data_15932 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15932 _Entry.Title ; Solution Structure of the Catalytic Domain of Procaspase-8 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-08-28 _Entry.Accession_date 2008-08-28 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.116 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'NMR solution structure of a 266 amino acid polypeptide. Residue numbering starts at 213. Coordinates of residues 213-223, 405-414, 447-463 are not defined' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Nadine Keller . . . 15932 2 Oliver Zerbe . . . 15932 3 Jiri Mares . . . 15932 4 Markus Gruetter . G. . 15932 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 15932 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID apoptosis . 15932 caspase . 15932 'initiator caspase' . 15932 NMR . 15932 procaspase . 15932 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15932 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 922 15932 '15N chemical shifts' 209 15932 '1H chemical shifts' 1346 15932 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 3 . . 2010-06-02 2008-08-28 update BMRB 'edit assembly name' 15932 2 . . 2009-03-23 2008-08-28 update BMRB 'complete entry citation' 15932 1 . . 2009-03-11 2008-08-28 original author 'original release' 15932 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2K7Z 'BMRB Entry Tracking System' 15932 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 15932 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19278658 _Citation.Full_citation . _Citation.Title 'Structural and Biochemical Studies on Procaspase-8: New Insights on Initiator Caspase Activation' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full . _Citation.Journal_volume 17 _Citation.Journal_issue 3 _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 438 _Citation.Page_last 448 _Citation.Year 2009 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Nadine Keller . . . 15932 1 2 Jiri Mares . . . 15932 1 3 Oliver Zerbe . . . 15932 1 4 Markus Gruetter . G. . 15932 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID activation 15932 1 apoptosis 15932 1 caspase-8 15932 1 initiator 15932 1 NMR 15932 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15932 _Assembly.ID 1 _Assembly.Name Procaspase-8 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 procaspase8 1 $procaspase8 A . yes native no no . . . 15932 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_procaspase8 _Entity.Sf_category entity _Entity.Sf_framecode procaspase8 _Entity.Entry_ID 15932 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name procaspase8 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MRGSESQTLDKVYQMKSKPR GYCLIINNHNFAKAREKVPK LHSIRDRNGTHLDAGALTTT FEELHFEIKPHDDCTVEQIY EILKIYQLMDHSNMDCFICC ILSHGDKGIIYGTDGQEAPI YELTSQFTGLKCPSLAGKPK VFFIQAAQGDNYQKGIPVET DSEEQPYLEMDLSSPQTRYI PDEADFLLGMATVNNCVSYR NPAEGTWYIQSLCQSLRERC PRGDDILTILTEVNYEVSNK DDKKNMGKQMPQPTFTLRKK LVFPSD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 266 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 24713.402 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1F9E . "Caspase-8 Specificity Probed At Subsite S4: Crystal Structure Of The Caspase-8-Z-Devd-Cho" . . . . . 57.52 153 98.69 98.69 1.29e-106 . . . . 15932 1 2 no PDB 1I4E . "Crystal Structure Of The Caspase-8/p35 Complex" . . . . . 96.99 258 99.22 99.22 0.00e+00 . . . . 15932 1 3 no PDB 1QDU . "Crystal Structure Of The Complex Of Caspase-8 With The Tripeptide Ketone Inhibitor Zevd-Dcbmk" . . . . . 57.52 153 98.69 98.69 1.29e-106 . . . . 15932 1 4 no PDB 1QTN . "Crystal Structure Of The Complex Of Caspase-8 With The Tetrapeptide Inhibitor Ace-Ietd-Aldehyde" . . . . . 59.40 164 99.37 99.37 3.88e-111 . . . . 15932 1 5 no PDB 2C2Z . "Crystal Structure Of Caspase-8 In Complex With Aza-Peptide Michael Acceptor Inhibitor" . . . . . 59.40 159 98.73 98.73 1.15e-110 . . . . 15932 1 6 no PDB 2FUN . "Alternative P35-Caspase-8 Complex" . . . . . 96.99 258 99.22 99.22 0.00e+00 . . . . 15932 1 7 no PDB 2K7Z . "Solution Structure Of The Catalytic Domain Of Procaspase-8" . . . . . 100.00 266 100.00 100.00 0.00e+00 . . . . 15932 1 8 no PDB 2Y1L . "Caspase-8 In Complex With Darpin-8.4" . . . . . 59.40 159 98.73 98.73 1.15e-110 . . . . 15932 1 9 no PDB 3H11 . "Zymogen Caspase-8:c-Flipl Protease Domain Complex" . . . . . 98.87 271 98.86 98.86 0.00e+00 . . . . 15932 1 10 no PDB 3KJN . "Caspase 8 Bound To A Covalent Inhibitor" . . . . . 59.40 164 99.37 99.37 3.88e-111 . . . . 15932 1 11 no PDB 3KJQ . "Caspase 8 With Covalent Inhibitor" . . . . . 59.40 164 99.37 99.37 3.88e-111 . . . . 15932 1 12 no PDB 4JJ7 . "Caspase-3 Specific Unnatural Amino Acid-based Peptides" . . . . . 98.87 275 99.62 99.62 0.00e+00 . . . . 15932 1 13 no PDB 4PRZ . "Caspase-8 Specific Unnatural Amino Acid Peptides" . . . . . 98.87 275 99.62 99.62 0.00e+00 . . . . 15932 1 14 no PDB 4PS1 . "Caspase-8 Specific Unnatural Amino Acid Peptides" . . . . . 98.87 275 99.62 99.62 0.00e+00 . . . . 15932 1 15 no DBJ BAB32555 . "caspase-8 [Homo sapiens]" . . . . . 98.87 496 99.24 99.24 0.00e+00 . . . . 15932 1 16 no DBJ BAG70096 . "caspase 8 isoform C precursor [Homo sapiens]" . . . . . 98.87 464 98.86 98.86 0.00e+00 . . . . 15932 1 17 no DBJ BAG70228 . "caspase 8 isoform C precursor [Homo sapiens]" . . . . . 98.87 464 98.86 98.86 0.00e+00 . . . . 15932 1 18 no EMBL CAA66853 . "MACH-alpha-1 [Homo sapiens]" . . . . . 98.87 479 99.62 99.62 0.00e+00 . . . . 15932 1 19 no EMBL CAA66854 . "MACH-alpha-2 [Homo sapiens]" . . . . . 98.87 464 99.62 99.62 0.00e+00 . . . . 15932 1 20 no EMBL CAA66855 . "MACH-alpha-3 [Homo sapiens]" . . . . . 79.70 266 99.53 99.53 6.93e-155 . . . . 15932 1 21 no GB AAB70913 . "apoptotic caspase Mch5-beta [Homo sapiens]" . . . . . 98.87 464 99.24 99.24 0.00e+00 . . . . 15932 1 22 no GB AAC50602 . "FADD-homologous ICE/CED-3-like protease [Homo sapiens]" . . . . . 98.87 479 99.24 99.24 0.00e+00 . . . . 15932 1 23 no GB AAC50645 . "apoptotic cysteine protease Mch5 isoform alpha [Homo sapiens]" . . . . . 98.87 496 99.24 99.24 0.00e+00 . . . . 15932 1 24 no GB AAD24962 . "caspase 8 [Homo sapiens]" . . . . . 98.87 479 98.86 99.24 0.00e+00 . . . . 15932 1 25 no GB AAL87628 . "procaspase-8L [Homo sapiens]" . . . . . 98.87 538 99.62 99.62 0.00e+00 . . . . 15932 1 26 no REF NP_001073593 . "caspase-8 isoform C precursor [Homo sapiens]" . . . . . 98.87 464 99.62 99.62 0.00e+00 . . . . 15932 1 27 no REF NP_001073594 . "caspase-8 isoform G precursor [Homo sapiens]" . . . . . 98.87 538 99.62 99.62 0.00e+00 . . . . 15932 1 28 no REF NP_001125222 . "caspase-8 [Pongo abelii]" . . . . . 98.87 496 98.48 99.24 0.00e+00 . . . . 15932 1 29 no REF NP_001219 . "caspase-8 isoform A precursor [Homo sapiens]" . . . . . 98.87 496 99.62 99.62 0.00e+00 . . . . 15932 1 30 no REF NP_203519 . "caspase-8 isoform B precursor [Homo sapiens]" . . . . . 98.87 479 99.62 99.62 0.00e+00 . . . . 15932 1 31 no SP Q14790 . "RecName: Full=Caspase-8; Short=CASP-8; AltName: Full=Apoptotic cysteine protease; AltName: Full=Apoptotic protease Mch-5; AltNa" . . . . . 98.87 479 99.62 99.62 0.00e+00 . . . . 15932 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 1 214 MET . 15932 1 2 215 ARG . 15932 1 3 216 GLY . 15932 1 4 217 SER . 15932 1 5 218 GLU . 15932 1 6 219 SER . 15932 1 7 220 GLN . 15932 1 8 221 THR . 15932 1 9 222 LEU . 15932 1 10 223 ASP . 15932 1 11 224 LYS . 15932 1 12 225 VAL . 15932 1 13 226 TYR . 15932 1 14 227 GLN . 15932 1 15 228 MET . 15932 1 16 229 LYS . 15932 1 17 230 SER . 15932 1 18 231 LYS . 15932 1 19 232 PRO . 15932 1 20 233 ARG . 15932 1 21 234 GLY . 15932 1 22 235 TYR . 15932 1 23 236 CYS . 15932 1 24 237 LEU . 15932 1 25 238 ILE . 15932 1 26 239 ILE . 15932 1 27 240 ASN . 15932 1 28 241 ASN . 15932 1 29 242 HIS . 15932 1 30 243 ASN . 15932 1 31 244 PHE . 15932 1 32 245 ALA . 15932 1 33 246 LYS . 15932 1 34 247 ALA . 15932 1 35 248 ARG . 15932 1 36 249 GLU . 15932 1 37 250 LYS . 15932 1 38 251 VAL . 15932 1 39 252 PRO . 15932 1 40 253 LYS . 15932 1 41 254 LEU . 15932 1 42 255 HIS . 15932 1 43 256 SER . 15932 1 44 257 ILE . 15932 1 45 258 ARG . 15932 1 46 259 ASP . 15932 1 47 260 ARG . 15932 1 48 261 ASN . 15932 1 49 262 GLY . 15932 1 50 263 THR . 15932 1 51 264 HIS . 15932 1 52 265 LEU . 15932 1 53 266 ASP . 15932 1 54 267 ALA . 15932 1 55 268 GLY . 15932 1 56 269 ALA . 15932 1 57 270 LEU . 15932 1 58 271 THR . 15932 1 59 272 THR . 15932 1 60 273 THR . 15932 1 61 274 PHE . 15932 1 62 275 GLU . 15932 1 63 276 GLU . 15932 1 64 277 LEU . 15932 1 65 278 HIS . 15932 1 66 279 PHE . 15932 1 67 280 GLU . 15932 1 68 281 ILE . 15932 1 69 282 LYS . 15932 1 70 283 PRO . 15932 1 71 284 HIS . 15932 1 72 285 ASP . 15932 1 73 286 ASP . 15932 1 74 287 CYS . 15932 1 75 288 THR . 15932 1 76 289 VAL . 15932 1 77 290 GLU . 15932 1 78 291 GLN . 15932 1 79 292 ILE . 15932 1 80 293 TYR . 15932 1 81 294 GLU . 15932 1 82 295 ILE . 15932 1 83 296 LEU . 15932 1 84 297 LYS . 15932 1 85 298 ILE . 15932 1 86 299 TYR . 15932 1 87 300 GLN . 15932 1 88 301 LEU . 15932 1 89 302 MET . 15932 1 90 303 ASP . 15932 1 91 304 HIS . 15932 1 92 305 SER . 15932 1 93 306 ASN . 15932 1 94 307 MET . 15932 1 95 308 ASP . 15932 1 96 309 CYS . 15932 1 97 310 PHE . 15932 1 98 311 ILE . 15932 1 99 312 CYS . 15932 1 100 313 CYS . 15932 1 101 314 ILE . 15932 1 102 315 LEU . 15932 1 103 316 SER . 15932 1 104 317 HIS . 15932 1 105 318 GLY . 15932 1 106 319 ASP . 15932 1 107 320 LYS . 15932 1 108 321 GLY . 15932 1 109 322 ILE . 15932 1 110 323 ILE . 15932 1 111 324 TYR . 15932 1 112 325 GLY . 15932 1 113 326 THR . 15932 1 114 327 ASP . 15932 1 115 328 GLY . 15932 1 116 329 GLN . 15932 1 117 330 GLU . 15932 1 118 331 ALA . 15932 1 119 332 PRO . 15932 1 120 333 ILE . 15932 1 121 334 TYR . 15932 1 122 335 GLU . 15932 1 123 336 LEU . 15932 1 124 337 THR . 15932 1 125 338 SER . 15932 1 126 339 GLN . 15932 1 127 340 PHE . 15932 1 128 341 THR . 15932 1 129 342 GLY . 15932 1 130 343 LEU . 15932 1 131 344 LYS . 15932 1 132 345 CYS . 15932 1 133 346 PRO . 15932 1 134 347 SER . 15932 1 135 348 LEU . 15932 1 136 349 ALA . 15932 1 137 350 GLY . 15932 1 138 351 LYS . 15932 1 139 352 PRO . 15932 1 140 353 LYS . 15932 1 141 354 VAL . 15932 1 142 355 PHE . 15932 1 143 356 PHE . 15932 1 144 357 ILE . 15932 1 145 358 GLN . 15932 1 146 359 ALA . 15932 1 147 360 ALA . 15932 1 148 361 GLN . 15932 1 149 362 GLY . 15932 1 150 363 ASP . 15932 1 151 364 ASN . 15932 1 152 365 TYR . 15932 1 153 366 GLN . 15932 1 154 367 LYS . 15932 1 155 368 GLY . 15932 1 156 369 ILE . 15932 1 157 370 PRO . 15932 1 158 371 VAL . 15932 1 159 372 GLU . 15932 1 160 373 THR . 15932 1 161 374 ASP . 15932 1 162 375 SER . 15932 1 163 376 GLU . 15932 1 164 377 GLU . 15932 1 165 378 GLN . 15932 1 166 379 PRO . 15932 1 167 380 TYR . 15932 1 168 381 LEU . 15932 1 169 382 GLU . 15932 1 170 383 MET . 15932 1 171 384 ASP . 15932 1 172 385 LEU . 15932 1 173 386 SER . 15932 1 174 387 SER . 15932 1 175 388 PRO . 15932 1 176 389 GLN . 15932 1 177 390 THR . 15932 1 178 391 ARG . 15932 1 179 392 TYR . 15932 1 180 393 ILE . 15932 1 181 394 PRO . 15932 1 182 395 ASP . 15932 1 183 396 GLU . 15932 1 184 397 ALA . 15932 1 185 398 ASP . 15932 1 186 399 PHE . 15932 1 187 400 LEU . 15932 1 188 401 LEU . 15932 1 189 402 GLY . 15932 1 190 403 MET . 15932 1 191 404 ALA . 15932 1 192 405 THR . 15932 1 193 406 VAL . 15932 1 194 407 ASN . 15932 1 195 408 ASN . 15932 1 196 409 CYS . 15932 1 197 410 VAL . 15932 1 198 411 SER . 15932 1 199 412 TYR . 15932 1 200 413 ARG . 15932 1 201 414 ASN . 15932 1 202 415 PRO . 15932 1 203 416 ALA . 15932 1 204 417 GLU . 15932 1 205 418 GLY . 15932 1 206 419 THR . 15932 1 207 420 TRP . 15932 1 208 421 TYR . 15932 1 209 422 ILE . 15932 1 210 423 GLN . 15932 1 211 424 SER . 15932 1 212 425 LEU . 15932 1 213 426 CYS . 15932 1 214 427 GLN . 15932 1 215 428 SER . 15932 1 216 429 LEU . 15932 1 217 430 ARG . 15932 1 218 431 GLU . 15932 1 219 432 ARG . 15932 1 220 433 CYS . 15932 1 221 434 PRO . 15932 1 222 435 ARG . 15932 1 223 436 GLY . 15932 1 224 437 ASP . 15932 1 225 438 ASP . 15932 1 226 439 ILE . 15932 1 227 440 LEU . 15932 1 228 441 THR . 15932 1 229 442 ILE . 15932 1 230 443 LEU . 15932 1 231 444 THR . 15932 1 232 445 GLU . 15932 1 233 446 VAL . 15932 1 234 447 ASN . 15932 1 235 448 TYR . 15932 1 236 449 GLU . 15932 1 237 450 VAL . 15932 1 238 451 SER . 15932 1 239 452 ASN . 15932 1 240 453 LYS . 15932 1 241 454 ASP . 15932 1 242 455 ASP . 15932 1 243 456 LYS . 15932 1 244 457 LYS . 15932 1 245 458 ASN . 15932 1 246 459 MET . 15932 1 247 460 GLY . 15932 1 248 461 LYS . 15932 1 249 462 GLN . 15932 1 250 463 MET . 15932 1 251 464 PRO . 15932 1 252 465 GLN . 15932 1 253 466 PRO . 15932 1 254 467 THR . 15932 1 255 468 PHE . 15932 1 256 469 THR . 15932 1 257 470 LEU . 15932 1 258 471 ARG . 15932 1 259 472 LYS . 15932 1 260 473 LYS . 15932 1 261 474 LEU . 15932 1 262 475 VAL . 15932 1 263 476 PHE . 15932 1 264 477 PRO . 15932 1 265 478 SER . 15932 1 266 479 ASP . 15932 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 15932 1 . ARG 2 2 15932 1 . GLY 3 3 15932 1 . SER 4 4 15932 1 . GLU 5 5 15932 1 . SER 6 6 15932 1 . GLN 7 7 15932 1 . THR 8 8 15932 1 . LEU 9 9 15932 1 . ASP 10 10 15932 1 . LYS 11 11 15932 1 . VAL 12 12 15932 1 . TYR 13 13 15932 1 . GLN 14 14 15932 1 . MET 15 15 15932 1 . LYS 16 16 15932 1 . SER 17 17 15932 1 . LYS 18 18 15932 1 . PRO 19 19 15932 1 . ARG 20 20 15932 1 . GLY 21 21 15932 1 . TYR 22 22 15932 1 . CYS 23 23 15932 1 . LEU 24 24 15932 1 . ILE 25 25 15932 1 . ILE 26 26 15932 1 . ASN 27 27 15932 1 . ASN 28 28 15932 1 . HIS 29 29 15932 1 . ASN 30 30 15932 1 . PHE 31 31 15932 1 . ALA 32 32 15932 1 . LYS 33 33 15932 1 . ALA 34 34 15932 1 . ARG 35 35 15932 1 . GLU 36 36 15932 1 . LYS 37 37 15932 1 . VAL 38 38 15932 1 . PRO 39 39 15932 1 . LYS 40 40 15932 1 . LEU 41 41 15932 1 . HIS 42 42 15932 1 . SER 43 43 15932 1 . ILE 44 44 15932 1 . ARG 45 45 15932 1 . ASP 46 46 15932 1 . ARG 47 47 15932 1 . ASN 48 48 15932 1 . GLY 49 49 15932 1 . THR 50 50 15932 1 . HIS 51 51 15932 1 . LEU 52 52 15932 1 . ASP 53 53 15932 1 . ALA 54 54 15932 1 . GLY 55 55 15932 1 . ALA 56 56 15932 1 . LEU 57 57 15932 1 . THR 58 58 15932 1 . THR 59 59 15932 1 . THR 60 60 15932 1 . PHE 61 61 15932 1 . GLU 62 62 15932 1 . GLU 63 63 15932 1 . LEU 64 64 15932 1 . HIS 65 65 15932 1 . PHE 66 66 15932 1 . GLU 67 67 15932 1 . ILE 68 68 15932 1 . LYS 69 69 15932 1 . PRO 70 70 15932 1 . HIS 71 71 15932 1 . ASP 72 72 15932 1 . ASP 73 73 15932 1 . CYS 74 74 15932 1 . THR 75 75 15932 1 . VAL 76 76 15932 1 . GLU 77 77 15932 1 . GLN 78 78 15932 1 . ILE 79 79 15932 1 . TYR 80 80 15932 1 . GLU 81 81 15932 1 . ILE 82 82 15932 1 . LEU 83 83 15932 1 . LYS 84 84 15932 1 . ILE 85 85 15932 1 . TYR 86 86 15932 1 . GLN 87 87 15932 1 . LEU 88 88 15932 1 . MET 89 89 15932 1 . ASP 90 90 15932 1 . HIS 91 91 15932 1 . SER 92 92 15932 1 . ASN 93 93 15932 1 . MET 94 94 15932 1 . ASP 95 95 15932 1 . CYS 96 96 15932 1 . PHE 97 97 15932 1 . ILE 98 98 15932 1 . CYS 99 99 15932 1 . CYS 100 100 15932 1 . ILE 101 101 15932 1 . LEU 102 102 15932 1 . SER 103 103 15932 1 . HIS 104 104 15932 1 . GLY 105 105 15932 1 . ASP 106 106 15932 1 . LYS 107 107 15932 1 . GLY 108 108 15932 1 . ILE 109 109 15932 1 . ILE 110 110 15932 1 . TYR 111 111 15932 1 . GLY 112 112 15932 1 . THR 113 113 15932 1 . ASP 114 114 15932 1 . GLY 115 115 15932 1 . GLN 116 116 15932 1 . GLU 117 117 15932 1 . ALA 118 118 15932 1 . PRO 119 119 15932 1 . ILE 120 120 15932 1 . TYR 121 121 15932 1 . GLU 122 122 15932 1 . LEU 123 123 15932 1 . THR 124 124 15932 1 . SER 125 125 15932 1 . GLN 126 126 15932 1 . PHE 127 127 15932 1 . THR 128 128 15932 1 . GLY 129 129 15932 1 . LEU 130 130 15932 1 . LYS 131 131 15932 1 . CYS 132 132 15932 1 . PRO 133 133 15932 1 . SER 134 134 15932 1 . LEU 135 135 15932 1 . ALA 136 136 15932 1 . GLY 137 137 15932 1 . LYS 138 138 15932 1 . PRO 139 139 15932 1 . LYS 140 140 15932 1 . VAL 141 141 15932 1 . PHE 142 142 15932 1 . PHE 143 143 15932 1 . ILE 144 144 15932 1 . GLN 145 145 15932 1 . ALA 146 146 15932 1 . ALA 147 147 15932 1 . GLN 148 148 15932 1 . GLY 149 149 15932 1 . ASP 150 150 15932 1 . ASN 151 151 15932 1 . TYR 152 152 15932 1 . GLN 153 153 15932 1 . LYS 154 154 15932 1 . GLY 155 155 15932 1 . ILE 156 156 15932 1 . PRO 157 157 15932 1 . VAL 158 158 15932 1 . GLU 159 159 15932 1 . THR 160 160 15932 1 . ASP 161 161 15932 1 . SER 162 162 15932 1 . GLU 163 163 15932 1 . GLU 164 164 15932 1 . GLN 165 165 15932 1 . PRO 166 166 15932 1 . TYR 167 167 15932 1 . LEU 168 168 15932 1 . GLU 169 169 15932 1 . MET 170 170 15932 1 . ASP 171 171 15932 1 . LEU 172 172 15932 1 . SER 173 173 15932 1 . SER 174 174 15932 1 . PRO 175 175 15932 1 . GLN 176 176 15932 1 . THR 177 177 15932 1 . ARG 178 178 15932 1 . TYR 179 179 15932 1 . ILE 180 180 15932 1 . PRO 181 181 15932 1 . ASP 182 182 15932 1 . GLU 183 183 15932 1 . ALA 184 184 15932 1 . ASP 185 185 15932 1 . PHE 186 186 15932 1 . LEU 187 187 15932 1 . LEU 188 188 15932 1 . GLY 189 189 15932 1 . MET 190 190 15932 1 . ALA 191 191 15932 1 . THR 192 192 15932 1 . VAL 193 193 15932 1 . ASN 194 194 15932 1 . ASN 195 195 15932 1 . CYS 196 196 15932 1 . VAL 197 197 15932 1 . SER 198 198 15932 1 . TYR 199 199 15932 1 . ARG 200 200 15932 1 . ASN 201 201 15932 1 . PRO 202 202 15932 1 . ALA 203 203 15932 1 . GLU 204 204 15932 1 . GLY 205 205 15932 1 . THR 206 206 15932 1 . TRP 207 207 15932 1 . TYR 208 208 15932 1 . ILE 209 209 15932 1 . GLN 210 210 15932 1 . SER 211 211 15932 1 . LEU 212 212 15932 1 . CYS 213 213 15932 1 . GLN 214 214 15932 1 . SER 215 215 15932 1 . LEU 216 216 15932 1 . ARG 217 217 15932 1 . GLU 218 218 15932 1 . ARG 219 219 15932 1 . CYS 220 220 15932 1 . PRO 221 221 15932 1 . ARG 222 222 15932 1 . GLY 223 223 15932 1 . ASP 224 224 15932 1 . ASP 225 225 15932 1 . ILE 226 226 15932 1 . LEU 227 227 15932 1 . THR 228 228 15932 1 . ILE 229 229 15932 1 . LEU 230 230 15932 1 . THR 231 231 15932 1 . GLU 232 232 15932 1 . VAL 233 233 15932 1 . ASN 234 234 15932 1 . TYR 235 235 15932 1 . GLU 236 236 15932 1 . VAL 237 237 15932 1 . SER 238 238 15932 1 . ASN 239 239 15932 1 . LYS 240 240 15932 1 . ASP 241 241 15932 1 . ASP 242 242 15932 1 . LYS 243 243 15932 1 . LYS 244 244 15932 1 . ASN 245 245 15932 1 . MET 246 246 15932 1 . GLY 247 247 15932 1 . LYS 248 248 15932 1 . GLN 249 249 15932 1 . MET 250 250 15932 1 . PRO 251 251 15932 1 . GLN 252 252 15932 1 . PRO 253 253 15932 1 . THR 254 254 15932 1 . PHE 255 255 15932 1 . THR 256 256 15932 1 . LEU 257 257 15932 1 . ARG 258 258 15932 1 . LYS 259 259 15932 1 . LYS 260 260 15932 1 . LEU 261 261 15932 1 . VAL 262 262 15932 1 . PHE 263 263 15932 1 . PRO 264 264 15932 1 . SER 265 265 15932 1 . ASP 266 266 15932 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15932 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $procaspase8 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 15932 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 15932 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $procaspase8 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pQE-50 . . . . . . 15932 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15932 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C,15N labelled PC8' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 procaspase8 '[U-99% 13C; U-99% 15N]' . . 1 $procaspase8 . . 0.8 . . mM . . . . 15932 1 2 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 15932 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15932 1 4 TRIS [U-2H] . . . . . . 20 . . mM . . . . 15932 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15932 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 15932 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15932 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '2H, 13C,15N labelled PC8' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 procaspase8 '[U-100% 13C; U-100% 15N; 80% 2H]' . . 1 $procaspase8 . . 0.8 . . mM . . . . 15932 2 2 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 15932 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 15932 2 4 TRIS [U-2H] . . . . . . 20 . . mM . . . . 15932 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 15932 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 15932 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 15932 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 15932 1 pH 8.0 . pH 15932 1 pressure 1 . atm 15932 1 temperature 305 . K 15932 1 stop_ save_ ############################ # Computer software used # ############################ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 15932 _Software.ID 1 _Software.Name AMBER _Software.Version 6.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 15932 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 15932 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 15932 _Software.ID 2 _Software.Name CYANA _Software.Version 2.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 15932 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 15932 2 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 15932 _Software.ID 3 _Software.Name XEASY _Software.Version 1.55 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 15932 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15932 3 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 15932 _Software.ID 4 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller, W thrich' . . 15932 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15932 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 15932 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15932 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15932 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 15932 1 2 spectrometer_2 Bruker Avance . 600 . . . 15932 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15932 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 3 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 4 '3D HN(CO)CACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 5 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 6 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 7 '3D HN(CO)CG' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 8 '3D HNCG' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 9 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15932 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15932 1 12 HN(CACO)NH no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15932 1 14 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15932 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15932 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details 'referencing of 1H chemical shifts relative to the water frequency at 4.682 ppm at 305K and 13C and 15N using the conversion factors of the BMRB' loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.682 na indirect 0.251449530 . . . . . . . . . 15932 1 H 1 water protons . . . . ppm 4.682 internal direct 1.0 . . . . . . . . . 15932 1 N 15 water protons . . . . ppm 4.682 na indirect 0.101329118 . . . . . . . . . 15932 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15932 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 11 '3D 1H-13C NOESY' . . . 15932 1 14 '3D 1H-15N NOESY' . . . 15932 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 4 $CARA . . 15932 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 11 11 LYS HA H 1 4.384 0.020 . 1 . . . . 224 LYS HA . 15932 1 2 . 1 1 11 11 LYS HB2 H 1 1.851 0.020 . 2 . . . . 224 LYS HB2 . 15932 1 3 . 1 1 11 11 LYS HB3 H 1 1.763 0.020 . 2 . . . . 224 LYS HB3 . 15932 1 4 . 1 1 11 11 LYS HD2 H 1 1.333 0.020 . 2 . . . . 224 LYS HD2 . 15932 1 5 . 1 1 11 11 LYS HD3 H 1 2.145 0.020 . 2 . . . . 224 LYS HD3 . 15932 1 6 . 1 1 11 11 LYS HE2 H 1 2.954 0.020 . 2 . . . . 224 LYS HE2 . 15932 1 7 . 1 1 11 11 LYS HE3 H 1 2.871 0.020 . 2 . . . . 224 LYS HE3 . 15932 1 8 . 1 1 11 11 LYS HG2 H 1 1.444 0.020 . 2 . . . . 224 LYS HG2 . 15932 1 9 . 1 1 11 11 LYS HG3 H 1 1.372 0.020 . 2 . . . . 224 LYS HG3 . 15932 1 10 . 1 1 11 11 LYS C C 13 175.395 0.400 . 1 . . . . 224 LYS C . 15932 1 11 . 1 1 11 11 LYS CA C 13 56.001 0.400 . 1 . . . . 224 LYS CA . 15932 1 12 . 1 1 11 11 LYS CB C 13 33.797 0.400 . 1 . . . . 224 LYS CB . 15932 1 13 . 1 1 11 11 LYS CD C 13 28.876 0.400 . 1 . . . . 224 LYS CD . 15932 1 14 . 1 1 11 11 LYS CE C 13 41.893 0.400 . 1 . . . . 224 LYS CE . 15932 1 15 . 1 1 11 11 LYS CG C 13 24.828 0.400 . 1 . . . . 224 LYS CG . 15932 1 16 . 1 1 11 11 LYS N N 15 118.252 0.400 . 1 . . . . 224 LYS N . 15932 1 17 . 1 1 12 12 VAL H H 1 7.819 0.020 . 1 . . . . 225 VAL H . 15932 1 18 . 1 1 12 12 VAL HA H 1 4.946 0.020 . 1 . . . . 225 VAL HA . 15932 1 19 . 1 1 12 12 VAL HB H 1 1.988 0.020 . 1 . . . . 225 VAL HB . 15932 1 20 . 1 1 12 12 VAL HG11 H 1 0.819 0.020 . 2 . . . . 225 VAL HG11 . 15932 1 21 . 1 1 12 12 VAL HG12 H 1 0.819 0.020 . 2 . . . . 225 VAL HG12 . 15932 1 22 . 1 1 12 12 VAL HG13 H 1 0.819 0.020 . 2 . . . . 225 VAL HG13 . 15932 1 23 . 1 1 12 12 VAL HG21 H 1 0.930 0.020 . 2 . . . . 225 VAL HG21 . 15932 1 24 . 1 1 12 12 VAL HG22 H 1 0.930 0.020 . 2 . . . . 225 VAL HG22 . 15932 1 25 . 1 1 12 12 VAL HG23 H 1 0.930 0.020 . 2 . . . . 225 VAL HG23 . 15932 1 26 . 1 1 12 12 VAL C C 13 175.898 0.400 . 1 . . . . 225 VAL C . 15932 1 27 . 1 1 12 12 VAL CA C 13 59.650 0.400 . 1 . . . . 225 VAL CA . 15932 1 28 . 1 1 12 12 VAL CB C 13 35.296 0.400 . 1 . . . . 225 VAL CB . 15932 1 29 . 1 1 12 12 VAL CG1 C 13 20.253 0.400 . 1 . . . . 225 VAL CG1 . 15932 1 30 . 1 1 12 12 VAL CG2 C 13 21.319 0.400 . 1 . . . . 225 VAL CG2 . 15932 1 31 . 1 1 12 12 VAL N N 15 117.637 0.400 . 1 . . . . 225 VAL N . 15932 1 32 . 1 1 13 13 TYR H H 1 8.318 0.020 . 1 . . . . 226 TYR H . 15932 1 33 . 1 1 13 13 TYR HA H 1 4.291 0.020 . 1 . . . . 226 TYR HA . 15932 1 34 . 1 1 13 13 TYR HB2 H 1 3.099 0.020 . 2 . . . . 226 TYR HB2 . 15932 1 35 . 1 1 13 13 TYR HB3 H 1 3.000 0.020 . 2 . . . . 226 TYR HB3 . 15932 1 36 . 1 1 13 13 TYR C C 13 176.911 0.400 . 1 . . . . 226 TYR C . 15932 1 37 . 1 1 13 13 TYR CA C 13 60.063 0.400 . 1 . . . . 226 TYR CA . 15932 1 38 . 1 1 13 13 TYR CB C 13 37.843 0.400 . 1 . . . . 226 TYR CB . 15932 1 39 . 1 1 13 13 TYR N N 15 122.976 0.400 . 1 . . . . 226 TYR N . 15932 1 40 . 1 1 14 14 GLN H H 1 9.128 0.020 . 1 . . . . 227 GLN H . 15932 1 41 . 1 1 14 14 GLN HA H 1 3.996 0.020 . 1 . . . . 227 GLN HA . 15932 1 42 . 1 1 14 14 GLN HB2 H 1 2.188 0.020 . 1 . . . . 227 GLN HB2 . 15932 1 43 . 1 1 14 14 GLN HB3 H 1 2.188 0.020 . 1 . . . . 227 GLN HB3 . 15932 1 44 . 1 1 14 14 GLN HG2 H 1 2.463 0.020 . 2 . . . . 227 GLN HG2 . 15932 1 45 . 1 1 14 14 GLN HG3 H 1 2.174 0.020 . 2 . . . . 227 GLN HG3 . 15932 1 46 . 1 1 14 14 GLN C C 13 175.052 0.400 . 1 . . . . 227 GLN C . 15932 1 47 . 1 1 14 14 GLN CA C 13 57.421 0.400 . 1 . . . . 227 GLN CA . 15932 1 48 . 1 1 14 14 GLN CB C 13 29.550 0.400 . 1 . . . . 227 GLN CB . 15932 1 49 . 1 1 14 14 GLN CG C 13 34.547 0.400 . 1 . . . . 227 GLN CG . 15932 1 50 . 1 1 14 14 GLN N N 15 124.676 0.400 . 1 . . . . 227 GLN N . 15932 1 51 . 1 1 15 15 MET H H 1 8.465 0.020 . 1 . . . . 228 MET H . 15932 1 52 . 1 1 15 15 MET HA H 1 5.210 0.020 . 1 . . . . 228 MET HA . 15932 1 53 . 1 1 15 15 MET HB2 H 1 2.131 0.020 . 1 . . . . 228 MET HB2 . 15932 1 54 . 1 1 15 15 MET HB3 H 1 2.131 0.020 . 1 . . . . 228 MET HB3 . 15932 1 55 . 1 1 15 15 MET HE1 H 1 2.176 0.020 . 1 . . . . 228 MET HE1 . 15932 1 56 . 1 1 15 15 MET HE2 H 1 2.176 0.020 . 1 . . . . 228 MET HE2 . 15932 1 57 . 1 1 15 15 MET HE3 H 1 2.176 0.020 . 1 . . . . 228 MET HE3 . 15932 1 58 . 1 1 15 15 MET HG2 H 1 2.662 0.020 . 2 . . . . 228 MET HG2 . 15932 1 59 . 1 1 15 15 MET HG3 H 1 3.341 0.020 . 2 . . . . 228 MET HG3 . 15932 1 60 . 1 1 15 15 MET C C 13 172.979 0.400 . 1 . . . . 228 MET C . 15932 1 61 . 1 1 15 15 MET CA C 13 52.955 0.400 . 1 . . . . 228 MET CA . 15932 1 62 . 1 1 15 15 MET CB C 13 30.751 0.400 . 1 . . . . 228 MET CB . 15932 1 63 . 1 1 15 15 MET CE C 13 16.792 0.400 . 1 . . . . 228 MET CE . 15932 1 64 . 1 1 15 15 MET CG C 13 32.529 0.400 . 1 . . . . 228 MET CG . 15932 1 65 . 1 1 15 15 MET N N 15 128.835 0.400 . 1 . . . . 228 MET N . 15932 1 66 . 1 1 16 16 LYS H H 1 9.119 0.020 . 1 . . . . 229 LYS H . 15932 1 67 . 1 1 16 16 LYS HA H 1 4.558 0.020 . 1 . . . . 229 LYS HA . 15932 1 68 . 1 1 16 16 LYS HB2 H 1 1.747 0.020 . 1 . . . . 229 LYS HB2 . 15932 1 69 . 1 1 16 16 LYS HB3 H 1 1.747 0.020 . 1 . . . . 229 LYS HB3 . 15932 1 70 . 1 1 16 16 LYS HD2 H 1 1.637 0.020 . 1 . . . . 229 LYS HD2 . 15932 1 71 . 1 1 16 16 LYS HD3 H 1 1.637 0.020 . 1 . . . . 229 LYS HD3 . 15932 1 72 . 1 1 16 16 LYS HE2 H 1 2.915 0.020 . 1 . . . . 229 LYS HE2 . 15932 1 73 . 1 1 16 16 LYS HE3 H 1 2.915 0.020 . 1 . . . . 229 LYS HE3 . 15932 1 74 . 1 1 16 16 LYS HG2 H 1 1.346 0.020 . 1 . . . . 229 LYS HG2 . 15932 1 75 . 1 1 16 16 LYS HG3 H 1 1.346 0.020 . 1 . . . . 229 LYS HG3 . 15932 1 76 . 1 1 16 16 LYS C C 13 176.209 0.400 . 1 . . . . 229 LYS C . 15932 1 77 . 1 1 16 16 LYS CA C 13 55.916 0.400 . 1 . . . . 229 LYS CA . 15932 1 78 . 1 1 16 16 LYS CB C 13 35.555 0.400 . 1 . . . . 229 LYS CB . 15932 1 79 . 1 1 16 16 LYS CD C 13 28.995 0.400 . 1 . . . . 229 LYS CD . 15932 1 80 . 1 1 16 16 LYS CE C 13 41.852 0.400 . 1 . . . . 229 LYS CE . 15932 1 81 . 1 1 16 16 LYS CG C 13 24.244 0.400 . 1 . . . . 229 LYS CG . 15932 1 82 . 1 1 16 16 LYS N N 15 120.235 0.400 . 1 . . . . 229 LYS N . 15932 1 83 . 1 1 17 17 SER H H 1 9.101 0.020 . 1 . . . . 230 SER H . 15932 1 84 . 1 1 17 17 SER HA H 1 4.077 0.020 . 1 . . . . 230 SER HA . 15932 1 85 . 1 1 17 17 SER HB2 H 1 3.708 0.020 . 2 . . . . 230 SER HB2 . 15932 1 86 . 1 1 17 17 SER HB3 H 1 3.944 0.020 . 2 . . . . 230 SER HB3 . 15932 1 87 . 1 1 17 17 SER C C 13 172.995 0.400 . 1 . . . . 230 SER C . 15932 1 88 . 1 1 17 17 SER CA C 13 59.615 0.400 . 1 . . . . 230 SER CA . 15932 1 89 . 1 1 17 17 SER CB C 13 64.482 0.400 . 1 . . . . 230 SER CB . 15932 1 90 . 1 1 17 17 SER N N 15 121.500 0.400 . 1 . . . . 230 SER N . 15932 1 91 . 1 1 18 18 LYS H H 1 8.120 0.020 . 1 . . . . 231 LYS H . 15932 1 92 . 1 1 18 18 LYS HA H 1 4.373 0.020 . 1 . . . . 231 LYS HA . 15932 1 93 . 1 1 18 18 LYS HB2 H 1 1.568 0.020 . 1 . . . . 231 LYS HB2 . 15932 1 94 . 1 1 18 18 LYS HB3 H 1 1.568 0.020 . 1 . . . . 231 LYS HB3 . 15932 1 95 . 1 1 18 18 LYS HD2 H 1 1.336 0.020 . 1 . . . . 231 LYS HD2 . 15932 1 96 . 1 1 18 18 LYS HD3 H 1 1.336 0.020 . 1 . . . . 231 LYS HD3 . 15932 1 97 . 1 1 18 18 LYS HE2 H 1 2.421 0.020 . 2 . . . . 231 LYS HE2 . 15932 1 98 . 1 1 18 18 LYS HE3 H 1 2.155 0.020 . 2 . . . . 231 LYS HE3 . 15932 1 99 . 1 1 18 18 LYS HG2 H 1 1.185 0.020 . 2 . . . . 231 LYS HG2 . 15932 1 100 . 1 1 18 18 LYS HG3 H 1 0.932 0.020 . 2 . . . . 231 LYS HG3 . 15932 1 101 . 1 1 18 18 LYS C C 13 173.565 0.400 . 1 . . . . 231 LYS C . 15932 1 102 . 1 1 18 18 LYS CA C 13 53.231 0.400 . 1 . . . . 231 LYS CA . 15932 1 103 . 1 1 18 18 LYS CB C 13 34.596 0.400 . 1 . . . . 231 LYS CB . 15932 1 104 . 1 1 18 18 LYS CD C 13 28.951 0.400 . 1 . . . . 231 LYS CD . 15932 1 105 . 1 1 18 18 LYS CE C 13 41.211 0.400 . 1 . . . . 231 LYS CE . 15932 1 106 . 1 1 18 18 LYS CG C 13 25.324 0.400 . 1 . . . . 231 LYS CG . 15932 1 107 . 1 1 18 18 LYS N N 15 120.561 0.400 . 1 . . . . 231 LYS N . 15932 1 108 . 1 1 19 19 PRO HA H 1 4.898 0.020 . 1 . . . . 232 PRO HA . 15932 1 109 . 1 1 19 19 PRO HB2 H 1 1.750 0.020 . 2 . . . . 232 PRO HB2 . 15932 1 110 . 1 1 19 19 PRO HB3 H 1 2.350 0.020 . 2 . . . . 232 PRO HB3 . 15932 1 111 . 1 1 19 19 PRO HD2 H 1 3.474 0.020 . 1 . . . . 232 PRO HD2 . 15932 1 112 . 1 1 19 19 PRO HD3 H 1 3.474 0.020 . 1 . . . . 232 PRO HD3 . 15932 1 113 . 1 1 19 19 PRO HG2 H 1 1.892 0.020 . 1 . . . . 232 PRO HG2 . 15932 1 114 . 1 1 19 19 PRO HG3 H 1 1.892 0.020 . 1 . . . . 232 PRO HG3 . 15932 1 115 . 1 1 19 19 PRO C C 13 176.162 0.400 . 1 . . . . 232 PRO C . 15932 1 116 . 1 1 19 19 PRO CA C 13 62.838 0.400 . 1 . . . . 232 PRO CA . 15932 1 117 . 1 1 19 19 PRO CB C 13 34.997 0.400 . 1 . . . . 232 PRO CB . 15932 1 118 . 1 1 19 19 PRO CD C 13 50.072 0.400 . 1 . . . . 232 PRO CD . 15932 1 119 . 1 1 19 19 PRO CG C 13 24.687 0.400 . 1 . . . . 232 PRO CG . 15932 1 120 . 1 1 20 20 ARG H H 1 8.782 0.020 . 1 . . . . 233 ARG H . 15932 1 121 . 1 1 20 20 ARG HA H 1 3.651 0.020 . 1 . . . . 233 ARG HA . 15932 1 122 . 1 1 20 20 ARG C C 13 175.210 0.400 . 1 . . . . 233 ARG C . 15932 1 123 . 1 1 20 20 ARG CA C 13 56.621 0.400 . 1 . . . . 233 ARG CA . 15932 1 124 . 1 1 20 20 ARG CB C 13 30.581 0.400 . 1 . . . . 233 ARG CB . 15932 1 125 . 1 1 20 20 ARG CD C 13 44.111 0.400 . 1 . . . . 233 ARG CD . 15932 1 126 . 1 1 20 20 ARG CG C 13 27.237 0.400 . 1 . . . . 233 ARG CG . 15932 1 127 . 1 1 20 20 ARG N N 15 118.785 0.400 . 1 . . . . 233 ARG N . 15932 1 128 . 1 1 21 21 GLY H H 1 6.490 0.020 . 1 . . . . 234 GLY H . 15932 1 129 . 1 1 21 21 GLY HA2 H 1 4.312 0.020 . 2 . . . . 234 GLY HA2 . 15932 1 130 . 1 1 21 21 GLY HA3 H 1 4.662 0.020 . 2 . . . . 234 GLY HA3 . 15932 1 131 . 1 1 21 21 GLY C C 13 172.012 0.400 . 1 . . . . 234 GLY C . 15932 1 132 . 1 1 21 21 GLY CA C 13 43.743 0.400 . 1 . . . . 234 GLY CA . 15932 1 133 . 1 1 21 21 GLY N N 15 128.529 0.400 . 1 . . . . 234 GLY N . 15932 1 134 . 1 1 22 22 TYR H H 1 9.327 0.020 . 1 . . . . 235 TYR H . 15932 1 135 . 1 1 22 22 TYR HA H 1 5.260 0.020 . 1 . . . . 235 TYR HA . 15932 1 136 . 1 1 22 22 TYR HB2 H 1 2.922 0.020 . 1 . . . . 235 TYR HB2 . 15932 1 137 . 1 1 22 22 TYR HB3 H 1 2.922 0.020 . 1 . . . . 235 TYR HB3 . 15932 1 138 . 1 1 22 22 TYR HD1 H 1 7.313 0.020 . 1 . . . . 235 TYR HD1 . 15932 1 139 . 1 1 22 22 TYR HE1 H 1 6.672 0.020 . 1 . . . . 235 TYR HE1 . 15932 1 140 . 1 1 22 22 TYR C C 13 173.931 0.400 . 1 . . . . 235 TYR C . 15932 1 141 . 1 1 22 22 TYR CA C 13 58.287 0.400 . 1 . . . . 235 TYR CA . 15932 1 142 . 1 1 22 22 TYR CB C 13 39.762 0.400 . 1 . . . . 235 TYR CB . 15932 1 143 . 1 1 22 22 TYR CD1 C 13 132.546 0.400 . 1 . . . . 235 TYR CD1 . 15932 1 144 . 1 1 22 22 TYR CE1 C 13 118.400 0.400 . 1 . . . . 235 TYR CE1 . 15932 1 145 . 1 1 22 22 TYR N N 15 119.429 0.400 . 1 . . . . 235 TYR N . 15932 1 146 . 1 1 23 23 CYS H H 1 8.665 0.020 . 1 . . . . 236 CYS H . 15932 1 147 . 1 1 23 23 CYS HA H 1 4.928 0.020 . 1 . . . . 236 CYS HA . 15932 1 148 . 1 1 23 23 CYS C C 13 172.970 0.400 . 1 . . . . 236 CYS C . 15932 1 149 . 1 1 23 23 CYS CA C 13 55.636 0.400 . 1 . . . . 236 CYS CA . 15932 1 150 . 1 1 23 23 CYS CB C 13 50.040 0.400 . 1 . . . . 236 CYS CB . 15932 1 151 . 1 1 23 23 CYS N N 15 120.485 0.400 . 1 . . . . 236 CYS N . 15932 1 152 . 1 1 24 24 LEU H H 1 8.619 0.020 . 1 . . . . 237 LEU H . 15932 1 153 . 1 1 24 24 LEU HA H 1 4.691 0.020 . 1 . . . . 237 LEU HA . 15932 1 154 . 1 1 24 24 LEU HB2 H 1 1.223 0.020 . 2 . . . . 237 LEU HB2 . 15932 1 155 . 1 1 24 24 LEU HB3 H 1 1.357 0.020 . 2 . . . . 237 LEU HB3 . 15932 1 156 . 1 1 24 24 LEU HD11 H 1 0.607 0.020 . 2 . . . . 237 LEU HD11 . 15932 1 157 . 1 1 24 24 LEU HD12 H 1 0.607 0.020 . 2 . . . . 237 LEU HD12 . 15932 1 158 . 1 1 24 24 LEU HD13 H 1 0.607 0.020 . 2 . . . . 237 LEU HD13 . 15932 1 159 . 1 1 24 24 LEU HD21 H 1 0.452 0.020 . 2 . . . . 237 LEU HD21 . 15932 1 160 . 1 1 24 24 LEU HD22 H 1 0.452 0.020 . 2 . . . . 237 LEU HD22 . 15932 1 161 . 1 1 24 24 LEU HD23 H 1 0.452 0.020 . 2 . . . . 237 LEU HD23 . 15932 1 162 . 1 1 24 24 LEU HG H 1 1.344 0.020 . 1 . . . . 237 LEU HG . 15932 1 163 . 1 1 24 24 LEU C C 13 175.850 0.400 . 1 . . . . 237 LEU C . 15932 1 164 . 1 1 24 24 LEU CA C 13 54.053 0.400 . 1 . . . . 237 LEU CA . 15932 1 165 . 1 1 24 24 LEU CB C 13 44.117 0.400 . 1 . . . . 237 LEU CB . 15932 1 166 . 1 1 24 24 LEU CD1 C 13 24.744 0.400 . 1 . . . . 237 LEU CD1 . 15932 1 167 . 1 1 24 24 LEU CD2 C 13 24.835 0.400 . 1 . . . . 237 LEU CD2 . 15932 1 168 . 1 1 24 24 LEU CG C 13 27.756 0.400 . 1 . . . . 237 LEU CG . 15932 1 169 . 1 1 24 24 LEU N N 15 129.465 0.400 . 1 . . . . 237 LEU N . 15932 1 170 . 1 1 25 25 ILE H H 1 8.304 0.020 . 1 . . . . 238 ILE H . 15932 1 171 . 1 1 25 25 ILE HA H 1 4.639 0.020 . 1 . . . . 238 ILE HA . 15932 1 172 . 1 1 25 25 ILE HB H 1 1.461 0.020 . 1 . . . . 238 ILE HB . 15932 1 173 . 1 1 25 25 ILE HD11 H 1 0.712 0.020 . 1 . . . . 238 ILE HD11 . 15932 1 174 . 1 1 25 25 ILE HD12 H 1 0.712 0.020 . 1 . . . . 238 ILE HD12 . 15932 1 175 . 1 1 25 25 ILE HD13 H 1 0.712 0.020 . 1 . . . . 238 ILE HD13 . 15932 1 176 . 1 1 25 25 ILE HG21 H 1 0.646 0.020 . 1 . . . . 238 ILE HG21 . 15932 1 177 . 1 1 25 25 ILE HG22 H 1 0.646 0.020 . 1 . . . . 238 ILE HG22 . 15932 1 178 . 1 1 25 25 ILE HG23 H 1 0.646 0.020 . 1 . . . . 238 ILE HG23 . 15932 1 179 . 1 1 25 25 ILE C C 13 174.032 0.400 . 1 . . . . 238 ILE C . 15932 1 180 . 1 1 25 25 ILE CA C 13 60.879 0.400 . 1 . . . . 238 ILE CA . 15932 1 181 . 1 1 25 25 ILE CB C 13 41.165 0.400 . 1 . . . . 238 ILE CB . 15932 1 182 . 1 1 25 25 ILE CD1 C 13 15.565 0.400 . 1 . . . . 238 ILE CD1 . 15932 1 183 . 1 1 25 25 ILE CG1 C 13 27.367 0.400 . 1 . . . . 238 ILE CG1 . 15932 1 184 . 1 1 25 25 ILE CG2 C 13 16.922 0.400 . 1 . . . . 238 ILE CG2 . 15932 1 185 . 1 1 25 25 ILE N N 15 122.597 0.400 . 1 . . . . 238 ILE N . 15932 1 186 . 1 1 26 26 ILE H H 1 9.025 0.020 . 1 . . . . 239 ILE H . 15932 1 187 . 1 1 26 26 ILE HA H 1 4.778 0.020 . 1 . . . . 239 ILE HA . 15932 1 188 . 1 1 26 26 ILE HB H 1 1.938 0.020 . 1 . . . . 239 ILE HB . 15932 1 189 . 1 1 26 26 ILE HD11 H 1 0.743 0.020 . 1 . . . . 239 ILE HD11 . 15932 1 190 . 1 1 26 26 ILE HD12 H 1 0.743 0.020 . 1 . . . . 239 ILE HD12 . 15932 1 191 . 1 1 26 26 ILE HD13 H 1 0.743 0.020 . 1 . . . . 239 ILE HD13 . 15932 1 192 . 1 1 26 26 ILE HG12 H 1 1.454 0.020 . 2 . . . . 239 ILE HG12 . 15932 1 193 . 1 1 26 26 ILE HG13 H 1 1.126 0.020 . 2 . . . . 239 ILE HG13 . 15932 1 194 . 1 1 26 26 ILE HG21 H 1 0.824 0.020 . 1 . . . . 239 ILE HG21 . 15932 1 195 . 1 1 26 26 ILE HG22 H 1 0.824 0.020 . 1 . . . . 239 ILE HG22 . 15932 1 196 . 1 1 26 26 ILE HG23 H 1 0.824 0.020 . 1 . . . . 239 ILE HG23 . 15932 1 197 . 1 1 26 26 ILE C C 13 173.104 0.400 . 1 . . . . 239 ILE C . 15932 1 198 . 1 1 26 26 ILE CA C 13 60.733 0.400 . 1 . . . . 239 ILE CA . 15932 1 199 . 1 1 26 26 ILE CB C 13 38.237 0.400 . 1 . . . . 239 ILE CB . 15932 1 200 . 1 1 26 26 ILE CD1 C 13 13.001 0.400 . 1 . . . . 239 ILE CD1 . 15932 1 201 . 1 1 26 26 ILE CG1 C 13 27.723 0.400 . 1 . . . . 239 ILE CG1 . 15932 1 202 . 1 1 26 26 ILE CG2 C 13 16.413 0.400 . 1 . . . . 239 ILE CG2 . 15932 1 203 . 1 1 26 26 ILE N N 15 129.303 0.400 . 1 . . . . 239 ILE N . 15932 1 204 . 1 1 27 27 ASN H H 1 8.957 0.020 . 1 . . . . 240 ASN H . 15932 1 205 . 1 1 27 27 ASN HA H 1 5.174 0.020 . 1 . . . . 240 ASN HA . 15932 1 206 . 1 1 27 27 ASN HB2 H 1 2.084 0.020 . 2 . . . . 240 ASN HB2 . 15932 1 207 . 1 1 27 27 ASN HB3 H 1 3.512 0.020 . 2 . . . . 240 ASN HB3 . 15932 1 208 . 1 1 27 27 ASN C C 13 172.948 0.400 . 1 . . . . 240 ASN C . 15932 1 209 . 1 1 27 27 ASN CA C 13 52.055 0.400 . 1 . . . . 240 ASN CA . 15932 1 210 . 1 1 27 27 ASN CB C 13 40.530 0.400 . 1 . . . . 240 ASN CB . 15932 1 211 . 1 1 27 27 ASN N N 15 125.494 0.400 . 1 . . . . 240 ASN N . 15932 1 212 . 1 1 28 28 ASN H H 1 9.118 0.020 . 1 . . . . 241 ASN H . 15932 1 213 . 1 1 28 28 ASN HA H 1 5.106 0.020 . 1 . . . . 241 ASN HA . 15932 1 214 . 1 1 28 28 ASN HB2 H 1 2.549 0.020 . 2 . . . . 241 ASN HB2 . 15932 1 215 . 1 1 28 28 ASN HB3 H 1 3.764 0.020 . 2 . . . . 241 ASN HB3 . 15932 1 216 . 1 1 28 28 ASN C C 13 172.184 0.400 . 1 . . . . 241 ASN C . 15932 1 217 . 1 1 28 28 ASN CA C 13 52.599 0.400 . 1 . . . . 241 ASN CA . 15932 1 218 . 1 1 28 28 ASN CB C 13 38.296 0.400 . 1 . . . . 241 ASN CB . 15932 1 219 . 1 1 28 28 ASN N N 15 125.089 0.400 . 1 . . . . 241 ASN N . 15932 1 220 . 1 1 29 29 HIS H H 1 9.512 0.020 . 1 . . . . 242 HIS H . 15932 1 221 . 1 1 29 29 HIS HA H 1 4.384 0.020 . 1 . . . . 242 HIS HA . 15932 1 222 . 1 1 29 29 HIS HB2 H 1 2.791 0.020 . 1 . . . . 242 HIS HB2 . 15932 1 223 . 1 1 29 29 HIS HB3 H 1 2.791 0.020 . 1 . . . . 242 HIS HB3 . 15932 1 224 . 1 1 29 29 HIS C C 13 173.519 0.400 . 1 . . . . 242 HIS C . 15932 1 225 . 1 1 29 29 HIS CA C 13 59.174 0.400 . 1 . . . . 242 HIS CA . 15932 1 226 . 1 1 29 29 HIS CB C 13 28.022 0.400 . 1 . . . . 242 HIS CB . 15932 1 227 . 1 1 29 29 HIS N N 15 125.634 0.400 . 1 . . . . 242 HIS N . 15932 1 228 . 1 1 30 30 ASN H H 1 8.623 0.020 . 1 . . . . 243 ASN H . 15932 1 229 . 1 1 30 30 ASN HA H 1 4.148 0.020 . 1 . . . . 243 ASN HA . 15932 1 230 . 1 1 30 30 ASN HB2 H 1 2.940 0.020 . 1 . . . . 243 ASN HB2 . 15932 1 231 . 1 1 30 30 ASN HB3 H 1 2.940 0.020 . 1 . . . . 243 ASN HB3 . 15932 1 232 . 1 1 30 30 ASN HD21 H 1 7.635 0.020 . 2 . . . . 243 ASN HD21 . 15932 1 233 . 1 1 30 30 ASN HD22 H 1 6.494 0.020 . 2 . . . . 243 ASN HD22 . 15932 1 234 . 1 1 30 30 ASN C C 13 175.052 0.400 . 1 . . . . 243 ASN C . 15932 1 235 . 1 1 30 30 ASN CA C 13 53.229 0.400 . 1 . . . . 243 ASN CA . 15932 1 236 . 1 1 30 30 ASN CB C 13 38.980 0.400 . 1 . . . . 243 ASN CB . 15932 1 237 . 1 1 30 30 ASN N N 15 119.059 0.400 . 1 . . . . 243 ASN N . 15932 1 238 . 1 1 30 30 ASN ND2 N 15 111.520 0.400 . 1 . . . . 243 ASN ND2 . 15932 1 239 . 1 1 31 31 PHE H H 1 8.676 0.020 . 1 . . . . 244 PHE H . 15932 1 240 . 1 1 31 31 PHE HA H 1 4.686 0.020 . 1 . . . . 244 PHE HA . 15932 1 241 . 1 1 31 31 PHE HB2 H 1 2.961 0.020 . 2 . . . . 244 PHE HB2 . 15932 1 242 . 1 1 31 31 PHE HB3 H 1 3.489 0.020 . 2 . . . . 244 PHE HB3 . 15932 1 243 . 1 1 31 31 PHE C C 13 174.399 0.400 . 1 . . . . 244 PHE C . 15932 1 244 . 1 1 31 31 PHE CA C 13 57.688 0.400 . 1 . . . . 244 PHE CA . 15932 1 245 . 1 1 31 31 PHE CB C 13 39.026 0.400 . 1 . . . . 244 PHE CB . 15932 1 246 . 1 1 31 31 PHE N N 15 124.091 0.400 . 1 . . . . 244 PHE N . 15932 1 247 . 1 1 32 32 ALA H H 1 8.244 0.020 . 1 . . . . 245 ALA H . 15932 1 248 . 1 1 32 32 ALA HA H 1 3.869 0.020 . 1 . . . . 245 ALA HA . 15932 1 249 . 1 1 32 32 ALA HB1 H 1 1.456 0.020 . 1 . . . . 245 ALA HB1 . 15932 1 250 . 1 1 32 32 ALA HB2 H 1 1.456 0.020 . 1 . . . . 245 ALA HB2 . 15932 1 251 . 1 1 32 32 ALA HB3 H 1 1.456 0.020 . 1 . . . . 245 ALA HB3 . 15932 1 252 . 1 1 32 32 ALA C C 13 180.452 0.400 . 1 . . . . 245 ALA C . 15932 1 253 . 1 1 32 32 ALA CA C 13 56.274 0.400 . 1 . . . . 245 ALA CA . 15932 1 254 . 1 1 32 32 ALA CB C 13 18.181 0.400 . 1 . . . . 245 ALA CB . 15932 1 255 . 1 1 32 32 ALA N N 15 122.713 0.400 . 1 . . . . 245 ALA N . 15932 1 256 . 1 1 33 33 LYS H H 1 8.964 0.020 . 1 . . . . 246 LYS H . 15932 1 257 . 1 1 33 33 LYS HA H 1 4.089 0.020 . 1 . . . . 246 LYS HA . 15932 1 258 . 1 1 33 33 LYS HB2 H 1 1.669 0.020 . 2 . . . . 246 LYS HB2 . 15932 1 259 . 1 1 33 33 LYS HB3 H 1 1.790 0.020 . 2 . . . . 246 LYS HB3 . 15932 1 260 . 1 1 33 33 LYS HD2 H 1 1.653 0.020 . 1 . . . . 246 LYS HD2 . 15932 1 261 . 1 1 33 33 LYS HD3 H 1 1.653 0.020 . 1 . . . . 246 LYS HD3 . 15932 1 262 . 1 1 33 33 LYS HE2 H 1 2.915 0.020 . 1 . . . . 246 LYS HE2 . 15932 1 263 . 1 1 33 33 LYS HE3 H 1 2.915 0.020 . 1 . . . . 246 LYS HE3 . 15932 1 264 . 1 1 33 33 LYS HG2 H 1 1.424 0.020 . 2 . . . . 246 LYS HG2 . 15932 1 265 . 1 1 33 33 LYS HG3 H 1 1.464 0.020 . 2 . . . . 246 LYS HG3 . 15932 1 266 . 1 1 33 33 LYS C C 13 177.441 0.400 . 1 . . . . 246 LYS C . 15932 1 267 . 1 1 33 33 LYS CA C 13 58.632 0.400 . 1 . . . . 246 LYS CA . 15932 1 268 . 1 1 33 33 LYS CB C 13 30.418 0.400 . 1 . . . . 246 LYS CB . 15932 1 269 . 1 1 33 33 LYS CD C 13 28.315 0.400 . 1 . . . . 246 LYS CD . 15932 1 270 . 1 1 33 33 LYS CE C 13 58.012 0.400 . 1 . . . . 246 LYS CE . 15932 1 271 . 1 1 33 33 LYS CG C 13 24.457 0.400 . 1 . . . . 246 LYS CG . 15932 1 272 . 1 1 33 33 LYS N N 15 116.888 0.400 . 1 . . . . 246 LYS N . 15932 1 273 . 1 1 34 34 ALA H H 1 7.088 0.020 . 1 . . . . 247 ALA H . 15932 1 274 . 1 1 34 34 ALA HA H 1 3.752 0.020 . 1 . . . . 247 ALA HA . 15932 1 275 . 1 1 34 34 ALA HB1 H 1 1.457 0.020 . 1 . . . . 247 ALA HB1 . 15932 1 276 . 1 1 34 34 ALA HB2 H 1 1.457 0.020 . 1 . . . . 247 ALA HB2 . 15932 1 277 . 1 1 34 34 ALA HB3 H 1 1.457 0.020 . 1 . . . . 247 ALA HB3 . 15932 1 278 . 1 1 34 34 ALA C C 13 177.581 0.400 . 1 . . . . 247 ALA C . 15932 1 279 . 1 1 34 34 ALA CA C 13 55.502 0.400 . 1 . . . . 247 ALA CA . 15932 1 280 . 1 1 34 34 ALA CB C 13 18.099 0.400 . 1 . . . . 247 ALA CB . 15932 1 281 . 1 1 34 34 ALA N N 15 122.047 0.400 . 1 . . . . 247 ALA N . 15932 1 282 . 1 1 35 35 ARG H H 1 7.706 0.020 . 1 . . . . 248 ARG H . 15932 1 283 . 1 1 35 35 ARG HA H 1 4.338 0.020 . 1 . . . . 248 ARG HA . 15932 1 284 . 1 1 35 35 ARG HB2 H 1 1.855 0.020 . 2 . . . . 248 ARG HB2 . 15932 1 285 . 1 1 35 35 ARG HB3 H 1 1.770 0.020 . 2 . . . . 248 ARG HB3 . 15932 1 286 . 1 1 35 35 ARG HD2 H 1 3.185 0.020 . 2 . . . . 248 ARG HD2 . 15932 1 287 . 1 1 35 35 ARG HD3 H 1 2.705 0.020 . 2 . . . . 248 ARG HD3 . 15932 1 288 . 1 1 35 35 ARG HG2 H 1 1.628 0.020 . 1 . . . . 248 ARG HG2 . 15932 1 289 . 1 1 35 35 ARG HG3 H 1 1.628 0.020 . 1 . . . . 248 ARG HG3 . 15932 1 290 . 1 1 35 35 ARG HH11 H 1 7.635 0.020 . 2 . . . . 248 ARG HH11 . 15932 1 291 . 1 1 35 35 ARG HH12 H 1 6.494 0.020 . 2 . . . . 248 ARG HH12 . 15932 1 292 . 1 1 35 35 ARG C C 13 179.094 0.400 . 1 . . . . 248 ARG C . 15932 1 293 . 1 1 35 35 ARG CA C 13 56.283 0.400 . 1 . . . . 248 ARG CA . 15932 1 294 . 1 1 35 35 ARG CB C 13 30.668 0.400 . 1 . . . . 248 ARG CB . 15932 1 295 . 1 1 35 35 ARG CD C 13 43.200 0.400 . 1 . . . . 248 ARG CD . 15932 1 296 . 1 1 35 35 ARG CG C 13 26.942 0.400 . 1 . . . . 248 ARG CG . 15932 1 297 . 1 1 35 35 ARG N N 15 112.008 0.400 . 1 . . . . 248 ARG N . 15932 1 298 . 1 1 35 35 ARG NH1 N 15 111.520 0.400 . 1 . . . . 248 ARG NH1 . 15932 1 299 . 1 1 36 36 GLU H H 1 7.707 0.020 . 1 . . . . 249 GLU H . 15932 1 300 . 1 1 36 36 GLU HA H 1 4.121 0.020 . 1 . . . . 249 GLU HA . 15932 1 301 . 1 1 36 36 GLU HB2 H 1 2.129 0.020 . 1 . . . . 249 GLU HB2 . 15932 1 302 . 1 1 36 36 GLU HB3 H 1 2.129 0.020 . 1 . . . . 249 GLU HB3 . 15932 1 303 . 1 1 36 36 GLU HG2 H 1 2.367 0.020 . 2 . . . . 249 GLU HG2 . 15932 1 304 . 1 1 36 36 GLU HG3 H 1 2.129 0.020 . 2 . . . . 249 GLU HG3 . 15932 1 305 . 1 1 36 36 GLU C C 13 178.205 0.400 . 1 . . . . 249 GLU C . 15932 1 306 . 1 1 36 36 GLU CA C 13 58.194 0.400 . 1 . . . . 249 GLU CA . 15932 1 307 . 1 1 36 36 GLU CB C 13 30.596 0.400 . 1 . . . . 249 GLU CB . 15932 1 308 . 1 1 36 36 GLU CG C 13 36.142 0.400 . 1 . . . . 249 GLU CG . 15932 1 309 . 1 1 36 36 GLU N N 15 116.945 0.400 . 1 . . . . 249 GLU N . 15932 1 310 . 1 1 37 37 LYS H H 1 7.954 0.020 . 1 . . . . 250 LYS H . 15932 1 311 . 1 1 37 37 LYS HA H 1 4.381 0.020 . 1 . . . . 250 LYS HA . 15932 1 312 . 1 1 37 37 LYS HB2 H 1 1.901 0.020 . 1 . . . . 250 LYS HB2 . 15932 1 313 . 1 1 37 37 LYS HB3 H 1 1.901 0.020 . 1 . . . . 250 LYS HB3 . 15932 1 314 . 1 1 37 37 LYS HD2 H 1 1.648 0.020 . 1 . . . . 250 LYS HD2 . 15932 1 315 . 1 1 37 37 LYS HD3 H 1 1.648 0.020 . 1 . . . . 250 LYS HD3 . 15932 1 316 . 1 1 37 37 LYS HE2 H 1 2.950 0.020 . 1 . . . . 250 LYS HE2 . 15932 1 317 . 1 1 37 37 LYS HE3 H 1 2.950 0.020 . 1 . . . . 250 LYS HE3 . 15932 1 318 . 1 1 37 37 LYS HG2 H 1 1.560 0.020 . 2 . . . . 250 LYS HG2 . 15932 1 319 . 1 1 37 37 LYS HG3 H 1 1.466 0.020 . 2 . . . . 250 LYS HG3 . 15932 1 320 . 1 1 37 37 LYS C C 13 176.772 0.400 . 1 . . . . 250 LYS C . 15932 1 321 . 1 1 37 37 LYS CA C 13 57.323 0.400 . 1 . . . . 250 LYS CA . 15932 1 322 . 1 1 37 37 LYS CB C 13 34.892 0.400 . 1 . . . . 250 LYS CB . 15932 1 323 . 1 1 37 37 LYS CD C 13 28.420 0.400 . 1 . . . . 250 LYS CD . 15932 1 324 . 1 1 37 37 LYS CE C 13 41.888 0.400 . 1 . . . . 250 LYS CE . 15932 1 325 . 1 1 37 37 LYS CG C 13 25.202 0.400 . 1 . . . . 250 LYS CG . 15932 1 326 . 1 1 37 37 LYS N N 15 114.798 0.400 . 1 . . . . 250 LYS N . 15932 1 327 . 1 1 38 38 VAL H H 1 8.298 0.020 . 1 . . . . 251 VAL H . 15932 1 328 . 1 1 38 38 VAL HA H 1 4.582 0.020 . 1 . . . . 251 VAL HA . 15932 1 329 . 1 1 38 38 VAL HB H 1 2.223 0.020 . 1 . . . . 251 VAL HB . 15932 1 330 . 1 1 38 38 VAL HG11 H 1 0.985 0.020 . 2 . . . . 251 VAL HG11 . 15932 1 331 . 1 1 38 38 VAL HG12 H 1 0.985 0.020 . 2 . . . . 251 VAL HG12 . 15932 1 332 . 1 1 38 38 VAL HG13 H 1 0.985 0.020 . 2 . . . . 251 VAL HG13 . 15932 1 333 . 1 1 38 38 VAL HG21 H 1 0.920 0.020 . 2 . . . . 251 VAL HG21 . 15932 1 334 . 1 1 38 38 VAL HG22 H 1 0.920 0.020 . 2 . . . . 251 VAL HG22 . 15932 1 335 . 1 1 38 38 VAL HG23 H 1 0.920 0.020 . 2 . . . . 251 VAL HG23 . 15932 1 336 . 1 1 38 38 VAL C C 13 174.903 0.400 . 1 . . . . 251 VAL C . 15932 1 337 . 1 1 38 38 VAL CA C 13 60.316 0.400 . 1 . . . . 251 VAL CA . 15932 1 338 . 1 1 38 38 VAL CB C 13 32.374 0.400 . 1 . . . . 251 VAL CB . 15932 1 339 . 1 1 38 38 VAL CG1 C 13 20.344 0.400 . 1 . . . . 251 VAL CG1 . 15932 1 340 . 1 1 38 38 VAL CG2 C 13 21.834 0.400 . 1 . . . . 251 VAL CG2 . 15932 1 341 . 1 1 38 38 VAL N N 15 120.907 0.400 . 1 . . . . 251 VAL N . 15932 1 342 . 1 1 40 40 LYS H H 1 8.588 0.020 . 1 . . . . 253 LYS H . 15932 1 343 . 1 1 40 40 LYS HA H 1 4.275 0.020 . 1 . . . . 253 LYS HA . 15932 1 344 . 1 1 40 40 LYS HB2 H 1 1.959 0.020 . 1 . . . . 253 LYS HB2 . 15932 1 345 . 1 1 40 40 LYS HB3 H 1 1.959 0.020 . 1 . . . . 253 LYS HB3 . 15932 1 346 . 1 1 40 40 LYS HD2 H 1 1.620 0.020 . 1 . . . . 253 LYS HD2 . 15932 1 347 . 1 1 40 40 LYS HD3 H 1 1.620 0.020 . 1 . . . . 253 LYS HD3 . 15932 1 348 . 1 1 40 40 LYS HE2 H 1 2.912 0.020 . 1 . . . . 253 LYS HE2 . 15932 1 349 . 1 1 40 40 LYS HE3 H 1 2.912 0.020 . 1 . . . . 253 LYS HE3 . 15932 1 350 . 1 1 40 40 LYS HG2 H 1 1.100 0.020 . 1 . . . . 253 LYS HG2 . 15932 1 351 . 1 1 40 40 LYS HG3 H 1 1.100 0.020 . 1 . . . . 253 LYS HG3 . 15932 1 352 . 1 1 40 40 LYS C C 13 176.447 0.400 . 1 . . . . 253 LYS C . 15932 1 353 . 1 1 40 40 LYS CA C 13 58.550 0.400 . 1 . . . . 253 LYS CA . 15932 1 354 . 1 1 40 40 LYS CB C 13 31.568 0.400 . 1 . . . . 253 LYS CB . 15932 1 355 . 1 1 40 40 LYS CD C 13 29.553 0.400 . 1 . . . . 253 LYS CD . 15932 1 356 . 1 1 40 40 LYS CE C 13 41.874 0.400 . 1 . . . . 253 LYS CE . 15932 1 357 . 1 1 40 40 LYS CG C 13 24.516 0.400 . 1 . . . . 253 LYS CG . 15932 1 358 . 1 1 40 40 LYS N N 15 113.861 0.400 . 1 . . . . 253 LYS N . 15932 1 359 . 1 1 41 41 LEU H H 1 7.948 0.020 . 1 . . . . 254 LEU H . 15932 1 360 . 1 1 41 41 LEU HA H 1 4.391 0.020 . 1 . . . . 254 LEU HA . 15932 1 361 . 1 1 41 41 LEU HB2 H 1 1.356 0.020 . 2 . . . . 254 LEU HB2 . 15932 1 362 . 1 1 41 41 LEU HB3 H 1 1.456 0.020 . 2 . . . . 254 LEU HB3 . 15932 1 363 . 1 1 41 41 LEU HD11 H 1 0.276 0.020 . 2 . . . . 254 LEU HD11 . 15932 1 364 . 1 1 41 41 LEU HD12 H 1 0.276 0.020 . 2 . . . . 254 LEU HD12 . 15932 1 365 . 1 1 41 41 LEU HD13 H 1 0.276 0.020 . 2 . . . . 254 LEU HD13 . 15932 1 366 . 1 1 41 41 LEU HD21 H 1 0.279 0.020 . 2 . . . . 254 LEU HD21 . 15932 1 367 . 1 1 41 41 LEU HD22 H 1 0.279 0.020 . 2 . . . . 254 LEU HD22 . 15932 1 368 . 1 1 41 41 LEU HD23 H 1 0.279 0.020 . 2 . . . . 254 LEU HD23 . 15932 1 369 . 1 1 41 41 LEU HG H 1 0.418 0.020 . 1 . . . . 254 LEU HG . 15932 1 370 . 1 1 41 41 LEU C C 13 175.989 0.400 . 1 . . . . 254 LEU C . 15932 1 371 . 1 1 41 41 LEU CA C 13 53.279 0.400 . 1 . . . . 254 LEU CA . 15932 1 372 . 1 1 41 41 LEU CB C 13 40.369 0.400 . 1 . . . . 254 LEU CB . 15932 1 373 . 1 1 41 41 LEU CD1 C 13 21.011 0.400 . 1 . . . . 254 LEU CD1 . 15932 1 374 . 1 1 41 41 LEU CD2 C 13 21.087 0.400 . 1 . . . . 254 LEU CD2 . 15932 1 375 . 1 1 41 41 LEU CG C 13 26.354 0.400 . 1 . . . . 254 LEU CG . 15932 1 376 . 1 1 41 41 LEU N N 15 118.998 0.400 . 1 . . . . 254 LEU N . 15932 1 377 . 1 1 42 42 HIS H H 1 7.167 0.020 . 1 . . . . 255 HIS H . 15932 1 378 . 1 1 42 42 HIS HA H 1 4.376 0.020 . 1 . . . . 255 HIS HA . 15932 1 379 . 1 1 42 42 HIS HB2 H 1 3.240 0.020 . 2 . . . . 255 HIS HB2 . 15932 1 380 . 1 1 42 42 HIS HB3 H 1 3.296 0.020 . 2 . . . . 255 HIS HB3 . 15932 1 381 . 1 1 42 42 HIS HD2 H 1 7.244 0.020 . 1 . . . . 255 HIS HD2 . 15932 1 382 . 1 1 42 42 HIS C C 13 174.836 0.400 . 1 . . . . 255 HIS C . 15932 1 383 . 1 1 42 42 HIS CA C 13 59.188 0.400 . 1 . . . . 255 HIS CA . 15932 1 384 . 1 1 42 42 HIS CB C 13 30.311 0.400 . 1 . . . . 255 HIS CB . 15932 1 385 . 1 1 42 42 HIS CD2 C 13 121.171 0.400 . 1 . . . . 255 HIS CD2 . 15932 1 386 . 1 1 42 42 HIS N N 15 116.251 0.400 . 1 . . . . 255 HIS N . 15932 1 387 . 1 1 43 43 SER H H 1 7.735 0.020 . 1 . . . . 256 SER H . 15932 1 388 . 1 1 43 43 SER HA H 1 4.490 0.020 . 1 . . . . 256 SER HA . 15932 1 389 . 1 1 43 43 SER HB2 H 1 3.634 0.020 . 1 . . . . 256 SER HB2 . 15932 1 390 . 1 1 43 43 SER HB3 H 1 3.634 0.020 . 1 . . . . 256 SER HB3 . 15932 1 391 . 1 1 43 43 SER C C 13 174.045 0.400 . 1 . . . . 256 SER C . 15932 1 392 . 1 1 43 43 SER CA C 13 56.420 0.400 . 1 . . . . 256 SER CA . 15932 1 393 . 1 1 43 43 SER CB C 13 64.093 0.400 . 1 . . . . 256 SER CB . 15932 1 394 . 1 1 43 43 SER N N 15 110.725 0.400 . 1 . . . . 256 SER N . 15932 1 395 . 1 1 44 44 ILE H H 1 7.403 0.020 . 1 . . . . 257 ILE H . 15932 1 396 . 1 1 44 44 ILE HA H 1 3.806 0.020 . 1 . . . . 257 ILE HA . 15932 1 397 . 1 1 44 44 ILE HB H 1 1.168 0.020 . 1 . . . . 257 ILE HB . 15932 1 398 . 1 1 44 44 ILE HD11 H 1 0.116 0.020 . 1 . . . . 257 ILE HD11 . 15932 1 399 . 1 1 44 44 ILE HD12 H 1 0.116 0.020 . 1 . . . . 257 ILE HD12 . 15932 1 400 . 1 1 44 44 ILE HD13 H 1 0.116 0.020 . 1 . . . . 257 ILE HD13 . 15932 1 401 . 1 1 44 44 ILE HG12 H 1 0.465 0.020 . 2 . . . . 257 ILE HG12 . 15932 1 402 . 1 1 44 44 ILE HG13 H 1 0.735 0.020 . 2 . . . . 257 ILE HG13 . 15932 1 403 . 1 1 44 44 ILE HG21 H 1 0.689 0.020 . 1 . . . . 257 ILE HG21 . 15932 1 404 . 1 1 44 44 ILE HG22 H 1 0.689 0.020 . 1 . . . . 257 ILE HG22 . 15932 1 405 . 1 1 44 44 ILE HG23 H 1 0.689 0.020 . 1 . . . . 257 ILE HG23 . 15932 1 406 . 1 1 44 44 ILE C C 13 174.321 0.400 . 1 . . . . 257 ILE C . 15932 1 407 . 1 1 44 44 ILE CA C 13 61.640 0.400 . 1 . . . . 257 ILE CA . 15932 1 408 . 1 1 44 44 ILE CB C 13 38.324 0.400 . 1 . . . . 257 ILE CB . 15932 1 409 . 1 1 44 44 ILE CD1 C 13 13.987 0.400 . 1 . . . . 257 ILE CD1 . 15932 1 410 . 1 1 44 44 ILE CG1 C 13 28.023 0.400 . 1 . . . . 257 ILE CG1 . 15932 1 411 . 1 1 44 44 ILE CG2 C 13 17.901 0.400 . 1 . . . . 257 ILE CG2 . 15932 1 412 . 1 1 44 44 ILE N N 15 124.717 0.400 . 1 . . . . 257 ILE N . 15932 1 413 . 1 1 45 45 ARG H H 1 8.043 0.020 . 1 . . . . 258 ARG H . 15932 1 414 . 1 1 45 45 ARG HA H 1 4.201 0.020 . 1 . . . . 258 ARG HA . 15932 1 415 . 1 1 45 45 ARG HB2 H 1 1.557 0.020 . 2 . . . . 258 ARG HB2 . 15932 1 416 . 1 1 45 45 ARG HB3 H 1 1.360 0.020 . 2 . . . . 258 ARG HB3 . 15932 1 417 . 1 1 45 45 ARG HD2 H 1 3.062 0.020 . 2 . . . . 258 ARG HD2 . 15932 1 418 . 1 1 45 45 ARG HD3 H 1 2.872 0.020 . 2 . . . . 258 ARG HD3 . 15932 1 419 . 1 1 45 45 ARG HG2 H 1 1.363 0.020 . 2 . . . . 258 ARG HG2 . 15932 1 420 . 1 1 45 45 ARG HG3 H 1 1.300 0.020 . 2 . . . . 258 ARG HG3 . 15932 1 421 . 1 1 45 45 ARG C C 13 177.535 0.400 . 1 . . . . 258 ARG C . 15932 1 422 . 1 1 45 45 ARG CA C 13 55.412 0.400 . 1 . . . . 258 ARG CA . 15932 1 423 . 1 1 45 45 ARG CB C 13 31.546 0.400 . 1 . . . . 258 ARG CB . 15932 1 424 . 1 1 45 45 ARG CD C 13 43.211 0.400 . 1 . . . . 258 ARG CD . 15932 1 425 . 1 1 45 45 ARG CG C 13 26.971 0.400 . 1 . . . . 258 ARG CG . 15932 1 426 . 1 1 45 45 ARG N N 15 124.319 0.400 . 1 . . . . 258 ARG N . 15932 1 427 . 1 1 46 46 ASP H H 1 8.584 0.020 . 1 . . . . 259 ASP H . 15932 1 428 . 1 1 46 46 ASP HA H 1 5.096 0.020 . 1 . . . . 259 ASP HA . 15932 1 429 . 1 1 46 46 ASP HB2 H 1 2.415 0.020 . 1 . . . . 259 ASP HB2 . 15932 1 430 . 1 1 46 46 ASP HB3 H 1 2.415 0.020 . 1 . . . . 259 ASP HB3 . 15932 1 431 . 1 1 46 46 ASP C C 13 177.819 0.400 . 1 . . . . 259 ASP C . 15932 1 432 . 1 1 46 46 ASP CA C 13 55.248 0.400 . 1 . . . . 259 ASP CA . 15932 1 433 . 1 1 46 46 ASP CB C 13 39.614 0.400 . 1 . . . . 259 ASP CB . 15932 1 434 . 1 1 46 46 ASP N N 15 120.371 0.400 . 1 . . . . 259 ASP N . 15932 1 435 . 1 1 47 47 ARG H H 1 8.632 0.020 . 1 . . . . 260 ARG H . 15932 1 436 . 1 1 47 47 ARG HD2 H 1 1.640 0.020 . 2 . . . . 260 ARG HD2 . 15932 1 437 . 1 1 47 47 ARG HD3 H 1 2.926 0.020 . 2 . . . . 260 ARG HD3 . 15932 1 438 . 1 1 47 47 ARG HG2 H 1 1.860 0.020 . 2 . . . . 260 ARG HG2 . 15932 1 439 . 1 1 47 47 ARG HG3 H 1 1.775 0.020 . 2 . . . . 260 ARG HG3 . 15932 1 440 . 1 1 47 47 ARG HH11 H 1 7.635 0.020 . 2 . . . . 260 ARG HH11 . 15932 1 441 . 1 1 47 47 ARG HH12 H 1 6.494 0.020 . 2 . . . . 260 ARG HH12 . 15932 1 442 . 1 1 47 47 ARG CA C 13 56.228 0.400 . 1 . . . . 260 ARG CA . 15932 1 443 . 1 1 47 47 ARG CB C 13 26.981 0.400 . 1 . . . . 260 ARG CB . 15932 1 444 . 1 1 47 47 ARG CD C 13 43.229 0.400 . 1 . . . . 260 ARG CD . 15932 1 445 . 1 1 47 47 ARG N N 15 123.120 0.400 . 1 . . . . 260 ARG N . 15932 1 446 . 1 1 47 47 ARG NH1 N 15 111.520 0.400 . 1 . . . . 260 ARG NH1 . 15932 1 447 . 1 1 51 51 HIS HA H 1 4.293 0.020 . 1 . . . . 264 HIS HA . 15932 1 448 . 1 1 51 51 HIS HB2 H 1 3.138 0.020 . 2 . . . . 264 HIS HB2 . 15932 1 449 . 1 1 51 51 HIS HB3 H 1 3.010 0.020 . 2 . . . . 264 HIS HB3 . 15932 1 450 . 1 1 51 51 HIS HD2 H 1 6.990 0.020 . 1 . . . . 264 HIS HD2 . 15932 1 451 . 1 1 51 51 HIS C C 13 178.002 0.400 . 1 . . . . 264 HIS C . 15932 1 452 . 1 1 51 51 HIS CA C 13 60.062 0.400 . 1 . . . . 264 HIS CA . 15932 1 453 . 1 1 51 51 HIS CB C 13 29.109 0.400 . 1 . . . . 264 HIS CB . 15932 1 454 . 1 1 51 51 HIS CD2 C 13 117.760 0.400 . 1 . . . . 264 HIS CD2 . 15932 1 455 . 1 1 52 52 LEU H H 1 7.474 0.020 . 1 . . . . 265 LEU H . 15932 1 456 . 1 1 52 52 LEU HA H 1 4.125 0.020 . 1 . . . . 265 LEU HA . 15932 1 457 . 1 1 52 52 LEU HB2 H 1 1.362 0.020 . 2 . . . . 265 LEU HB2 . 15932 1 458 . 1 1 52 52 LEU HB3 H 1 1.667 0.020 . 2 . . . . 265 LEU HB3 . 15932 1 459 . 1 1 52 52 LEU HD11 H 1 0.715 0.020 . 2 . . . . 265 LEU HD11 . 15932 1 460 . 1 1 52 52 LEU HD12 H 1 0.715 0.020 . 2 . . . . 265 LEU HD12 . 15932 1 461 . 1 1 52 52 LEU HD13 H 1 0.715 0.020 . 2 . . . . 265 LEU HD13 . 15932 1 462 . 1 1 52 52 LEU HD21 H 1 0.790 0.020 . 2 . . . . 265 LEU HD21 . 15932 1 463 . 1 1 52 52 LEU HD22 H 1 0.790 0.020 . 2 . . . . 265 LEU HD22 . 15932 1 464 . 1 1 52 52 LEU HD23 H 1 0.790 0.020 . 2 . . . . 265 LEU HD23 . 15932 1 465 . 1 1 52 52 LEU HG H 1 1.129 0.020 . 1 . . . . 265 LEU HG . 15932 1 466 . 1 1 52 52 LEU C C 13 180.623 0.400 . 1 . . . . 265 LEU C . 15932 1 467 . 1 1 52 52 LEU CA C 13 56.921 0.400 . 1 . . . . 265 LEU CA . 15932 1 468 . 1 1 52 52 LEU CB C 13 40.572 0.400 . 1 . . . . 265 LEU CB . 15932 1 469 . 1 1 52 52 LEU CD1 C 13 22.897 0.400 . 1 . . . . 265 LEU CD1 . 15932 1 470 . 1 1 52 52 LEU CD2 C 13 24.819 0.400 . 1 . . . . 265 LEU CD2 . 15932 1 471 . 1 1 52 52 LEU CG C 13 26.969 0.400 . 1 . . . . 265 LEU CG . 15932 1 472 . 1 1 52 52 LEU N N 15 122.692 0.400 . 1 . . . . 265 LEU N . 15932 1 473 . 1 1 53 53 ASP H H 1 6.993 0.020 . 1 . . . . 266 ASP H . 15932 1 474 . 1 1 53 53 ASP C C 13 176.536 0.400 . 1 . . . . 266 ASP C . 15932 1 475 . 1 1 53 53 ASP CA C 13 56.718 0.400 . 1 . . . . 266 ASP CA . 15932 1 476 . 1 1 53 53 ASP CB C 13 39.787 0.400 . 1 . . . . 266 ASP CB . 15932 1 477 . 1 1 53 53 ASP N N 15 122.192 0.400 . 1 . . . . 266 ASP N . 15932 1 478 . 1 1 54 54 ALA H H 1 8.217 0.020 . 1 . . . . 267 ALA H . 15932 1 479 . 1 1 54 54 ALA HA H 1 3.840 0.020 . 1 . . . . 267 ALA HA . 15932 1 480 . 1 1 54 54 ALA HB1 H 1 1.357 0.020 . 1 . . . . 267 ALA HB1 . 15932 1 481 . 1 1 54 54 ALA HB2 H 1 1.357 0.020 . 1 . . . . 267 ALA HB2 . 15932 1 482 . 1 1 54 54 ALA HB3 H 1 1.357 0.020 . 1 . . . . 267 ALA HB3 . 15932 1 483 . 1 1 54 54 ALA C C 13 180.507 0.400 . 1 . . . . 267 ALA C . 15932 1 484 . 1 1 54 54 ALA CA C 13 55.836 0.400 . 1 . . . . 267 ALA CA . 15932 1 485 . 1 1 54 54 ALA CB C 13 17.386 0.400 . 1 . . . . 267 ALA CB . 15932 1 486 . 1 1 54 54 ALA N N 15 121.612 0.400 . 1 . . . . 267 ALA N . 15932 1 487 . 1 1 55 55 GLY H H 1 8.481 0.020 . 1 . . . . 268 GLY H . 15932 1 488 . 1 1 55 55 GLY C C 13 174.929 0.400 . 1 . . . . 268 GLY C . 15932 1 489 . 1 1 55 55 GLY CA C 13 46.546 0.400 . 1 . . . . 268 GLY CA . 15932 1 490 . 1 1 55 55 GLY N N 15 107.453 0.400 . 1 . . . . 268 GLY N . 15932 1 491 . 1 1 56 56 ALA H H 1 7.759 0.020 . 1 . . . . 269 ALA H . 15932 1 492 . 1 1 56 56 ALA HA H 1 4.190 0.020 . 1 . . . . 269 ALA HA . 15932 1 493 . 1 1 56 56 ALA HB1 H 1 1.452 0.020 . 1 . . . . 269 ALA HB1 . 15932 1 494 . 1 1 56 56 ALA HB2 H 1 1.452 0.020 . 1 . . . . 269 ALA HB2 . 15932 1 495 . 1 1 56 56 ALA HB3 H 1 1.452 0.020 . 1 . . . . 269 ALA HB3 . 15932 1 496 . 1 1 56 56 ALA C C 13 180.493 0.400 . 1 . . . . 269 ALA C . 15932 1 497 . 1 1 56 56 ALA CA C 13 55.311 0.400 . 1 . . . . 269 ALA CA . 15932 1 498 . 1 1 56 56 ALA CB C 13 17.951 0.400 . 1 . . . . 269 ALA CB . 15932 1 499 . 1 1 56 56 ALA N N 15 125.518 0.400 . 1 . . . . 269 ALA N . 15932 1 500 . 1 1 57 57 LEU H H 1 8.224 0.020 . 1 . . . . 270 LEU H . 15932 1 501 . 1 1 57 57 LEU HA H 1 3.840 0.020 . 1 . . . . 270 LEU HA . 15932 1 502 . 1 1 57 57 LEU HD11 H 1 0.717 0.020 . 1 . . . . 270 LEU HD11 . 15932 1 503 . 1 1 57 57 LEU HD12 H 1 0.717 0.020 . 1 . . . . 270 LEU HD12 . 15932 1 504 . 1 1 57 57 LEU HD13 H 1 0.717 0.020 . 1 . . . . 270 LEU HD13 . 15932 1 505 . 1 1 57 57 LEU HG H 1 0.729 0.020 . 1 . . . . 270 LEU HG . 15932 1 506 . 1 1 57 57 LEU C C 13 177.499 0.400 . 1 . . . . 270 LEU C . 15932 1 507 . 1 1 57 57 LEU CA C 13 58.315 0.400 . 1 . . . . 270 LEU CA . 15932 1 508 . 1 1 57 57 LEU CB C 13 43.182 0.400 . 1 . . . . 270 LEU CB . 15932 1 509 . 1 1 57 57 LEU CD1 C 13 22.857 0.400 . 1 . . . . 270 LEU CD1 . 15932 1 510 . 1 1 57 57 LEU CG C 13 26.959 0.400 . 1 . . . . 270 LEU CG . 15932 1 511 . 1 1 57 57 LEU N N 15 121.610 0.400 . 1 . . . . 270 LEU N . 15932 1 512 . 1 1 58 58 THR H H 1 7.976 0.020 . 1 . . . . 271 THR H . 15932 1 513 . 1 1 58 58 THR HA H 1 4.432 0.020 . 1 . . . . 271 THR HA . 15932 1 514 . 1 1 58 58 THR HB H 1 3.680 0.020 . 1 . . . . 271 THR HB . 15932 1 515 . 1 1 58 58 THR HG21 H 1 1.148 0.020 . 1 . . . . 271 THR HG21 . 15932 1 516 . 1 1 58 58 THR HG22 H 1 1.148 0.020 . 1 . . . . 271 THR HG22 . 15932 1 517 . 1 1 58 58 THR HG23 H 1 1.148 0.020 . 1 . . . . 271 THR HG23 . 15932 1 518 . 1 1 58 58 THR C C 13 174.457 0.400 . 1 . . . . 271 THR C . 15932 1 519 . 1 1 58 58 THR CA C 13 68.788 0.400 . 1 . . . . 271 THR CA . 15932 1 520 . 1 1 58 58 THR CB C 13 67.557 0.400 . 1 . . . . 271 THR CB . 15932 1 521 . 1 1 58 58 THR CG2 C 13 20.097 0.400 . 1 . . . . 271 THR CG2 . 15932 1 522 . 1 1 58 58 THR N N 15 115.528 0.400 . 1 . . . . 271 THR N . 15932 1 523 . 1 1 59 59 THR H H 1 8.085 0.020 . 1 . . . . 272 THR H . 15932 1 524 . 1 1 59 59 THR HA H 1 3.911 0.020 . 1 . . . . 272 THR HA . 15932 1 525 . 1 1 59 59 THR HB H 1 3.980 0.020 . 1 . . . . 272 THR HB . 15932 1 526 . 1 1 59 59 THR HG21 H 1 1.113 0.020 . 1 . . . . 272 THR HG21 . 15932 1 527 . 1 1 59 59 THR HG22 H 1 1.113 0.020 . 1 . . . . 272 THR HG22 . 15932 1 528 . 1 1 59 59 THR HG23 H 1 1.113 0.020 . 1 . . . . 272 THR HG23 . 15932 1 529 . 1 1 59 59 THR C C 13 176.131 0.400 . 1 . . . . 272 THR C . 15932 1 530 . 1 1 59 59 THR CA C 13 65.908 0.400 . 1 . . . . 272 THR CA . 15932 1 531 . 1 1 59 59 THR CB C 13 69.045 0.400 . 1 . . . . 272 THR CB . 15932 1 532 . 1 1 59 59 THR CG2 C 13 21.267 0.400 . 1 . . . . 272 THR CG2 . 15932 1 533 . 1 1 59 59 THR N N 15 114.864 0.400 . 1 . . . . 272 THR N . 15932 1 534 . 1 1 60 60 THR H H 1 7.875 0.020 . 1 . . . . 273 THR H . 15932 1 535 . 1 1 60 60 THR HA H 1 3.423 0.020 . 1 . . . . 273 THR HA . 15932 1 536 . 1 1 60 60 THR HB H 1 3.690 0.020 . 1 . . . . 273 THR HB . 15932 1 537 . 1 1 60 60 THR HG21 H 1 0.380 0.020 . 1 . . . . 273 THR HG21 . 15932 1 538 . 1 1 60 60 THR HG22 H 1 0.380 0.020 . 1 . . . . 273 THR HG22 . 15932 1 539 . 1 1 60 60 THR HG23 H 1 0.380 0.020 . 1 . . . . 273 THR HG23 . 15932 1 540 . 1 1 60 60 THR C C 13 175.166 0.400 . 1 . . . . 273 THR C . 15932 1 541 . 1 1 60 60 THR CA C 13 67.291 0.400 . 1 . . . . 273 THR CA . 15932 1 542 . 1 1 60 60 THR CB C 13 68.824 0.400 . 1 . . . . 273 THR CB . 15932 1 543 . 1 1 60 60 THR CG2 C 13 20.275 0.400 . 1 . . . . 273 THR CG2 . 15932 1 544 . 1 1 60 60 THR N N 15 116.718 0.400 . 1 . . . . 273 THR N . 15932 1 545 . 1 1 61 61 PHE H H 1 8.219 0.020 . 1 . . . . 274 PHE H . 15932 1 546 . 1 1 61 61 PHE HA H 1 4.213 0.020 . 1 . . . . 274 PHE HA . 15932 1 547 . 1 1 61 61 PHE HB2 H 1 2.465 0.020 . 1 . . . . 274 PHE HB2 . 15932 1 548 . 1 1 61 61 PHE HB3 H 1 2.465 0.020 . 1 . . . . 274 PHE HB3 . 15932 1 549 . 1 1 61 61 PHE HD1 H 1 6.709 0.020 . 1 . . . . 274 PHE HD1 . 15932 1 550 . 1 1 61 61 PHE HE1 H 1 6.479 0.020 . 1 . . . . 274 PHE HE1 . 15932 1 551 . 1 1 61 61 PHE HZ H 1 6.594 0.020 . 1 . . . . 274 PHE HZ . 15932 1 552 . 1 1 61 61 PHE C C 13 178.034 0.400 . 1 . . . . 274 PHE C . 15932 1 553 . 1 1 61 61 PHE CA C 13 63.308 0.400 . 1 . . . . 274 PHE CA . 15932 1 554 . 1 1 61 61 PHE CB C 13 37.080 0.400 . 1 . . . . 274 PHE CB . 15932 1 555 . 1 1 61 61 PHE CD1 C 13 131.433 0.400 . 1 . . . . 274 PHE CD1 . 15932 1 556 . 1 1 61 61 PHE CE1 C 13 129.594 0.400 . 1 . . . . 274 PHE CE1 . 15932 1 557 . 1 1 61 61 PHE CZ C 13 128.117 0.400 . 1 . . . . 274 PHE CZ . 15932 1 558 . 1 1 61 61 PHE N N 15 114.721 0.400 . 1 . . . . 274 PHE N . 15932 1 559 . 1 1 62 62 GLU H H 1 8.810 0.020 . 1 . . . . 275 GLU H . 15932 1 560 . 1 1 62 62 GLU HA H 1 4.416 0.020 . 1 . . . . 275 GLU HA . 15932 1 561 . 1 1 62 62 GLU HB2 H 1 2.021 0.020 . 2 . . . . 275 GLU HB2 . 15932 1 562 . 1 1 62 62 GLU HB3 H 1 2.277 0.020 . 2 . . . . 275 GLU HB3 . 15932 1 563 . 1 1 62 62 GLU HG2 H 1 2.548 0.020 . 2 . . . . 275 GLU HG2 . 15932 1 564 . 1 1 62 62 GLU HG3 H 1 2.269 0.020 . 2 . . . . 275 GLU HG3 . 15932 1 565 . 1 1 62 62 GLU C C 13 181.232 0.400 . 1 . . . . 275 GLU C . 15932 1 566 . 1 1 62 62 GLU CA C 13 60.190 0.400 . 1 . . . . 275 GLU CA . 15932 1 567 . 1 1 62 62 GLU CB C 13 28.990 0.400 . 1 . . . . 275 GLU CB . 15932 1 568 . 1 1 62 62 GLU CG C 13 37.706 0.400 . 1 . . . . 275 GLU CG . 15932 1 569 . 1 1 62 62 GLU N N 15 123.787 0.400 . 1 . . . . 275 GLU N . 15932 1 570 . 1 1 63 63 GLU H H 1 7.698 0.020 . 1 . . . . 276 GLU H . 15932 1 571 . 1 1 63 63 GLU HA H 1 3.871 0.020 . 1 . . . . 276 GLU HA . 15932 1 572 . 1 1 63 63 GLU HB3 H 1 1.960 0.020 . 1 . . . . 276 GLU HB3 . 15932 1 573 . 1 1 63 63 GLU HG2 H 1 2.458 0.020 . 2 . . . . 276 GLU HG2 . 15932 1 574 . 1 1 63 63 GLU HG3 H 1 2.181 0.020 . 2 . . . . 276 GLU HG3 . 15932 1 575 . 1 1 63 63 GLU C C 13 176.721 0.400 . 1 . . . . 276 GLU C . 15932 1 576 . 1 1 63 63 GLU CA C 13 58.821 0.400 . 1 . . . . 276 GLU CA . 15932 1 577 . 1 1 63 63 GLU CB C 13 29.251 0.400 . 1 . . . . 276 GLU CB . 15932 1 578 . 1 1 63 63 GLU CG C 13 36.867 0.400 . 1 . . . . 276 GLU CG . 15932 1 579 . 1 1 63 63 GLU N N 15 120.707 0.400 . 1 . . . . 276 GLU N . 15932 1 580 . 1 1 64 64 LEU H H 1 6.708 0.020 . 1 . . . . 277 LEU H . 15932 1 581 . 1 1 64 64 LEU HA H 1 4.148 0.020 . 1 . . . . 277 LEU HA . 15932 1 582 . 1 1 64 64 LEU HD11 H 1 0.732 0.020 . 2 . . . . 277 LEU HD11 . 15932 1 583 . 1 1 64 64 LEU HD12 H 1 0.732 0.020 . 2 . . . . 277 LEU HD12 . 15932 1 584 . 1 1 64 64 LEU HD13 H 1 0.732 0.020 . 2 . . . . 277 LEU HD13 . 15932 1 585 . 1 1 64 64 LEU HD21 H 1 1.668 0.020 . 2 . . . . 277 LEU HD21 . 15932 1 586 . 1 1 64 64 LEU HD22 H 1 1.668 0.020 . 2 . . . . 277 LEU HD22 . 15932 1 587 . 1 1 64 64 LEU HD23 H 1 1.668 0.020 . 2 . . . . 277 LEU HD23 . 15932 1 588 . 1 1 64 64 LEU HG H 1 0.485 0.020 . 1 . . . . 277 LEU HG . 15932 1 589 . 1 1 64 64 LEU C C 13 174.571 0.400 . 1 . . . . 277 LEU C . 15932 1 590 . 1 1 64 64 LEU CA C 13 54.060 0.400 . 1 . . . . 277 LEU CA . 15932 1 591 . 1 1 64 64 LEU CD1 C 13 21.933 0.400 . 1 . . . . 277 LEU CD1 . 15932 1 592 . 1 1 64 64 LEU CD2 C 13 25.665 0.400 . 1 . . . . 277 LEU CD2 . 15932 1 593 . 1 1 64 64 LEU CG C 13 25.458 0.400 . 1 . . . . 277 LEU CG . 15932 1 594 . 1 1 64 64 LEU N N 15 115.451 0.400 . 1 . . . . 277 LEU N . 15932 1 595 . 1 1 65 65 HIS H H 1 7.388 0.020 . 1 . . . . 278 HIS H . 15932 1 596 . 1 1 65 65 HIS HA H 1 4.259 0.020 . 1 . . . . 278 HIS HA . 15932 1 597 . 1 1 65 65 HIS HB2 H 1 3.128 0.020 . 2 . . . . 278 HIS HB2 . 15932 1 598 . 1 1 65 65 HIS HB3 H 1 3.506 0.020 . 2 . . . . 278 HIS HB3 . 15932 1 599 . 1 1 65 65 HIS C C 13 174.571 0.400 . 1 . . . . 278 HIS C . 15932 1 600 . 1 1 65 65 HIS CA C 13 57.737 0.400 . 1 . . . . 278 HIS CA . 15932 1 601 . 1 1 65 65 HIS CB C 13 26.020 0.400 . 1 . . . . 278 HIS CB . 15932 1 602 . 1 1 65 65 HIS N N 15 107.287 0.400 . 1 . . . . 278 HIS N . 15932 1 603 . 1 1 66 66 PHE H H 1 8.554 0.020 . 1 . . . . 279 PHE H . 15932 1 604 . 1 1 66 66 PHE HA H 1 4.462 0.020 . 1 . . . . 279 PHE HA . 15932 1 605 . 1 1 66 66 PHE HB2 H 1 2.430 0.020 . 1 . . . . 279 PHE HB2 . 15932 1 606 . 1 1 66 66 PHE HB3 H 1 2.430 0.020 . 1 . . . . 279 PHE HB3 . 15932 1 607 . 1 1 66 66 PHE HD1 H 1 6.709 0.020 . 1 . . . . 279 PHE HD1 . 15932 1 608 . 1 1 66 66 PHE HE1 H 1 6.479 0.020 . 1 . . . . 279 PHE HE1 . 15932 1 609 . 1 1 66 66 PHE HZ H 1 6.594 0.020 . 1 . . . . 279 PHE HZ . 15932 1 610 . 1 1 66 66 PHE C C 13 174.258 0.400 . 1 . . . . 279 PHE C . 15932 1 611 . 1 1 66 66 PHE CA C 13 58.032 0.400 . 1 . . . . 279 PHE CA . 15932 1 612 . 1 1 66 66 PHE CB C 13 39.809 0.400 . 1 . . . . 279 PHE CB . 15932 1 613 . 1 1 66 66 PHE CD1 C 13 131.433 0.400 . 1 . . . . 279 PHE CD1 . 15932 1 614 . 1 1 66 66 PHE CE1 C 13 129.594 0.400 . 1 . . . . 279 PHE CE1 . 15932 1 615 . 1 1 66 66 PHE CZ C 13 128.117 0.400 . 1 . . . . 279 PHE CZ . 15932 1 616 . 1 1 66 66 PHE N N 15 117.992 0.400 . 1 . . . . 279 PHE N . 15932 1 617 . 1 1 67 67 GLU H H 1 8.403 0.020 . 1 . . . . 280 GLU H . 15932 1 618 . 1 1 67 67 GLU HA H 1 4.631 0.020 . 1 . . . . 280 GLU HA . 15932 1 619 . 1 1 67 67 GLU HB2 H 1 1.789 0.020 . 2 . . . . 280 GLU HB2 . 15932 1 620 . 1 1 67 67 GLU HB3 H 1 1.946 0.020 . 2 . . . . 280 GLU HB3 . 15932 1 621 . 1 1 67 67 GLU C C 13 174.640 0.400 . 1 . . . . 280 GLU C . 15932 1 622 . 1 1 67 67 GLU CA C 13 55.467 0.400 . 1 . . . . 280 GLU CA . 15932 1 623 . 1 1 67 67 GLU CB C 13 30.671 0.400 . 1 . . . . 280 GLU CB . 15932 1 624 . 1 1 67 67 GLU CG C 13 36.448 0.400 . 1 . . . . 280 GLU CG . 15932 1 625 . 1 1 67 67 GLU N N 15 120.980 0.400 . 1 . . . . 280 GLU N . 15932 1 626 . 1 1 68 68 ILE H H 1 8.988 0.020 . 1 . . . . 281 ILE H . 15932 1 627 . 1 1 68 68 ILE HA H 1 4.491 0.020 . 1 . . . . 281 ILE HA . 15932 1 628 . 1 1 68 68 ILE HB H 1 2.207 0.020 . 1 . . . . 281 ILE HB . 15932 1 629 . 1 1 68 68 ILE HD11 H 1 0.719 0.020 . 1 . . . . 281 ILE HD11 . 15932 1 630 . 1 1 68 68 ILE HD12 H 1 0.719 0.020 . 1 . . . . 281 ILE HD12 . 15932 1 631 . 1 1 68 68 ILE HD13 H 1 0.719 0.020 . 1 . . . . 281 ILE HD13 . 15932 1 632 . 1 1 68 68 ILE HG12 H 1 1.921 0.020 . 1 . . . . 281 ILE HG12 . 15932 1 633 . 1 1 68 68 ILE HG21 H 1 0.921 0.020 . 1 . . . . 281 ILE HG21 . 15932 1 634 . 1 1 68 68 ILE HG22 H 1 0.921 0.020 . 1 . . . . 281 ILE HG22 . 15932 1 635 . 1 1 68 68 ILE HG23 H 1 0.921 0.020 . 1 . . . . 281 ILE HG23 . 15932 1 636 . 1 1 68 68 ILE C C 13 176.177 0.400 . 1 . . . . 281 ILE C . 15932 1 637 . 1 1 68 68 ILE CA C 13 59.688 0.400 . 1 . . . . 281 ILE CA . 15932 1 638 . 1 1 68 68 ILE CB C 13 35.090 0.400 . 1 . . . . 281 ILE CB . 15932 1 639 . 1 1 68 68 ILE CD1 C 13 10.410 0.400 . 1 . . . . 281 ILE CD1 . 15932 1 640 . 1 1 68 68 ILE CG1 C 13 27.664 0.400 . 1 . . . . 281 ILE CG1 . 15932 1 641 . 1 1 68 68 ILE CG2 C 13 18.476 0.400 . 1 . . . . 281 ILE CG2 . 15932 1 642 . 1 1 68 68 ILE N N 15 127.994 0.400 . 1 . . . . 281 ILE N . 15932 1 643 . 1 1 69 69 LYS H H 1 8.559 0.020 . 1 . . . . 282 LYS H . 15932 1 644 . 1 1 69 69 LYS HA H 1 4.981 0.020 . 1 . . . . 282 LYS HA . 15932 1 645 . 1 1 69 69 LYS CA C 13 50.465 0.400 . 1 . . . . 282 LYS CA . 15932 1 646 . 1 1 69 69 LYS CB C 13 32.762 0.400 . 1 . . . . 282 LYS CB . 15932 1 647 . 1 1 69 69 LYS CD C 13 28.679 0.400 . 1 . . . . 282 LYS CD . 15932 1 648 . 1 1 69 69 LYS CG C 13 22.735 0.400 . 1 . . . . 282 LYS CG . 15932 1 649 . 1 1 69 69 LYS N N 15 126.350 0.400 . 1 . . . . 282 LYS N . 15932 1 650 . 1 1 70 70 PRO HA H 1 5.133 0.020 . 1 . . . . 283 PRO HA . 15932 1 651 . 1 1 70 70 PRO C C 13 176.378 0.400 . 1 . . . . 283 PRO C . 15932 1 652 . 1 1 70 70 PRO CA C 13 62.027 0.400 . 1 . . . . 283 PRO CA . 15932 1 653 . 1 1 70 70 PRO CB C 13 32.856 0.400 . 1 . . . . 283 PRO CB . 15932 1 654 . 1 1 70 70 PRO CG C 13 25.943 0.400 . 1 . . . . 283 PRO CG . 15932 1 655 . 1 1 71 71 HIS H H 1 8.967 0.020 . 1 . . . . 284 HIS H . 15932 1 656 . 1 1 71 71 HIS HA H 1 4.465 0.020 . 1 . . . . 284 HIS HA . 15932 1 657 . 1 1 71 71 HIS HB2 H 1 2.816 0.020 . 1 . . . . 284 HIS HB2 . 15932 1 658 . 1 1 71 71 HIS HB3 H 1 2.816 0.020 . 1 . . . . 284 HIS HB3 . 15932 1 659 . 1 1 71 71 HIS HD2 H 1 6.648 0.020 . 1 . . . . 284 HIS HD2 . 15932 1 660 . 1 1 71 71 HIS C C 13 172.714 0.400 . 1 . . . . 284 HIS C . 15932 1 661 . 1 1 71 71 HIS CA C 13 55.994 0.400 . 1 . . . . 284 HIS CA . 15932 1 662 . 1 1 71 71 HIS CB C 13 33.678 0.400 . 1 . . . . 284 HIS CB . 15932 1 663 . 1 1 71 71 HIS CD2 C 13 118.976 0.400 . 1 . . . . 284 HIS CD2 . 15932 1 664 . 1 1 71 71 HIS N N 15 121.708 0.400 . 1 . . . . 284 HIS N . 15932 1 665 . 1 1 72 72 ASP H H 1 8.625 0.020 . 1 . . . . 285 ASP H . 15932 1 666 . 1 1 72 72 ASP HA H 1 5.695 0.020 . 1 . . . . 285 ASP HA . 15932 1 667 . 1 1 72 72 ASP HB2 H 1 2.664 0.020 . 2 . . . . 285 ASP HB2 . 15932 1 668 . 1 1 72 72 ASP HB3 H 1 2.530 0.020 . 2 . . . . 285 ASP HB3 . 15932 1 669 . 1 1 72 72 ASP C C 13 175.881 0.400 . 1 . . . . 285 ASP C . 15932 1 670 . 1 1 72 72 ASP CA C 13 53.201 0.400 . 1 . . . . 285 ASP CA . 15932 1 671 . 1 1 72 72 ASP CB C 13 43.758 0.400 . 1 . . . . 285 ASP CB . 15932 1 672 . 1 1 72 72 ASP N N 15 122.941 0.400 . 1 . . . . 285 ASP N . 15932 1 673 . 1 1 73 73 ASP H H 1 9.212 0.020 . 1 . . . . 286 ASP H . 15932 1 674 . 1 1 73 73 ASP HA H 1 4.263 0.020 . 1 . . . . 286 ASP HA . 15932 1 675 . 1 1 73 73 ASP HB2 H 1 2.782 0.020 . 1 . . . . 286 ASP HB2 . 15932 1 676 . 1 1 73 73 ASP C C 13 174.368 0.400 . 1 . . . . 286 ASP C . 15932 1 677 . 1 1 73 73 ASP CA C 13 56.488 0.400 . 1 . . . . 286 ASP CA . 15932 1 678 . 1 1 73 73 ASP CB C 13 39.083 0.400 . 1 . . . . 286 ASP CB . 15932 1 679 . 1 1 73 73 ASP N N 15 119.175 0.400 . 1 . . . . 286 ASP N . 15932 1 680 . 1 1 74 74 CYS H H 1 8.750 0.020 . 1 . . . . 287 CYS H . 15932 1 681 . 1 1 74 74 CYS HA H 1 4.854 0.020 . 1 . . . . 287 CYS HA . 15932 1 682 . 1 1 74 74 CYS HB2 H 1 2.541 0.020 . 2 . . . . 287 CYS HB2 . 15932 1 683 . 1 1 74 74 CYS HB3 H 1 2.830 0.020 . 2 . . . . 287 CYS HB3 . 15932 1 684 . 1 1 74 74 CYS C C 13 176.146 0.400 . 1 . . . . 287 CYS C . 15932 1 685 . 1 1 74 74 CYS CA C 13 58.552 0.400 . 1 . . . . 287 CYS CA . 15932 1 686 . 1 1 74 74 CYS CB C 13 53.204 0.400 . 1 . . . . 287 CYS CB . 15932 1 687 . 1 1 74 74 CYS N N 15 119.631 0.400 . 1 . . . . 287 CYS N . 15932 1 688 . 1 1 75 75 THR H H 1 8.535 0.020 . 1 . . . . 288 THR H . 15932 1 689 . 1 1 75 75 THR HA H 1 4.163 0.020 . 1 . . . . 288 THR HA . 15932 1 690 . 1 1 75 75 THR HB H 1 4.594 0.020 . 1 . . . . 288 THR HB . 15932 1 691 . 1 1 75 75 THR HG21 H 1 1.207 0.020 . 1 . . . . 288 THR HG21 . 15932 1 692 . 1 1 75 75 THR HG22 H 1 1.207 0.020 . 1 . . . . 288 THR HG22 . 15932 1 693 . 1 1 75 75 THR HG23 H 1 1.207 0.020 . 1 . . . . 288 THR HG23 . 15932 1 694 . 1 1 75 75 THR C C 13 174.663 0.400 . 1 . . . . 288 THR C . 15932 1 695 . 1 1 75 75 THR CA C 13 61.353 0.400 . 1 . . . . 288 THR CA . 15932 1 696 . 1 1 75 75 THR CB C 13 70.100 0.400 . 1 . . . . 288 THR CB . 15932 1 697 . 1 1 75 75 THR CG2 C 13 22.192 0.400 . 1 . . . . 288 THR CG2 . 15932 1 698 . 1 1 75 75 THR N N 15 115.998 0.400 . 1 . . . . 288 THR N . 15932 1 699 . 1 1 76 76 VAL H H 1 8.083 0.020 . 1 . . . . 289 VAL H . 15932 1 700 . 1 1 76 76 VAL HA H 1 3.414 0.020 . 1 . . . . 289 VAL HA . 15932 1 701 . 1 1 76 76 VAL HB H 1 2.044 0.020 . 1 . . . . 289 VAL HB . 15932 1 702 . 1 1 76 76 VAL HG11 H 1 0.856 0.020 . 2 . . . . 289 VAL HG11 . 15932 1 703 . 1 1 76 76 VAL HG12 H 1 0.856 0.020 . 2 . . . . 289 VAL HG12 . 15932 1 704 . 1 1 76 76 VAL HG13 H 1 0.856 0.020 . 2 . . . . 289 VAL HG13 . 15932 1 705 . 1 1 76 76 VAL HG21 H 1 0.817 0.020 . 2 . . . . 289 VAL HG21 . 15932 1 706 . 1 1 76 76 VAL HG22 H 1 0.817 0.020 . 2 . . . . 289 VAL HG22 . 15932 1 707 . 1 1 76 76 VAL HG23 H 1 0.817 0.020 . 2 . . . . 289 VAL HG23 . 15932 1 708 . 1 1 76 76 VAL C C 13 176.443 0.400 . 1 . . . . 289 VAL C . 15932 1 709 . 1 1 76 76 VAL CA C 13 69.066 0.400 . 1 . . . . 289 VAL CA . 15932 1 710 . 1 1 76 76 VAL CB C 13 30.361 0.400 . 1 . . . . 289 VAL CB . 15932 1 711 . 1 1 76 76 VAL CG1 C 13 22.455 0.400 . 1 . . . . 289 VAL CG1 . 15932 1 712 . 1 1 76 76 VAL CG2 C 13 26.506 0.400 . 1 . . . . 289 VAL CG2 . 15932 1 713 . 1 1 76 76 VAL N N 15 120.599 0.400 . 1 . . . . 289 VAL N . 15932 1 714 . 1 1 77 77 GLU H H 1 9.095 0.020 . 1 . . . . 290 GLU H . 15932 1 715 . 1 1 77 77 GLU HA H 1 4.027 0.020 . 1 . . . . 290 GLU HA . 15932 1 716 . 1 1 77 77 GLU HB2 H 1 2.035 0.020 . 2 . . . . 290 GLU HB2 . 15932 1 717 . 1 1 77 77 GLU HB3 H 1 1.911 0.020 . 2 . . . . 290 GLU HB3 . 15932 1 718 . 1 1 77 77 GLU HG2 H 1 2.236 0.020 . 2 . . . . 290 GLU HG2 . 15932 1 719 . 1 1 77 77 GLU HG3 H 1 2.365 0.020 . 2 . . . . 290 GLU HG3 . 15932 1 720 . 1 1 77 77 GLU C C 13 179.172 0.400 . 1 . . . . 290 GLU C . 15932 1 721 . 1 1 77 77 GLU CA C 13 59.831 0.400 . 1 . . . . 290 GLU CA . 15932 1 722 . 1 1 77 77 GLU CB C 13 29.493 0.400 . 1 . . . . 290 GLU CB . 15932 1 723 . 1 1 77 77 GLU CG C 13 36.223 0.400 . 1 . . . . 290 GLU CG . 15932 1 724 . 1 1 77 77 GLU N N 15 119.191 0.400 . 1 . . . . 290 GLU N . 15932 1 725 . 1 1 78 78 GLN H H 1 7.523 0.020 . 1 . . . . 291 GLN H . 15932 1 726 . 1 1 78 78 GLN HA H 1 4.079 0.020 . 1 . . . . 291 GLN HA . 15932 1 727 . 1 1 78 78 GLN HB2 H 1 1.922 0.020 . 1 . . . . 291 GLN HB2 . 15932 1 728 . 1 1 78 78 GLN HB3 H 1 1.922 0.020 . 1 . . . . 291 GLN HB3 . 15932 1 729 . 1 1 78 78 GLN HG2 H 1 2.431 0.020 . 1 . . . . 291 GLN HG2 . 15932 1 730 . 1 1 78 78 GLN HG3 H 1 2.431 0.020 . 1 . . . . 291 GLN HG3 . 15932 1 731 . 1 1 78 78 GLN C C 13 177.815 0.400 . 1 . . . . 291 GLN C . 15932 1 732 . 1 1 78 78 GLN CA C 13 58.920 0.400 . 1 . . . . 291 GLN CA . 15932 1 733 . 1 1 78 78 GLN CG C 13 35.031 0.400 . 1 . . . . 291 GLN CG . 15932 1 734 . 1 1 78 78 GLN N N 15 117.101 0.400 . 1 . . . . 291 GLN N . 15932 1 735 . 1 1 79 79 ILE H H 1 8.368 0.020 . 1 . . . . 292 ILE H . 15932 1 736 . 1 1 79 79 ILE HA H 1 3.427 0.020 . 1 . . . . 292 ILE HA . 15932 1 737 . 1 1 79 79 ILE HB H 1 1.970 0.020 . 1 . . . . 292 ILE HB . 15932 1 738 . 1 1 79 79 ILE HD11 H 1 0.574 0.020 . 1 . . . . 292 ILE HD11 . 15932 1 739 . 1 1 79 79 ILE HD12 H 1 0.574 0.020 . 1 . . . . 292 ILE HD12 . 15932 1 740 . 1 1 79 79 ILE HD13 H 1 0.574 0.020 . 1 . . . . 292 ILE HD13 . 15932 1 741 . 1 1 79 79 ILE HG12 H 1 0.681 0.020 . 1 . . . . 292 ILE HG12 . 15932 1 742 . 1 1 79 79 ILE HG13 H 1 0.681 0.020 . 1 . . . . 292 ILE HG13 . 15932 1 743 . 1 1 79 79 ILE HG21 H 1 0.574 0.020 . 1 . . . . 292 ILE HG21 . 15932 1 744 . 1 1 79 79 ILE HG22 H 1 0.574 0.020 . 1 . . . . 292 ILE HG22 . 15932 1 745 . 1 1 79 79 ILE HG23 H 1 0.574 0.020 . 1 . . . . 292 ILE HG23 . 15932 1 746 . 1 1 79 79 ILE C C 13 177.133 0.400 . 1 . . . . 292 ILE C . 15932 1 747 . 1 1 79 79 ILE CA C 13 67.132 0.400 . 1 . . . . 292 ILE CA . 15932 1 748 . 1 1 79 79 ILE CB C 13 37.163 0.400 . 1 . . . . 292 ILE CB . 15932 1 749 . 1 1 79 79 ILE CD1 C 13 12.564 0.400 . 1 . . . . 292 ILE CD1 . 15932 1 750 . 1 1 79 79 ILE CG1 C 13 29.399 0.400 . 1 . . . . 292 ILE CG1 . 15932 1 751 . 1 1 79 79 ILE CG2 C 13 16.426 0.400 . 1 . . . . 292 ILE CG2 . 15932 1 752 . 1 1 79 79 ILE N N 15 120.006 0.400 . 1 . . . . 292 ILE N . 15932 1 753 . 1 1 80 80 TYR H H 1 8.302 0.020 . 1 . . . . 293 TYR H . 15932 1 754 . 1 1 80 80 TYR HA H 1 4.179 0.020 . 1 . . . . 293 TYR HA . 15932 1 755 . 1 1 80 80 TYR HB2 H 1 1.967 0.020 . 2 . . . . 293 TYR HB2 . 15932 1 756 . 1 1 80 80 TYR HB3 H 1 2.997 0.020 . 2 . . . . 293 TYR HB3 . 15932 1 757 . 1 1 80 80 TYR HD1 H 1 7.100 0.020 . 1 . . . . 293 TYR HD1 . 15932 1 758 . 1 1 80 80 TYR HE1 H 1 6.589 0.020 . 1 . . . . 293 TYR HE1 . 15932 1 759 . 1 1 80 80 TYR C C 13 178.907 0.400 . 1 . . . . 293 TYR C . 15932 1 760 . 1 1 80 80 TYR CA C 13 61.737 0.400 . 1 . . . . 293 TYR CA . 15932 1 761 . 1 1 80 80 TYR CB C 13 37.201 0.400 . 1 . . . . 293 TYR CB . 15932 1 762 . 1 1 80 80 TYR CD1 C 13 131.935 0.400 . 1 . . . . 293 TYR CD1 . 15932 1 763 . 1 1 80 80 TYR CE1 C 13 118.109 0.400 . 1 . . . . 293 TYR CE1 . 15932 1 764 . 1 1 80 80 TYR N N 15 116.291 0.400 . 1 . . . . 293 TYR N . 15932 1 765 . 1 1 81 81 GLU H H 1 8.170 0.020 . 1 . . . . 294 GLU H . 15932 1 766 . 1 1 81 81 GLU HA H 1 4.036 0.020 . 1 . . . . 294 GLU HA . 15932 1 767 . 1 1 81 81 GLU HB2 H 1 2.175 0.020 . 2 . . . . 294 GLU HB2 . 15932 1 768 . 1 1 81 81 GLU HB3 H 1 2.025 0.020 . 2 . . . . 294 GLU HB3 . 15932 1 769 . 1 1 81 81 GLU HG2 H 1 2.175 0.020 . 2 . . . . 294 GLU HG2 . 15932 1 770 . 1 1 81 81 GLU HG3 H 1 2.376 0.020 . 2 . . . . 294 GLU HG3 . 15932 1 771 . 1 1 81 81 GLU C C 13 178.414 0.400 . 1 . . . . 294 GLU C . 15932 1 772 . 1 1 81 81 GLU CA C 13 59.768 0.400 . 1 . . . . 294 GLU CA . 15932 1 773 . 1 1 81 81 GLU CB C 13 29.489 0.400 . 1 . . . . 294 GLU CB . 15932 1 774 . 1 1 81 81 GLU CG C 13 36.278 0.400 . 1 . . . . 294 GLU CG . 15932 1 775 . 1 1 81 81 GLU N N 15 120.325 0.400 . 1 . . . . 294 GLU N . 15932 1 776 . 1 1 82 82 ILE H H 1 8.501 0.020 . 1 . . . . 295 ILE H . 15932 1 777 . 1 1 82 82 ILE HA H 1 3.675 0.020 . 1 . . . . 295 ILE HA . 15932 1 778 . 1 1 82 82 ILE HB H 1 1.726 0.020 . 1 . . . . 295 ILE HB . 15932 1 779 . 1 1 82 82 ILE HD11 H 1 0.447 0.020 . 1 . . . . 295 ILE HD11 . 15932 1 780 . 1 1 82 82 ILE HD12 H 1 0.447 0.020 . 1 . . . . 295 ILE HD12 . 15932 1 781 . 1 1 82 82 ILE HD13 H 1 0.447 0.020 . 1 . . . . 295 ILE HD13 . 15932 1 782 . 1 1 82 82 ILE HG12 H 1 0.512 0.020 . 1 . . . . 295 ILE HG12 . 15932 1 783 . 1 1 82 82 ILE HG13 H 1 0.512 0.020 . 1 . . . . 295 ILE HG13 . 15932 1 784 . 1 1 82 82 ILE HG21 H 1 0.650 0.020 . 1 . . . . 295 ILE HG21 . 15932 1 785 . 1 1 82 82 ILE HG22 H 1 0.650 0.020 . 1 . . . . 295 ILE HG22 . 15932 1 786 . 1 1 82 82 ILE HG23 H 1 0.650 0.020 . 1 . . . . 295 ILE HG23 . 15932 1 787 . 1 1 82 82 ILE C C 13 177.751 0.400 . 1 . . . . 295 ILE C . 15932 1 788 . 1 1 82 82 ILE CA C 13 65.288 0.400 . 1 . . . . 295 ILE CA . 15932 1 789 . 1 1 82 82 ILE CB C 13 38.497 0.400 . 1 . . . . 295 ILE CB . 15932 1 790 . 1 1 82 82 ILE CD1 C 13 15.315 0.400 . 1 . . . . 295 ILE CD1 . 15932 1 791 . 1 1 82 82 ILE CG1 C 13 29.743 0.400 . 1 . . . . 295 ILE CG1 . 15932 1 792 . 1 1 82 82 ILE CG2 C 13 17.922 0.400 . 1 . . . . 295 ILE CG2 . 15932 1 793 . 1 1 82 82 ILE N N 15 120.434 0.400 . 1 . . . . 295 ILE N . 15932 1 794 . 1 1 83 83 LEU H H 1 8.508 0.020 . 1 . . . . 296 LEU H . 15932 1 795 . 1 1 83 83 LEU HA H 1 4.289 0.020 . 1 . . . . 296 LEU HA . 15932 1 796 . 1 1 83 83 LEU HB2 H 1 2.175 0.020 . 2 . . . . 296 LEU HB2 . 15932 1 797 . 1 1 83 83 LEU HB3 H 1 1.982 0.020 . 2 . . . . 296 LEU HB3 . 15932 1 798 . 1 1 83 83 LEU HD11 H 1 0.757 0.020 . 2 . . . . 296 LEU HD11 . 15932 1 799 . 1 1 83 83 LEU HD12 H 1 0.757 0.020 . 2 . . . . 296 LEU HD12 . 15932 1 800 . 1 1 83 83 LEU HD13 H 1 0.757 0.020 . 2 . . . . 296 LEU HD13 . 15932 1 801 . 1 1 83 83 LEU HD21 H 1 1.052 0.020 . 2 . . . . 296 LEU HD21 . 15932 1 802 . 1 1 83 83 LEU HD22 H 1 1.052 0.020 . 2 . . . . 296 LEU HD22 . 15932 1 803 . 1 1 83 83 LEU HD23 H 1 1.052 0.020 . 2 . . . . 296 LEU HD23 . 15932 1 804 . 1 1 83 83 LEU HG H 1 1.000 0.020 . 1 . . . . 296 LEU HG . 15932 1 805 . 1 1 83 83 LEU C C 13 178.393 0.400 . 1 . . . . 296 LEU C . 15932 1 806 . 1 1 83 83 LEU CA C 13 58.937 0.400 . 1 . . . . 296 LEU CA . 15932 1 807 . 1 1 83 83 LEU CB C 13 39.626 0.400 . 1 . . . . 296 LEU CB . 15932 1 808 . 1 1 83 83 LEU CD1 C 13 19.050 0.400 . 1 . . . . 296 LEU CD1 . 15932 1 809 . 1 1 83 83 LEU CD2 C 13 22.370 0.400 . 1 . . . . 296 LEU CD2 . 15932 1 810 . 1 1 83 83 LEU CG C 13 27.238 0.400 . 1 . . . . 296 LEU CG . 15932 1 811 . 1 1 83 83 LEU N N 15 116.807 0.400 . 1 . . . . 296 LEU N . 15932 1 812 . 1 1 84 84 LYS H H 1 8.048 0.020 . 1 . . . . 297 LYS H . 15932 1 813 . 1 1 84 84 LYS HA H 1 3.967 0.020 . 1 . . . . 297 LYS HA . 15932 1 814 . 1 1 84 84 LYS HD2 H 1 1.683 0.020 . 1 . . . . 297 LYS HD2 . 15932 1 815 . 1 1 84 84 LYS HD3 H 1 1.683 0.020 . 1 . . . . 297 LYS HD3 . 15932 1 816 . 1 1 84 84 LYS HE2 H 1 3.452 0.020 . 1 . . . . 297 LYS HE2 . 15932 1 817 . 1 1 84 84 LYS HE3 H 1 3.452 0.020 . 1 . . . . 297 LYS HE3 . 15932 1 818 . 1 1 84 84 LYS HG2 H 1 1.373 0.020 . 2 . . . . 297 LYS HG2 . 15932 1 819 . 1 1 84 84 LYS HG3 H 1 1.490 0.020 . 2 . . . . 297 LYS HG3 . 15932 1 820 . 1 1 84 84 LYS C C 13 177.773 0.400 . 1 . . . . 297 LYS C . 15932 1 821 . 1 1 84 84 LYS CA C 13 58.890 0.400 . 1 . . . . 297 LYS CA . 15932 1 822 . 1 1 84 84 LYS CB C 13 31.169 0.400 . 1 . . . . 297 LYS CB . 15932 1 823 . 1 1 84 84 LYS CD C 13 28.787 0.400 . 1 . . . . 297 LYS CD . 15932 1 824 . 1 1 84 84 LYS CE C 13 41.853 0.400 . 1 . . . . 297 LYS CE . 15932 1 825 . 1 1 84 84 LYS CG C 13 24.649 0.400 . 1 . . . . 297 LYS CG . 15932 1 826 . 1 1 84 84 LYS N N 15 118.687 0.400 . 1 . . . . 297 LYS N . 15932 1 827 . 1 1 85 85 ILE H H 1 7.694 0.020 . 1 . . . . 298 ILE H . 15932 1 828 . 1 1 85 85 ILE HA H 1 3.456 0.020 . 1 . . . . 298 ILE HA . 15932 1 829 . 1 1 85 85 ILE HB H 1 2.167 0.020 . 1 . . . . 298 ILE HB . 15932 1 830 . 1 1 85 85 ILE HD11 H 1 0.820 0.020 . 1 . . . . 298 ILE HD11 . 15932 1 831 . 1 1 85 85 ILE HD12 H 1 0.820 0.020 . 1 . . . . 298 ILE HD12 . 15932 1 832 . 1 1 85 85 ILE HD13 H 1 0.820 0.020 . 1 . . . . 298 ILE HD13 . 15932 1 833 . 1 1 85 85 ILE HG12 H 1 1.030 0.020 . 1 . . . . 298 ILE HG12 . 15932 1 834 . 1 1 85 85 ILE HG13 H 1 1.030 0.020 . 1 . . . . 298 ILE HG13 . 15932 1 835 . 1 1 85 85 ILE HG21 H 1 0.320 0.020 . 1 . . . . 298 ILE HG21 . 15932 1 836 . 1 1 85 85 ILE HG22 H 1 0.320 0.020 . 1 . . . . 298 ILE HG22 . 15932 1 837 . 1 1 85 85 ILE HG23 H 1 0.320 0.020 . 1 . . . . 298 ILE HG23 . 15932 1 838 . 1 1 85 85 ILE C C 13 179.100 0.400 . 1 . . . . 298 ILE C . 15932 1 839 . 1 1 85 85 ILE CA C 13 65.307 0.400 . 1 . . . . 298 ILE CA . 15932 1 840 . 1 1 85 85 ILE CB C 13 36.965 0.400 . 1 . . . . 298 ILE CB . 15932 1 841 . 1 1 85 85 ILE CD1 C 13 13.068 0.400 . 1 . . . . 298 ILE CD1 . 15932 1 842 . 1 1 85 85 ILE CG1 C 13 28.954 0.400 . 1 . . . . 298 ILE CG1 . 15932 1 843 . 1 1 85 85 ILE CG2 C 13 16.174 0.400 . 1 . . . . 298 ILE CG2 . 15932 1 844 . 1 1 85 85 ILE N N 15 118.157 0.400 . 1 . . . . 298 ILE N . 15932 1 845 . 1 1 86 86 TYR H H 1 7.613 0.020 . 1 . . . . 299 TYR H . 15932 1 846 . 1 1 86 86 TYR HA H 1 4.103 0.020 . 1 . . . . 299 TYR HA . 15932 1 847 . 1 1 86 86 TYR HB2 H 1 2.980 0.020 . 1 . . . . 299 TYR HB2 . 15932 1 848 . 1 1 86 86 TYR HB3 H 1 2.980 0.020 . 1 . . . . 299 TYR HB3 . 15932 1 849 . 1 1 86 86 TYR HD1 H 1 7.268 0.020 . 1 . . . . 299 TYR HD1 . 15932 1 850 . 1 1 86 86 TYR HE1 H 1 6.169 0.020 . 1 . . . . 299 TYR HE1 . 15932 1 851 . 1 1 86 86 TYR C C 13 177.425 0.400 . 1 . . . . 299 TYR C . 15932 1 852 . 1 1 86 86 TYR CA C 13 63.129 0.400 . 1 . . . . 299 TYR CA . 15932 1 853 . 1 1 86 86 TYR CB C 13 38.745 0.400 . 1 . . . . 299 TYR CB . 15932 1 854 . 1 1 86 86 TYR CD1 C 13 133.199 0.400 . 1 . . . . 299 TYR CD1 . 15932 1 855 . 1 1 86 86 TYR CE1 C 13 117.524 0.400 . 1 . . . . 299 TYR CE1 . 15932 1 856 . 1 1 86 86 TYR N N 15 115.499 0.400 . 1 . . . . 299 TYR N . 15932 1 857 . 1 1 87 87 GLN H H 1 9.112 0.020 . 1 . . . . 300 GLN H . 15932 1 858 . 1 1 87 87 GLN HA H 1 3.977 0.020 . 1 . . . . 300 GLN HA . 15932 1 859 . 1 1 87 87 GLN HB3 H 1 2.305 0.020 . 1 . . . . 300 GLN HB3 . 15932 1 860 . 1 1 87 87 GLN HG2 H 1 2.095 0.020 . 1 . . . . 300 GLN HG2 . 15932 1 861 . 1 1 87 87 GLN C C 13 176.380 0.400 . 1 . . . . 300 GLN C . 15932 1 862 . 1 1 87 87 GLN CA C 13 58.976 0.400 . 1 . . . . 300 GLN CA . 15932 1 863 . 1 1 87 87 GLN CB C 13 28.819 0.400 . 1 . . . . 300 GLN CB . 15932 1 864 . 1 1 87 87 GLN CG C 13 33.485 0.400 . 1 . . . . 300 GLN CG . 15932 1 865 . 1 1 87 87 GLN N N 15 125.039 0.400 . 1 . . . . 300 GLN N . 15932 1 866 . 1 1 88 88 LEU H H 1 7.536 0.020 . 1 . . . . 301 LEU H . 15932 1 867 . 1 1 88 88 LEU HA H 1 4.309 0.020 . 1 . . . . 301 LEU HA . 15932 1 868 . 1 1 88 88 LEU HB2 H 1 0.841 0.020 . 2 . . . . 301 LEU HB2 . 15932 1 869 . 1 1 88 88 LEU HB3 H 1 1.579 0.020 . 2 . . . . 301 LEU HB3 . 15932 1 870 . 1 1 88 88 LEU HD11 H 1 0.873 0.020 . 2 . . . . 301 LEU HD11 . 15932 1 871 . 1 1 88 88 LEU HD12 H 1 0.873 0.020 . 2 . . . . 301 LEU HD12 . 15932 1 872 . 1 1 88 88 LEU HD13 H 1 0.873 0.020 . 2 . . . . 301 LEU HD13 . 15932 1 873 . 1 1 88 88 LEU HD21 H 1 0.818 0.020 . 2 . . . . 301 LEU HD21 . 15932 1 874 . 1 1 88 88 LEU HD22 H 1 0.818 0.020 . 2 . . . . 301 LEU HD22 . 15932 1 875 . 1 1 88 88 LEU HD23 H 1 0.818 0.020 . 2 . . . . 301 LEU HD23 . 15932 1 876 . 1 1 88 88 LEU HG H 1 1.579 0.020 . 1 . . . . 301 LEU HG . 15932 1 877 . 1 1 88 88 LEU C C 13 177.129 0.400 . 1 . . . . 301 LEU C . 15932 1 878 . 1 1 88 88 LEU CA C 13 55.142 0.400 . 1 . . . . 301 LEU CA . 15932 1 879 . 1 1 88 88 LEU CB C 13 41.809 0.400 . 1 . . . . 301 LEU CB . 15932 1 880 . 1 1 88 88 LEU CD1 C 13 24.905 0.400 . 1 . . . . 301 LEU CD1 . 15932 1 881 . 1 1 88 88 LEU CD2 C 13 23.038 0.400 . 1 . . . . 301 LEU CD2 . 15932 1 882 . 1 1 88 88 LEU CG C 13 26.699 0.400 . 1 . . . . 301 LEU CG . 15932 1 883 . 1 1 88 88 LEU N N 15 115.623 0.400 . 1 . . . . 301 LEU N . 15932 1 884 . 1 1 89 89 MET H H 1 7.025 0.020 . 1 . . . . 302 MET H . 15932 1 885 . 1 1 89 89 MET HA H 1 4.031 0.020 . 1 . . . . 302 MET HA . 15932 1 886 . 1 1 89 89 MET HB2 H 1 1.642 0.020 . 2 . . . . 302 MET HB2 . 15932 1 887 . 1 1 89 89 MET HB3 H 1 1.896 0.020 . 2 . . . . 302 MET HB3 . 15932 1 888 . 1 1 89 89 MET HE1 H 1 1.378 0.020 . 1 . . . . 302 MET HE1 . 15932 1 889 . 1 1 89 89 MET HE2 H 1 1.378 0.020 . 1 . . . . 302 MET HE2 . 15932 1 890 . 1 1 89 89 MET HE3 H 1 1.378 0.020 . 1 . . . . 302 MET HE3 . 15932 1 891 . 1 1 89 89 MET HG2 H 1 2.220 0.020 . 2 . . . . 302 MET HG2 . 15932 1 892 . 1 1 89 89 MET HG3 H 1 2.170 0.020 . 2 . . . . 302 MET HG3 . 15932 1 893 . 1 1 89 89 MET C C 13 172.664 0.400 . 1 . . . . 302 MET C . 15932 1 894 . 1 1 89 89 MET CA C 13 55.513 0.400 . 1 . . . . 302 MET CA . 15932 1 895 . 1 1 89 89 MET CB C 13 33.748 0.400 . 1 . . . . 302 MET CB . 15932 1 896 . 1 1 89 89 MET CE C 13 16.240 0.400 . 1 . . . . 302 MET CE . 15932 1 897 . 1 1 89 89 MET CG C 13 31.632 0.400 . 1 . . . . 302 MET CG . 15932 1 898 . 1 1 89 89 MET N N 15 120.789 0.400 . 1 . . . . 302 MET N . 15932 1 899 . 1 1 90 90 ASP H H 1 8.056 0.020 . 1 . . . . 303 ASP H . 15932 1 900 . 1 1 90 90 ASP HA H 1 4.746 0.020 . 1 . . . . 303 ASP HA . 15932 1 901 . 1 1 90 90 ASP HB2 H 1 2.638 0.020 . 1 . . . . 303 ASP HB2 . 15932 1 902 . 1 1 90 90 ASP HB3 H 1 2.638 0.020 . 1 . . . . 303 ASP HB3 . 15932 1 903 . 1 1 90 90 ASP C C 13 177.139 0.400 . 1 . . . . 303 ASP C . 15932 1 904 . 1 1 90 90 ASP CA C 13 54.411 0.400 . 1 . . . . 303 ASP CA . 15932 1 905 . 1 1 90 90 ASP CB C 13 40.987 0.400 . 1 . . . . 303 ASP CB . 15932 1 906 . 1 1 90 90 ASP N N 15 117.873 0.400 . 1 . . . . 303 ASP N . 15932 1 907 . 1 1 91 91 HIS H H 1 9.371 0.020 . 1 . . . . 304 HIS H . 15932 1 908 . 1 1 91 91 HIS HA H 1 4.657 0.020 . 1 . . . . 304 HIS HA . 15932 1 909 . 1 1 91 91 HIS HB2 H 1 2.598 0.020 . 2 . . . . 304 HIS HB2 . 15932 1 910 . 1 1 91 91 HIS HB3 H 1 3.246 0.020 . 2 . . . . 304 HIS HB3 . 15932 1 911 . 1 1 91 91 HIS HD2 H 1 6.884 0.020 . 1 . . . . 304 HIS HD2 . 15932 1 912 . 1 1 91 91 HIS C C 13 177.332 0.400 . 1 . . . . 304 HIS C . 15932 1 913 . 1 1 91 91 HIS CA C 13 56.031 0.400 . 1 . . . . 304 HIS CA . 15932 1 914 . 1 1 91 91 HIS CB C 13 31.150 0.400 . 1 . . . . 304 HIS CB . 15932 1 915 . 1 1 91 91 HIS CD2 C 13 119.961 0.400 . 1 . . . . 304 HIS CD2 . 15932 1 916 . 1 1 91 91 HIS N N 15 126.666 0.400 . 1 . . . . 304 HIS N . 15932 1 917 . 1 1 92 92 SER H H 1 8.952 0.020 . 1 . . . . 305 SER H . 15932 1 918 . 1 1 92 92 SER HA H 1 4.055 0.020 . 1 . . . . 305 SER HA . 15932 1 919 . 1 1 92 92 SER HB2 H 1 3.917 0.020 . 1 . . . . 305 SER HB2 . 15932 1 920 . 1 1 92 92 SER HB3 H 1 3.917 0.020 . 1 . . . . 305 SER HB3 . 15932 1 921 . 1 1 92 92 SER CA C 13 63.687 0.400 . 1 . . . . 305 SER CA . 15932 1 922 . 1 1 92 92 SER CB C 13 62.694 0.400 . 1 . . . . 305 SER CB . 15932 1 923 . 1 1 92 92 SER N N 15 118.610 0.400 . 1 . . . . 305 SER N . 15932 1 924 . 1 1 93 93 ASN H H 1 8.745 0.020 . 1 . . . . 306 ASN H . 15932 1 925 . 1 1 93 93 ASN HA H 1 4.803 0.020 . 1 . . . . 306 ASN HA . 15932 1 926 . 1 1 93 93 ASN HB2 H 1 2.586 0.020 . 2 . . . . 306 ASN HB2 . 15932 1 927 . 1 1 93 93 ASN HB3 H 1 2.909 0.020 . 2 . . . . 306 ASN HB3 . 15932 1 928 . 1 1 93 93 ASN C C 13 173.428 0.400 . 1 . . . . 306 ASN C . 15932 1 929 . 1 1 93 93 ASN CA C 13 53.018 0.400 . 1 . . . . 306 ASN CA . 15932 1 930 . 1 1 93 93 ASN CB C 13 38.033 0.400 . 1 . . . . 306 ASN CB . 15932 1 931 . 1 1 93 93 ASN N N 15 116.257 0.400 . 1 . . . . 306 ASN N . 15932 1 932 . 1 1 94 94 MET H H 1 7.942 0.020 . 1 . . . . 307 MET H . 15932 1 933 . 1 1 94 94 MET HA H 1 4.683 0.020 . 1 . . . . 307 MET HA . 15932 1 934 . 1 1 94 94 MET HB2 H 1 2.540 0.020 . 1 . . . . 307 MET HB2 . 15932 1 935 . 1 1 94 94 MET HB3 H 1 2.540 0.020 . 1 . . . . 307 MET HB3 . 15932 1 936 . 1 1 94 94 MET HE1 H 1 1.454 0.020 . 1 . . . . 307 MET HE1 . 15932 1 937 . 1 1 94 94 MET HE2 H 1 1.454 0.020 . 1 . . . . 307 MET HE2 . 15932 1 938 . 1 1 94 94 MET HE3 H 1 1.454 0.020 . 1 . . . . 307 MET HE3 . 15932 1 939 . 1 1 94 94 MET C C 13 174.640 0.400 . 1 . . . . 307 MET C . 15932 1 940 . 1 1 94 94 MET CA C 13 53.564 0.400 . 1 . . . . 307 MET CA . 15932 1 941 . 1 1 94 94 MET CB C 13 33.988 0.400 . 1 . . . . 307 MET CB . 15932 1 942 . 1 1 94 94 MET CE C 13 17.647 0.400 . 1 . . . . 307 MET CE . 15932 1 943 . 1 1 94 94 MET CG C 13 32.770 0.400 . 1 . . . . 307 MET CG . 15932 1 944 . 1 1 94 94 MET N N 15 117.799 0.400 . 1 . . . . 307 MET N . 15932 1 945 . 1 1 95 95 ASP H H 1 8.276 0.020 . 1 . . . . 308 ASP H . 15932 1 946 . 1 1 95 95 ASP HA H 1 5.172 0.020 . 1 . . . . 308 ASP HA . 15932 1 947 . 1 1 95 95 ASP HB2 H 1 2.687 0.020 . 2 . . . . 308 ASP HB2 . 15932 1 948 . 1 1 95 95 ASP HB3 H 1 3.440 0.020 . 2 . . . . 308 ASP HB3 . 15932 1 949 . 1 1 95 95 ASP C C 13 176.264 0.400 . 1 . . . . 308 ASP C . 15932 1 950 . 1 1 95 95 ASP CA C 13 55.617 0.400 . 1 . . . . 308 ASP CA . 15932 1 951 . 1 1 95 95 ASP CB C 13 45.114 0.400 . 1 . . . . 308 ASP CB . 15932 1 952 . 1 1 95 95 ASP N N 15 119.567 0.400 . 1 . . . . 308 ASP N . 15932 1 953 . 1 1 96 96 CYS H H 1 8.215 0.020 . 1 . . . . 309 CYS H . 15932 1 954 . 1 1 96 96 CYS HA H 1 4.680 0.020 . 1 . . . . 309 CYS HA . 15932 1 955 . 1 1 96 96 CYS HB2 H 1 2.894 0.020 . 2 . . . . 309 CYS HB2 . 15932 1 956 . 1 1 96 96 CYS HB3 H 1 2.609 0.020 . 2 . . . . 309 CYS HB3 . 15932 1 957 . 1 1 96 96 CYS C C 13 170.157 0.400 . 1 . . . . 309 CYS C . 15932 1 958 . 1 1 96 96 CYS CA C 13 57.203 0.400 . 1 . . . . 309 CYS CA . 15932 1 959 . 1 1 96 96 CYS CB C 13 52.974 0.400 . 1 . . . . 309 CYS CB . 15932 1 960 . 1 1 96 96 CYS N N 15 118.264 0.400 . 1 . . . . 309 CYS N . 15932 1 961 . 1 1 97 97 PHE H H 1 8.108 0.020 . 1 . . . . 310 PHE H . 15932 1 962 . 1 1 97 97 PHE HA H 1 5.071 0.020 . 1 . . . . 310 PHE HA . 15932 1 963 . 1 1 97 97 PHE HB2 H 1 3.135 0.020 . 2 . . . . 310 PHE HB2 . 15932 1 964 . 1 1 97 97 PHE HB3 H 1 2.330 0.020 . 2 . . . . 310 PHE HB3 . 15932 1 965 . 1 1 97 97 PHE HD1 H 1 6.876 0.020 . 1 . . . . 310 PHE HD1 . 15932 1 966 . 1 1 97 97 PHE HE1 H 1 6.157 0.020 . 1 . . . . 310 PHE HE1 . 15932 1 967 . 1 1 97 97 PHE C C 13 171.279 0.400 . 1 . . . . 310 PHE C . 15932 1 968 . 1 1 97 97 PHE CA C 13 57.910 0.400 . 1 . . . . 310 PHE CA . 15932 1 969 . 1 1 97 97 PHE CB C 13 44.724 0.400 . 1 . . . . 310 PHE CB . 15932 1 970 . 1 1 97 97 PHE CD1 C 13 130.728 0.400 . 1 . . . . 310 PHE CD1 . 15932 1 971 . 1 1 97 97 PHE CE1 C 13 129.594 0.400 . 1 . . . . 310 PHE CE1 . 15932 1 972 . 1 1 97 97 PHE N N 15 125.767 0.400 . 1 . . . . 310 PHE N . 15932 1 973 . 1 1 98 98 ILE H H 1 7.647 0.020 . 1 . . . . 311 ILE H . 15932 1 974 . 1 1 98 98 ILE HA H 1 4.581 0.020 . 1 . . . . 311 ILE HA . 15932 1 975 . 1 1 98 98 ILE HB H 1 0.651 0.020 . 1 . . . . 311 ILE HB . 15932 1 976 . 1 1 98 98 ILE HD11 H 1 -0.727 0.020 . 1 . . . . 311 ILE HD11 . 15932 1 977 . 1 1 98 98 ILE HD12 H 1 -0.727 0.020 . 1 . . . . 311 ILE HD12 . 15932 1 978 . 1 1 98 98 ILE HD13 H 1 -0.727 0.020 . 1 . . . . 311 ILE HD13 . 15932 1 979 . 1 1 98 98 ILE HG12 H 1 0.629 0.020 . 2 . . . . 311 ILE HG12 . 15932 1 980 . 1 1 98 98 ILE HG13 H 1 0.301 0.020 . 2 . . . . 311 ILE HG13 . 15932 1 981 . 1 1 98 98 ILE HG21 H 1 -0.059 0.020 . 1 . . . . 311 ILE HG21 . 15932 1 982 . 1 1 98 98 ILE HG22 H 1 -0.059 0.020 . 1 . . . . 311 ILE HG22 . 15932 1 983 . 1 1 98 98 ILE HG23 H 1 -0.059 0.020 . 1 . . . . 311 ILE HG23 . 15932 1 984 . 1 1 98 98 ILE C C 13 172.012 0.400 . 1 . . . . 311 ILE C . 15932 1 985 . 1 1 98 98 ILE CA C 13 58.312 0.400 . 1 . . . . 311 ILE CA . 15932 1 986 . 1 1 98 98 ILE CB C 13 39.964 0.400 . 1 . . . . 311 ILE CB . 15932 1 987 . 1 1 98 98 ILE CD1 C 13 13.005 0.400 . 1 . . . . 311 ILE CD1 . 15932 1 988 . 1 1 98 98 ILE CG1 C 13 26.733 0.400 . 1 . . . . 311 ILE CG1 . 15932 1 989 . 1 1 98 98 ILE CG2 C 13 17.284 0.400 . 1 . . . . 311 ILE CG2 . 15932 1 990 . 1 1 98 98 ILE N N 15 125.102 0.400 . 1 . . . . 311 ILE N . 15932 1 991 . 1 1 99 99 CYS H H 1 8.309 0.020 . 1 . . . . 312 CYS H . 15932 1 992 . 1 1 99 99 CYS HA H 1 4.471 0.020 . 1 . . . . 312 CYS HA . 15932 1 993 . 1 1 99 99 CYS C C 13 171.965 0.400 . 1 . . . . 312 CYS C . 15932 1 994 . 1 1 99 99 CYS CA C 13 56.347 0.400 . 1 . . . . 312 CYS CA . 15932 1 995 . 1 1 99 99 CYS CB C 13 51.093 0.400 . 1 . . . . 312 CYS CB . 15932 1 996 . 1 1 99 99 CYS N N 15 124.548 0.400 . 1 . . . . 312 CYS N . 15932 1 997 . 1 1 100 100 CYS H H 1 9.116 0.020 . 1 . . . . 313 CYS H . 15932 1 998 . 1 1 100 100 CYS HA H 1 5.880 0.020 . 1 . . . . 313 CYS HA . 15932 1 999 . 1 1 100 100 CYS HB2 H 1 2.277 0.020 . 2 . . . . 313 CYS HB2 . 15932 1 1000 . 1 1 100 100 CYS HB3 H 1 2.953 0.020 . 2 . . . . 313 CYS HB3 . 15932 1 1001 . 1 1 100 100 CYS C C 13 173.635 0.400 . 1 . . . . 313 CYS C . 15932 1 1002 . 1 1 100 100 CYS CA C 13 55.906 0.400 . 1 . . . . 313 CYS CA . 15932 1 1003 . 1 1 100 100 CYS CB C 13 52.685 0.400 . 1 . . . . 313 CYS CB . 15932 1 1004 . 1 1 100 100 CYS N N 15 127.015 0.400 . 1 . . . . 313 CYS N . 15932 1 1005 . 1 1 101 101 ILE H H 1 8.896 0.020 . 1 . . . . 314 ILE H . 15932 1 1006 . 1 1 101 101 ILE HA H 1 4.737 0.020 . 1 . . . . 314 ILE HA . 15932 1 1007 . 1 1 101 101 ILE HB H 1 1.754 0.020 . 1 . . . . 314 ILE HB . 15932 1 1008 . 1 1 101 101 ILE HD11 H 1 0.739 0.020 . 1 . . . . 314 ILE HD11 . 15932 1 1009 . 1 1 101 101 ILE HD12 H 1 0.739 0.020 . 1 . . . . 314 ILE HD12 . 15932 1 1010 . 1 1 101 101 ILE HD13 H 1 0.739 0.020 . 1 . . . . 314 ILE HD13 . 15932 1 1011 . 1 1 101 101 ILE HG12 H 1 1.588 0.020 . 1 . . . . 314 ILE HG12 . 15932 1 1012 . 1 1 101 101 ILE HG13 H 1 1.588 0.020 . 1 . . . . 314 ILE HG13 . 15932 1 1013 . 1 1 101 101 ILE HG21 H 1 0.750 0.020 . 1 . . . . 314 ILE HG21 . 15932 1 1014 . 1 1 101 101 ILE HG22 H 1 0.750 0.020 . 1 . . . . 314 ILE HG22 . 15932 1 1015 . 1 1 101 101 ILE HG23 H 1 0.750 0.020 . 1 . . . . 314 ILE HG23 . 15932 1 1016 . 1 1 101 101 ILE C C 13 172.277 0.400 . 1 . . . . 314 ILE C . 15932 1 1017 . 1 1 101 101 ILE CA C 13 60.937 0.400 . 1 . . . . 314 ILE CA . 15932 1 1018 . 1 1 101 101 ILE CB C 13 40.848 0.400 . 1 . . . . 314 ILE CB . 15932 1 1019 . 1 1 101 101 ILE CD1 C 13 13.394 0.400 . 1 . . . . 314 ILE CD1 . 15932 1 1020 . 1 1 101 101 ILE CG1 C 13 27.551 0.400 . 1 . . . . 314 ILE CG1 . 15932 1 1021 . 1 1 101 101 ILE CG2 C 13 16.806 0.400 . 1 . . . . 314 ILE CG2 . 15932 1 1022 . 1 1 101 101 ILE N N 15 121.994 0.400 . 1 . . . . 314 ILE N . 15932 1 1023 . 1 1 102 102 LEU H H 1 8.951 0.020 . 1 . . . . 315 LEU H . 15932 1 1024 . 1 1 102 102 LEU HA H 1 5.285 0.020 . 1 . . . . 315 LEU HA . 15932 1 1025 . 1 1 102 102 LEU HB3 H 1 1.724 0.020 . 1 . . . . 315 LEU HB3 . 15932 1 1026 . 1 1 102 102 LEU HD11 H 1 0.822 0.020 . 1 . . . . 315 LEU HD11 . 15932 1 1027 . 1 1 102 102 LEU HD12 H 1 0.822 0.020 . 1 . . . . 315 LEU HD12 . 15932 1 1028 . 1 1 102 102 LEU HD13 H 1 0.822 0.020 . 1 . . . . 315 LEU HD13 . 15932 1 1029 . 1 1 102 102 LEU C C 13 174.789 0.400 . 1 . . . . 315 LEU C . 15932 1 1030 . 1 1 102 102 LEU CA C 13 52.489 0.400 . 1 . . . . 315 LEU CA . 15932 1 1031 . 1 1 102 102 LEU CB C 13 40.041 0.400 . 1 . . . . 315 LEU CB . 15932 1 1032 . 1 1 102 102 LEU CD1 C 13 25.325 0.400 . 1 . . . . 315 LEU CD1 . 15932 1 1033 . 1 1 102 102 LEU CG C 13 26.480 0.400 . 1 . . . . 315 LEU CG . 15932 1 1034 . 1 1 102 102 LEU N N 15 127.404 0.400 . 1 . . . . 315 LEU N . 15932 1 1035 . 1 1 103 103 SER H H 1 9.096 0.020 . 1 . . . . 316 SER H . 15932 1 1036 . 1 1 103 103 SER HA H 1 4.680 0.020 . 1 . . . . 316 SER HA . 15932 1 1037 . 1 1 103 103 SER HB2 H 1 4.697 0.020 . 1 . . . . 316 SER HB2 . 15932 1 1038 . 1 1 103 103 SER HB3 H 1 4.697 0.020 . 1 . . . . 316 SER HB3 . 15932 1 1039 . 1 1 103 103 SER C C 13 174.555 0.400 . 1 . . . . 316 SER C . 15932 1 1040 . 1 1 103 103 SER CA C 13 56.403 0.400 . 1 . . . . 316 SER CA . 15932 1 1041 . 1 1 103 103 SER CB C 13 63.224 0.400 . 1 . . . . 316 SER CB . 15932 1 1042 . 1 1 103 103 SER N N 15 113.273 0.400 . 1 . . . . 316 SER N . 15932 1 1043 . 1 1 104 104 HIS H H 1 7.515 0.020 . 1 . . . . 317 HIS H . 15932 1 1044 . 1 1 104 104 HIS HA H 1 5.214 0.020 . 1 . . . . 317 HIS HA . 15932 1 1045 . 1 1 104 104 HIS HB2 H 1 3.117 0.020 . 2 . . . . 317 HIS HB2 . 15932 1 1046 . 1 1 104 104 HIS HB3 H 1 2.342 0.020 . 2 . . . . 317 HIS HB3 . 15932 1 1047 . 1 1 104 104 HIS HD2 H 1 6.592 0.020 . 1 . . . . 317 HIS HD2 . 15932 1 1048 . 1 1 104 104 HIS C C 13 175.667 0.400 . 1 . . . . 317 HIS C . 15932 1 1049 . 1 1 104 104 HIS CA C 13 56.371 0.400 . 1 . . . . 317 HIS CA . 15932 1 1050 . 1 1 104 104 HIS CB C 13 34.676 0.400 . 1 . . . . 317 HIS CB . 15932 1 1051 . 1 1 104 104 HIS CD2 C 13 118.614 0.400 . 1 . . . . 317 HIS CD2 . 15932 1 1052 . 1 1 104 104 HIS N N 15 114.740 0.400 . 1 . . . . 317 HIS N . 15932 1 1053 . 1 1 105 105 GLY H H 1 8.368 0.020 . 1 . . . . 318 GLY H . 15932 1 1054 . 1 1 105 105 GLY C C 13 169.470 0.400 . 1 . . . . 318 GLY C . 15932 1 1055 . 1 1 105 105 GLY CA C 13 45.558 0.400 . 1 . . . . 318 GLY CA . 15932 1 1056 . 1 1 105 105 GLY N N 15 107.330 0.400 . 1 . . . . 318 GLY N . 15932 1 1057 . 1 1 106 106 ASP H H 1 7.943 0.020 . 1 . . . . 319 ASP H . 15932 1 1058 . 1 1 106 106 ASP HA H 1 4.622 0.020 . 1 . . . . 319 ASP HA . 15932 1 1059 . 1 1 106 106 ASP HB2 H 1 2.640 0.020 . 2 . . . . 319 ASP HB2 . 15932 1 1060 . 1 1 106 106 ASP HB3 H 1 2.434 0.020 . 2 . . . . 319 ASP HB3 . 15932 1 1061 . 1 1 106 106 ASP C C 13 175.179 0.400 . 1 . . . . 319 ASP C . 15932 1 1062 . 1 1 106 106 ASP CA C 13 53.188 0.400 . 1 . . . . 319 ASP CA . 15932 1 1063 . 1 1 106 106 ASP CB C 13 43.555 0.400 . 1 . . . . 319 ASP CB . 15932 1 1064 . 1 1 106 106 ASP N N 15 116.893 0.400 . 1 . . . . 319 ASP N . 15932 1 1065 . 1 1 107 107 LYS H H 1 9.376 0.020 . 1 . . . . 320 LYS H . 15932 1 1066 . 1 1 107 107 LYS HA H 1 3.956 0.020 . 1 . . . . 320 LYS HA . 15932 1 1067 . 1 1 107 107 LYS HB2 H 1 1.793 0.020 . 1 . . . . 320 LYS HB2 . 15932 1 1068 . 1 1 107 107 LYS HB3 H 1 1.793 0.020 . 1 . . . . 320 LYS HB3 . 15932 1 1069 . 1 1 107 107 LYS HD2 H 1 1.498 0.020 . 1 . . . . 320 LYS HD2 . 15932 1 1070 . 1 1 107 107 LYS HD3 H 1 1.498 0.020 . 1 . . . . 320 LYS HD3 . 15932 1 1071 . 1 1 107 107 LYS HE2 H 1 2.899 0.020 . 1 . . . . 320 LYS HE2 . 15932 1 1072 . 1 1 107 107 LYS HE3 H 1 2.899 0.020 . 1 . . . . 320 LYS HE3 . 15932 1 1073 . 1 1 107 107 LYS HG2 H 1 1.344 0.020 . 2 . . . . 320 LYS HG2 . 15932 1 1074 . 1 1 107 107 LYS HG3 H 1 1.498 0.020 . 2 . . . . 320 LYS HG3 . 15932 1 1075 . 1 1 107 107 LYS C C 13 176.864 0.400 . 1 . . . . 320 LYS C . 15932 1 1076 . 1 1 107 107 LYS CA C 13 58.567 0.400 . 1 . . . . 320 LYS CA . 15932 1 1077 . 1 1 107 107 LYS CB C 13 30.568 0.400 . 1 . . . . 320 LYS CB . 15932 1 1078 . 1 1 107 107 LYS CD C 13 28.813 0.400 . 1 . . . . 320 LYS CD . 15932 1 1079 . 1 1 107 107 LYS CE C 13 41.720 0.400 . 1 . . . . 320 LYS CE . 15932 1 1080 . 1 1 107 107 LYS CG C 13 24.345 0.400 . 1 . . . . 320 LYS CG . 15932 1 1081 . 1 1 107 107 LYS N N 15 122.539 0.400 . 1 . . . . 320 LYS N . 15932 1 1082 . 1 1 108 108 GLY H H 1 9.025 0.020 . 1 . . . . 321 GLY H . 15932 1 1083 . 1 1 108 108 GLY C C 13 173.633 0.400 . 1 . . . . 321 GLY C . 15932 1 1084 . 1 1 108 108 GLY CA C 13 45.491 0.400 . 1 . . . . 321 GLY CA . 15932 1 1085 . 1 1 108 108 GLY N N 15 111.919 0.400 . 1 . . . . 321 GLY N . 15932 1 1086 . 1 1 109 109 ILE H H 1 8.157 0.020 . 1 . . . . 322 ILE H . 15932 1 1087 . 1 1 109 109 ILE HA H 1 4.994 0.020 . 1 . . . . 322 ILE HA . 15932 1 1088 . 1 1 109 109 ILE HB H 1 1.401 0.020 . 1 . . . . 322 ILE HB . 15932 1 1089 . 1 1 109 109 ILE HD11 H 1 0.176 0.020 . 1 . . . . 322 ILE HD11 . 15932 1 1090 . 1 1 109 109 ILE HD12 H 1 0.176 0.020 . 1 . . . . 322 ILE HD12 . 15932 1 1091 . 1 1 109 109 ILE HD13 H 1 0.176 0.020 . 1 . . . . 322 ILE HD13 . 15932 1 1092 . 1 1 109 109 ILE HG12 H 1 0.705 0.020 . 2 . . . . 322 ILE HG12 . 15932 1 1093 . 1 1 109 109 ILE HG13 H 1 0.979 0.020 . 2 . . . . 322 ILE HG13 . 15932 1 1094 . 1 1 109 109 ILE HG21 H 1 0.625 0.020 . 1 . . . . 322 ILE HG21 . 15932 1 1095 . 1 1 109 109 ILE HG22 H 1 0.625 0.020 . 1 . . . . 322 ILE HG22 . 15932 1 1096 . 1 1 109 109 ILE HG23 H 1 0.625 0.020 . 1 . . . . 322 ILE HG23 . 15932 1 1097 . 1 1 109 109 ILE C C 13 174.524 0.400 . 1 . . . . 322 ILE C . 15932 1 1098 . 1 1 109 109 ILE CA C 13 59.009 0.400 . 1 . . . . 322 ILE CA . 15932 1 1099 . 1 1 109 109 ILE CB C 13 43.375 0.400 . 1 . . . . 322 ILE CB . 15932 1 1100 . 1 1 109 109 ILE CD1 C 13 13.676 0.400 . 1 . . . . 322 ILE CD1 . 15932 1 1101 . 1 1 109 109 ILE CG1 C 13 26.373 0.400 . 1 . . . . 322 ILE CG1 . 15932 1 1102 . 1 1 109 109 ILE CG2 C 13 18.739 0.400 . 1 . . . . 322 ILE CG2 . 15932 1 1103 . 1 1 109 109 ILE N N 15 116.465 0.400 . 1 . . . . 322 ILE N . 15932 1 1104 . 1 1 110 110 ILE H H 1 8.443 0.020 . 1 . . . . 323 ILE H . 15932 1 1105 . 1 1 110 110 ILE HA H 1 4.530 0.020 . 1 . . . . 323 ILE HA . 15932 1 1106 . 1 1 110 110 ILE HB H 1 1.753 0.020 . 1 . . . . 323 ILE HB . 15932 1 1107 . 1 1 110 110 ILE HD11 H 1 0.668 0.020 . 1 . . . . 323 ILE HD11 . 15932 1 1108 . 1 1 110 110 ILE HD12 H 1 0.668 0.020 . 1 . . . . 323 ILE HD12 . 15932 1 1109 . 1 1 110 110 ILE HD13 H 1 0.668 0.020 . 1 . . . . 323 ILE HD13 . 15932 1 1110 . 1 1 110 110 ILE HG12 H 1 1.426 0.020 . 2 . . . . 323 ILE HG12 . 15932 1 1111 . 1 1 110 110 ILE HG13 H 1 1.003 0.020 . 2 . . . . 323 ILE HG13 . 15932 1 1112 . 1 1 110 110 ILE HG21 H 1 0.765 0.020 . 1 . . . . 323 ILE HG21 . 15932 1 1113 . 1 1 110 110 ILE HG22 H 1 0.765 0.020 . 1 . . . . 323 ILE HG22 . 15932 1 1114 . 1 1 110 110 ILE HG23 H 1 0.765 0.020 . 1 . . . . 323 ILE HG23 . 15932 1 1115 . 1 1 110 110 ILE C C 13 174.337 0.400 . 1 . . . . 323 ILE C . 15932 1 1116 . 1 1 110 110 ILE CA C 13 58.547 0.400 . 1 . . . . 323 ILE CA . 15932 1 1117 . 1 1 110 110 ILE CB C 13 41.604 0.400 . 1 . . . . 323 ILE CB . 15932 1 1118 . 1 1 110 110 ILE CD1 C 13 14.675 0.400 . 1 . . . . 323 ILE CD1 . 15932 1 1119 . 1 1 110 110 ILE CG1 C 13 27.207 0.400 . 1 . . . . 323 ILE CG1 . 15932 1 1120 . 1 1 110 110 ILE CG2 C 13 19.205 0.400 . 1 . . . . 323 ILE CG2 . 15932 1 1121 . 1 1 110 110 ILE N N 15 116.661 0.400 . 1 . . . . 323 ILE N . 15932 1 1122 . 1 1 111 111 TYR H H 1 8.584 0.020 . 1 . . . . 324 TYR H . 15932 1 1123 . 1 1 111 111 TYR HA H 1 5.557 0.020 . 1 . . . . 324 TYR HA . 15932 1 1124 . 1 1 111 111 TYR HB2 H 1 2.527 0.020 . 2 . . . . 324 TYR HB2 . 15932 1 1125 . 1 1 111 111 TYR HB3 H 1 3.337 0.020 . 2 . . . . 324 TYR HB3 . 15932 1 1126 . 1 1 111 111 TYR HD1 H 1 6.658 0.020 . 1 . . . . 324 TYR HD1 . 15932 1 1127 . 1 1 111 111 TYR HE1 H 1 6.592 0.020 . 1 . . . . 324 TYR HE1 . 15932 1 1128 . 1 1 111 111 TYR C C 13 178.528 0.400 . 1 . . . . 324 TYR C . 15932 1 1129 . 1 1 111 111 TYR CA C 13 56.571 0.400 . 1 . . . . 324 TYR CA . 15932 1 1130 . 1 1 111 111 TYR CB C 13 39.984 0.400 . 1 . . . . 324 TYR CB . 15932 1 1131 . 1 1 111 111 TYR CD1 C 13 131.750 0.400 . 1 . . . . 324 TYR CD1 . 15932 1 1132 . 1 1 111 111 TYR CE1 C 13 118.106 0.400 . 1 . . . . 324 TYR CE1 . 15932 1 1133 . 1 1 111 111 TYR N N 15 119.472 0.400 . 1 . . . . 324 TYR N . 15932 1 1134 . 1 1 112 112 GLY H H 1 8.522 0.020 . 1 . . . . 325 GLY H . 15932 1 1135 . 1 1 112 112 GLY C C 13 174.755 0.400 . 1 . . . . 325 GLY C . 15932 1 1136 . 1 1 112 112 GLY CA C 13 43.145 0.400 . 1 . . . . 325 GLY CA . 15932 1 1137 . 1 1 112 112 GLY N N 15 107.078 0.400 . 1 . . . . 325 GLY N . 15932 1 1138 . 1 1 113 113 THR H H 1 8.245 0.020 . 1 . . . . 326 THR H . 15932 1 1139 . 1 1 113 113 THR HA H 1 3.186 0.020 . 1 . . . . 326 THR HA . 15932 1 1140 . 1 1 113 113 THR HB H 1 4.175 0.020 . 1 . . . . 326 THR HB . 15932 1 1141 . 1 1 113 113 THR HG21 H 1 0.393 0.020 . 1 . . . . 326 THR HG21 . 15932 1 1142 . 1 1 113 113 THR HG22 H 1 0.393 0.020 . 1 . . . . 326 THR HG22 . 15932 1 1143 . 1 1 113 113 THR HG23 H 1 0.393 0.020 . 1 . . . . 326 THR HG23 . 15932 1 1144 . 1 1 113 113 THR C C 13 173.264 0.400 . 1 . . . . 326 THR C . 15932 1 1145 . 1 1 113 113 THR CA C 13 64.857 0.400 . 1 . . . . 326 THR CA . 15932 1 1146 . 1 1 113 113 THR CB C 13 66.749 0.400 . 1 . . . . 326 THR CB . 15932 1 1147 . 1 1 113 113 THR CG2 C 13 22.575 0.400 . 1 . . . . 326 THR CG2 . 15932 1 1148 . 1 1 113 113 THR N N 15 113.146 0.400 . 1 . . . . 326 THR N . 15932 1 1149 . 1 1 114 114 ASP H H 1 8.801 0.020 . 1 . . . . 327 ASP H . 15932 1 1150 . 1 1 114 114 ASP HA H 1 4.099 0.020 . 1 . . . . 327 ASP HA . 15932 1 1151 . 1 1 114 114 ASP HB2 H 1 2.878 0.020 . 2 . . . . 327 ASP HB2 . 15932 1 1152 . 1 1 114 114 ASP HB3 H 1 2.497 0.020 . 2 . . . . 327 ASP HB3 . 15932 1 1153 . 1 1 114 114 ASP C C 13 176.262 0.400 . 1 . . . . 327 ASP C . 15932 1 1154 . 1 1 114 114 ASP CA C 13 52.768 0.400 . 1 . . . . 327 ASP CA . 15932 1 1155 . 1 1 114 114 ASP CB C 13 39.312 0.400 . 1 . . . . 327 ASP CB . 15932 1 1156 . 1 1 114 114 ASP N N 15 112.026 0.400 . 1 . . . . 327 ASP N . 15932 1 1157 . 1 1 115 115 GLY H H 1 8.462 0.020 . 1 . . . . 328 GLY H . 15932 1 1158 . 1 1 115 115 GLY HA2 H 1 4.010 0.020 . 1 . . . . 328 GLY HA2 . 15932 1 1159 . 1 1 115 115 GLY HA3 H 1 4.010 0.020 . 1 . . . . 328 GLY HA3 . 15932 1 1160 . 1 1 115 115 GLY C C 13 171.918 0.400 . 1 . . . . 328 GLY C . 15932 1 1161 . 1 1 115 115 GLY CA C 13 45.463 0.400 . 1 . . . . 328 GLY CA . 15932 1 1162 . 1 1 115 115 GLY N N 15 107.749 0.400 . 1 . . . . 328 GLY N . 15932 1 1163 . 1 1 116 116 GLN H H 1 6.657 0.020 . 1 . . . . 329 GLN H . 15932 1 1164 . 1 1 116 116 GLN HA H 1 4.441 0.020 . 1 . . . . 329 GLN HA . 15932 1 1165 . 1 1 116 116 GLN HB3 H 1 2.219 0.020 . 1 . . . . 329 GLN HB3 . 15932 1 1166 . 1 1 116 116 GLN HE21 H 1 6.984 0.020 . 2 . . . . 329 GLN HE21 . 15932 1 1167 . 1 1 116 116 GLN HE22 H 1 7.538 0.020 . 2 . . . . 329 GLN HE22 . 15932 1 1168 . 1 1 116 116 GLN HG2 H 1 2.424 0.020 . 2 . . . . 329 GLN HG2 . 15932 1 1169 . 1 1 116 116 GLN HG3 H 1 2.222 0.020 . 2 . . . . 329 GLN HG3 . 15932 1 1170 . 1 1 116 116 GLN C C 13 174.196 0.400 . 1 . . . . 329 GLN C . 15932 1 1171 . 1 1 116 116 GLN CA C 13 55.204 0.400 . 1 . . . . 329 GLN CA . 15932 1 1172 . 1 1 116 116 GLN CB C 13 28.541 0.400 . 1 . . . . 329 GLN CB . 15932 1 1173 . 1 1 116 116 GLN CG C 13 34.899 0.400 . 1 . . . . 329 GLN CG . 15932 1 1174 . 1 1 116 116 GLN N N 15 115.146 0.400 . 1 . . . . 329 GLN N . 15932 1 1175 . 1 1 116 116 GLN NE2 N 15 113.450 0.400 . 1 . . . . 329 GLN NE2 . 15932 1 1176 . 1 1 117 117 GLU H H 1 8.624 0.020 . 1 . . . . 330 GLU H . 15932 1 1177 . 1 1 117 117 GLU HA H 1 4.733 0.020 . 1 . . . . 330 GLU HA . 15932 1 1178 . 1 1 117 117 GLU C C 13 175.357 0.400 . 1 . . . . 330 GLU C . 15932 1 1179 . 1 1 117 117 GLU CA C 13 55.191 0.400 . 1 . . . . 330 GLU CA . 15932 1 1180 . 1 1 117 117 GLU CB C 13 32.586 0.400 . 1 . . . . 330 GLU CB . 15932 1 1181 . 1 1 117 117 GLU CG C 13 36.102 0.400 . 1 . . . . 330 GLU CG . 15932 1 1182 . 1 1 117 117 GLU N N 15 119.031 0.400 . 1 . . . . 330 GLU N . 15932 1 1183 . 1 1 118 118 ALA H H 1 8.995 0.020 . 1 . . . . 331 ALA H . 15932 1 1184 . 1 1 118 118 ALA HA H 1 5.165 0.020 . 1 . . . . 331 ALA HA . 15932 1 1185 . 1 1 118 118 ALA HB1 H 1 1.138 0.020 . 1 . . . . 331 ALA HB1 . 15932 1 1186 . 1 1 118 118 ALA HB2 H 1 1.138 0.020 . 1 . . . . 331 ALA HB2 . 15932 1 1187 . 1 1 118 118 ALA HB3 H 1 1.138 0.020 . 1 . . . . 331 ALA HB3 . 15932 1 1188 . 1 1 118 118 ALA C C 13 173.650 0.400 . 1 . . . . 331 ALA C . 15932 1 1189 . 1 1 118 118 ALA CA C 13 48.343 0.400 . 1 . . . . 331 ALA CA . 15932 1 1190 . 1 1 118 118 ALA CB C 13 20.353 0.400 . 1 . . . . 331 ALA CB . 15932 1 1191 . 1 1 118 118 ALA N N 15 123.550 0.400 . 1 . . . . 331 ALA N . 15932 1 1192 . 1 1 119 119 PRO HA H 1 4.819 0.020 . 1 . . . . 332 PRO HA . 15932 1 1193 . 1 1 119 119 PRO C C 13 177.819 0.400 . 1 . . . . 332 PRO C . 15932 1 1194 . 1 1 119 119 PRO CA C 13 62.007 0.400 . 1 . . . . 332 PRO CA . 15932 1 1195 . 1 1 119 119 PRO CB C 13 32.081 0.400 . 1 . . . . 332 PRO CB . 15932 1 1196 . 1 1 119 119 PRO CG C 13 28.001 0.400 . 1 . . . . 332 PRO CG . 15932 1 1197 . 1 1 120 120 ILE H H 1 8.574 0.020 . 1 . . . . 333 ILE H . 15932 1 1198 . 1 1 120 120 ILE HA H 1 3.278 0.020 . 1 . . . . 333 ILE HA . 15932 1 1199 . 1 1 120 120 ILE HB H 1 1.518 0.020 . 1 . . . . 333 ILE HB . 15932 1 1200 . 1 1 120 120 ILE HD11 H 1 0.663 0.020 . 1 . . . . 333 ILE HD11 . 15932 1 1201 . 1 1 120 120 ILE HD12 H 1 0.663 0.020 . 1 . . . . 333 ILE HD12 . 15932 1 1202 . 1 1 120 120 ILE HD13 H 1 0.663 0.020 . 1 . . . . 333 ILE HD13 . 15932 1 1203 . 1 1 120 120 ILE HG21 H 1 0.870 0.020 . 1 . . . . 333 ILE HG21 . 15932 1 1204 . 1 1 120 120 ILE HG22 H 1 0.870 0.020 . 1 . . . . 333 ILE HG22 . 15932 1 1205 . 1 1 120 120 ILE HG23 H 1 0.870 0.020 . 1 . . . . 333 ILE HG23 . 15932 1 1206 . 1 1 120 120 ILE C C 13 177.316 0.400 . 1 . . . . 333 ILE C . 15932 1 1207 . 1 1 120 120 ILE CA C 13 66.025 0.400 . 1 . . . . 333 ILE CA . 15932 1 1208 . 1 1 120 120 ILE CB C 13 37.991 0.400 . 1 . . . . 333 ILE CB . 15932 1 1209 . 1 1 120 120 ILE CD1 C 13 13.486 0.400 . 1 . . . . 333 ILE CD1 . 15932 1 1210 . 1 1 120 120 ILE CG1 C 13 30.357 0.400 . 1 . . . . 333 ILE CG1 . 15932 1 1211 . 1 1 120 120 ILE CG2 C 13 17.493 0.400 . 1 . . . . 333 ILE CG2 . 15932 1 1212 . 1 1 120 120 ILE N N 15 126.740 0.400 . 1 . . . . 333 ILE N . 15932 1 1213 . 1 1 121 121 TYR H H 1 9.192 0.020 . 1 . . . . 334 TYR H . 15932 1 1214 . 1 1 121 121 TYR HA H 1 3.942 0.020 . 1 . . . . 334 TYR HA . 15932 1 1215 . 1 1 121 121 TYR HB2 H 1 2.528 0.020 . 2 . . . . 334 TYR HB2 . 15932 1 1216 . 1 1 121 121 TYR HB3 H 1 3.063 0.020 . 2 . . . . 334 TYR HB3 . 15932 1 1217 . 1 1 121 121 TYR HD1 H 1 6.486 0.020 . 1 . . . . 334 TYR HD1 . 15932 1 1218 . 1 1 121 121 TYR HE1 H 1 6.411 0.020 . 1 . . . . 334 TYR HE1 . 15932 1 1219 . 1 1 121 121 TYR C C 13 177.847 0.400 . 1 . . . . 334 TYR C . 15932 1 1220 . 1 1 121 121 TYR CA C 13 60.688 0.400 . 1 . . . . 334 TYR CA . 15932 1 1221 . 1 1 121 121 TYR CB C 13 38.803 0.400 . 1 . . . . 334 TYR CB . 15932 1 1222 . 1 1 121 121 TYR CD1 C 13 132.675 0.400 . 1 . . . . 334 TYR CD1 . 15932 1 1223 . 1 1 121 121 TYR CE1 C 13 117.462 0.400 . 1 . . . . 334 TYR CE1 . 15932 1 1224 . 1 1 121 121 TYR N N 15 117.479 0.400 . 1 . . . . 334 TYR N . 15932 1 1225 . 1 1 122 122 GLU H H 1 7.178 0.020 . 1 . . . . 335 GLU H . 15932 1 1226 . 1 1 122 122 GLU HA H 1 3.751 0.020 . 1 . . . . 335 GLU HA . 15932 1 1227 . 1 1 122 122 GLU HB3 H 1 2.272 0.020 . 1 . . . . 335 GLU HB3 . 15932 1 1228 . 1 1 122 122 GLU C C 13 176.427 0.400 . 1 . . . . 335 GLU C . 15932 1 1229 . 1 1 122 122 GLU CA C 13 58.378 0.400 . 1 . . . . 335 GLU CA . 15932 1 1230 . 1 1 122 122 GLU CB C 13 29.477 0.400 . 1 . . . . 335 GLU CB . 15932 1 1231 . 1 1 122 122 GLU CG C 13 36.551 0.400 . 1 . . . . 335 GLU CG . 15932 1 1232 . 1 1 122 122 GLU N N 15 115.885 0.400 . 1 . . . . 335 GLU N . 15932 1 1233 . 1 1 123 123 LEU H H 1 7.440 0.020 . 1 . . . . 336 LEU H . 15932 1 1234 . 1 1 123 123 LEU HA H 1 4.123 0.020 . 1 . . . . 336 LEU HA . 15932 1 1235 . 1 1 123 123 LEU HB2 H 1 1.144 0.020 . 1 . . . . 336 LEU HB2 . 15932 1 1236 . 1 1 123 123 LEU HB3 H 1 1.144 0.020 . 1 . . . . 336 LEU HB3 . 15932 1 1237 . 1 1 123 123 LEU HD11 H 1 0.600 0.020 . 2 . . . . 336 LEU HD11 . 15932 1 1238 . 1 1 123 123 LEU HD12 H 1 0.600 0.020 . 2 . . . . 336 LEU HD12 . 15932 1 1239 . 1 1 123 123 LEU HD13 H 1 0.600 0.020 . 2 . . . . 336 LEU HD13 . 15932 1 1240 . 1 1 123 123 LEU HD21 H 1 0.364 0.020 . 2 . . . . 336 LEU HD21 . 15932 1 1241 . 1 1 123 123 LEU HD22 H 1 0.364 0.020 . 2 . . . . 336 LEU HD22 . 15932 1 1242 . 1 1 123 123 LEU HD23 H 1 0.364 0.020 . 2 . . . . 336 LEU HD23 . 15932 1 1243 . 1 1 123 123 LEU HG H 1 1.894 0.020 . 1 . . . . 336 LEU HG . 15932 1 1244 . 1 1 123 123 LEU C C 13 177.925 0.400 . 1 . . . . 336 LEU C . 15932 1 1245 . 1 1 123 123 LEU CA C 13 56.646 0.400 . 1 . . . . 336 LEU CA . 15932 1 1246 . 1 1 123 123 LEU CB C 13 40.661 0.400 . 1 . . . . 336 LEU CB . 15932 1 1247 . 1 1 123 123 LEU CD1 C 13 25.712 0.400 . 1 . . . . 336 LEU CD1 . 15932 1 1248 . 1 1 123 123 LEU CD2 C 13 21.712 0.400 . 1 . . . . 336 LEU CD2 . 15932 1 1249 . 1 1 123 123 LEU CG C 13 25.203 0.400 . 1 . . . . 336 LEU CG . 15932 1 1250 . 1 1 123 123 LEU N N 15 115.934 0.400 . 1 . . . . 336 LEU N . 15932 1 1251 . 1 1 124 124 THR H H 1 8.009 0.020 . 1 . . . . 337 THR H . 15932 1 1252 . 1 1 124 124 THR HA H 1 3.597 0.020 . 1 . . . . 337 THR HA . 15932 1 1253 . 1 1 124 124 THR HB H 1 3.526 0.020 . 1 . . . . 337 THR HB . 15932 1 1254 . 1 1 124 124 THR HG21 H 1 0.189 0.020 . 1 . . . . 337 THR HG21 . 15932 1 1255 . 1 1 124 124 THR HG22 H 1 0.189 0.020 . 1 . . . . 337 THR HG22 . 15932 1 1256 . 1 1 124 124 THR HG23 H 1 0.189 0.020 . 1 . . . . 337 THR HG23 . 15932 1 1257 . 1 1 124 124 THR C C 13 177.568 0.400 . 1 . . . . 337 THR C . 15932 1 1258 . 1 1 124 124 THR CA C 13 64.110 0.400 . 1 . . . . 337 THR CA . 15932 1 1259 . 1 1 124 124 THR CB C 13 67.603 0.400 . 1 . . . . 337 THR CB . 15932 1 1260 . 1 1 124 124 THR CG2 C 13 19.922 0.400 . 1 . . . . 337 THR CG2 . 15932 1 1261 . 1 1 124 124 THR N N 15 107.827 0.400 . 1 . . . . 337 THR N . 15932 1 1262 . 1 1 125 125 SER H H 1 7.435 0.020 . 1 . . . . 338 SER H . 15932 1 1263 . 1 1 125 125 SER HA H 1 3.723 0.020 . 1 . . . . 338 SER HA . 15932 1 1264 . 1 1 125 125 SER HB2 H 1 2.993 0.020 . 2 . . . . 338 SER HB2 . 15932 1 1265 . 1 1 125 125 SER HB3 H 1 3.635 0.020 . 2 . . . . 338 SER HB3 . 15932 1 1266 . 1 1 125 125 SER C C 13 174.040 0.400 . 1 . . . . 338 SER C . 15932 1 1267 . 1 1 125 125 SER CA C 13 60.514 0.400 . 1 . . . . 338 SER CA . 15932 1 1268 . 1 1 125 125 SER CB C 13 62.391 0.400 . 1 . . . . 338 SER CB . 15932 1 1269 . 1 1 125 125 SER N N 15 112.670 0.400 . 1 . . . . 338 SER N . 15932 1 1270 . 1 1 126 126 GLN H H 1 7.071 0.020 . 1 . . . . 339 GLN H . 15932 1 1271 . 1 1 126 126 GLN HA H 1 3.850 0.020 . 1 . . . . 339 GLN HA . 15932 1 1272 . 1 1 126 126 GLN HB2 H 1 1.626 0.020 . 1 . . . . 339 GLN HB2 . 15932 1 1273 . 1 1 126 126 GLN HB3 H 1 1.626 0.020 . 1 . . . . 339 GLN HB3 . 15932 1 1274 . 1 1 126 126 GLN HG2 H 1 2.700 0.020 . 1 . . . . 339 GLN HG2 . 15932 1 1275 . 1 1 126 126 GLN HG3 H 1 2.700 0.020 . 1 . . . . 339 GLN HG3 . 15932 1 1276 . 1 1 126 126 GLN C C 13 173.915 0.400 . 1 . . . . 339 GLN C . 15932 1 1277 . 1 1 126 126 GLN CA C 13 56.106 0.400 . 1 . . . . 339 GLN CA . 15932 1 1278 . 1 1 126 126 GLN CB C 13 27.028 0.400 . 1 . . . . 339 GLN CB . 15932 1 1279 . 1 1 126 126 GLN CG C 13 32.732 0.400 . 1 . . . . 339 GLN CG . 15932 1 1280 . 1 1 126 126 GLN N N 15 117.347 0.400 . 1 . . . . 339 GLN N . 15932 1 1281 . 1 1 127 127 PHE H H 1 7.355 0.020 . 1 . . . . 340 PHE H . 15932 1 1282 . 1 1 127 127 PHE HA H 1 4.515 0.020 . 1 . . . . 340 PHE HA . 15932 1 1283 . 1 1 127 127 PHE HB2 H 1 2.978 0.020 . 1 . . . . 340 PHE HB2 . 15932 1 1284 . 1 1 127 127 PHE HB3 H 1 2.978 0.020 . 1 . . . . 340 PHE HB3 . 15932 1 1285 . 1 1 127 127 PHE C C 13 175.241 0.400 . 1 . . . . 340 PHE C . 15932 1 1286 . 1 1 127 127 PHE CA C 13 57.914 0.400 . 1 . . . . 340 PHE CA . 15932 1 1287 . 1 1 127 127 PHE CB C 13 38.496 0.400 . 1 . . . . 340 PHE CB . 15932 1 1288 . 1 1 127 127 PHE N N 15 110.412 0.400 . 1 . . . . 340 PHE N . 15932 1 1289 . 1 1 128 128 THR H H 1 6.785 0.020 . 1 . . . . 341 THR H . 15932 1 1290 . 1 1 128 128 THR HA H 1 4.294 0.020 . 1 . . . . 341 THR HA . 15932 1 1291 . 1 1 128 128 THR HB H 1 4.203 0.020 . 1 . . . . 341 THR HB . 15932 1 1292 . 1 1 128 128 THR HG21 H 1 1.162 0.020 . 1 . . . . 341 THR HG21 . 15932 1 1293 . 1 1 128 128 THR HG22 H 1 1.162 0.020 . 1 . . . . 341 THR HG22 . 15932 1 1294 . 1 1 128 128 THR HG23 H 1 1.162 0.020 . 1 . . . . 341 THR HG23 . 15932 1 1295 . 1 1 128 128 THR C C 13 174.727 0.400 . 1 . . . . 341 THR C . 15932 1 1296 . 1 1 128 128 THR CA C 13 62.016 0.400 . 1 . . . . 341 THR CA . 15932 1 1297 . 1 1 128 128 THR CB C 13 69.757 0.400 . 1 . . . . 341 THR CB . 15932 1 1298 . 1 1 128 128 THR CG2 C 13 21.341 0.400 . 1 . . . . 341 THR CG2 . 15932 1 1299 . 1 1 128 128 THR N N 15 107.455 0.400 . 1 . . . . 341 THR N . 15932 1 1300 . 1 1 129 129 GLY H H 1 10.506 0.020 . 1 . . . . 342 GLY H . 15932 1 1301 . 1 1 129 129 GLY HA2 H 1 3.841 0.020 . 2 . . . . 342 GLY HA2 . 15932 1 1302 . 1 1 129 129 GLY HA3 H 1 3.648 0.020 . 2 . . . . 342 GLY HA3 . 15932 1 1303 . 1 1 129 129 GLY C C 13 175.631 0.400 . 1 . . . . 342 GLY C . 15932 1 1304 . 1 1 129 129 GLY CA C 13 47.056 0.400 . 1 . . . . 342 GLY CA . 15932 1 1305 . 1 1 129 129 GLY N N 15 111.023 0.400 . 1 . . . . 342 GLY N . 15932 1 1306 . 1 1 130 130 LEU H H 1 8.003 0.020 . 1 . . . . 343 LEU H . 15932 1 1307 . 1 1 130 130 LEU HA H 1 4.135 0.020 . 1 . . . . 343 LEU HA . 15932 1 1308 . 1 1 130 130 LEU HB2 H 1 1.430 0.020 . 2 . . . . 343 LEU HB2 . 15932 1 1309 . 1 1 130 130 LEU HB3 H 1 1.571 0.020 . 2 . . . . 343 LEU HB3 . 15932 1 1310 . 1 1 130 130 LEU HD11 H 1 0.842 0.020 . 2 . . . . 343 LEU HD11 . 15932 1 1311 . 1 1 130 130 LEU HD12 H 1 0.842 0.020 . 2 . . . . 343 LEU HD12 . 15932 1 1312 . 1 1 130 130 LEU HD13 H 1 0.842 0.020 . 2 . . . . 343 LEU HD13 . 15932 1 1313 . 1 1 130 130 LEU HD21 H 1 0.879 0.020 . 2 . . . . 343 LEU HD21 . 15932 1 1314 . 1 1 130 130 LEU HD22 H 1 0.879 0.020 . 2 . . . . 343 LEU HD22 . 15932 1 1315 . 1 1 130 130 LEU HD23 H 1 0.879 0.020 . 2 . . . . 343 LEU HD23 . 15932 1 1316 . 1 1 130 130 LEU HG H 1 1.591 0.020 . 1 . . . . 343 LEU HG . 15932 1 1317 . 1 1 130 130 LEU C C 13 178.627 0.400 . 1 . . . . 343 LEU C . 15932 1 1318 . 1 1 130 130 LEU CA C 13 56.606 0.400 . 1 . . . . 343 LEU CA . 15932 1 1319 . 1 1 130 130 LEU CB C 13 42.399 0.400 . 1 . . . . 343 LEU CB . 15932 1 1320 . 1 1 130 130 LEU CD1 C 13 23.599 0.400 . 1 . . . . 343 LEU CD1 . 15932 1 1321 . 1 1 130 130 LEU CD2 C 13 24.466 0.400 . 1 . . . . 343 LEU CD2 . 15932 1 1322 . 1 1 130 130 LEU CG C 13 26.920 0.400 . 1 . . . . 343 LEU CG . 15932 1 1323 . 1 1 130 130 LEU N N 15 116.983 0.400 . 1 . . . . 343 LEU N . 15932 1 1324 . 1 1 131 131 LYS H H 1 6.961 0.020 . 1 . . . . 344 LYS H . 15932 1 1325 . 1 1 131 131 LYS HA H 1 4.001 0.020 . 1 . . . . 344 LYS HA . 15932 1 1326 . 1 1 131 131 LYS HB2 H 1 1.549 0.020 . 1 . . . . 344 LYS HB2 . 15932 1 1327 . 1 1 131 131 LYS HB3 H 1 1.549 0.020 . 1 . . . . 344 LYS HB3 . 15932 1 1328 . 1 1 131 131 LYS HD2 H 1 1.500 0.020 . 1 . . . . 344 LYS HD2 . 15932 1 1329 . 1 1 131 131 LYS HE2 H 1 2.821 0.020 . 1 . . . . 344 LYS HE2 . 15932 1 1330 . 1 1 131 131 LYS HE3 H 1 2.821 0.020 . 1 . . . . 344 LYS HE3 . 15932 1 1331 . 1 1 131 131 LYS HG2 H 1 1.335 0.020 . 2 . . . . 344 LYS HG2 . 15932 1 1332 . 1 1 131 131 LYS HG3 H 1 1.158 0.020 . 2 . . . . 344 LYS HG3 . 15932 1 1333 . 1 1 131 131 LYS C C 13 176.224 0.400 . 1 . . . . 344 LYS C . 15932 1 1334 . 1 1 131 131 LYS CA C 13 57.534 0.400 . 1 . . . . 344 LYS CA . 15932 1 1335 . 1 1 131 131 LYS CB C 13 33.404 0.400 . 1 . . . . 344 LYS CB . 15932 1 1336 . 1 1 131 131 LYS CD C 13 28.872 0.400 . 1 . . . . 344 LYS CD . 15932 1 1337 . 1 1 131 131 LYS CE C 13 41.874 0.400 . 1 . . . . 344 LYS CE . 15932 1 1338 . 1 1 131 131 LYS CG C 13 25.766 0.400 . 1 . . . . 344 LYS CG . 15932 1 1339 . 1 1 131 131 LYS N N 15 116.907 0.400 . 1 . . . . 344 LYS N . 15932 1 1340 . 1 1 132 132 CYS H H 1 8.564 0.020 . 1 . . . . 345 CYS H . 15932 1 1341 . 1 1 132 132 CYS HA H 1 4.930 0.020 . 1 . . . . 345 CYS HA . 15932 1 1342 . 1 1 132 132 CYS HB2 H 1 2.560 0.020 . 2 . . . . 345 CYS HB2 . 15932 1 1343 . 1 1 132 132 CYS HB3 H 1 2.485 0.020 . 2 . . . . 345 CYS HB3 . 15932 1 1344 . 1 1 132 132 CYS C C 13 172.261 0.400 . 1 . . . . 345 CYS C . 15932 1 1345 . 1 1 132 132 CYS CA C 13 56.566 0.400 . 1 . . . . 345 CYS CA . 15932 1 1346 . 1 1 132 132 CYS CB C 13 49.011 0.400 . 1 . . . . 345 CYS CB . 15932 1 1347 . 1 1 132 132 CYS N N 15 117.718 0.400 . 1 . . . . 345 CYS N . 15932 1 1348 . 1 1 133 133 PRO HA H 1 4.719 0.020 . 1 . . . . 346 PRO HA . 15932 1 1349 . 1 1 133 133 PRO HB2 H 1 2.320 0.020 . 2 . . . . 346 PRO HB2 . 15932 1 1350 . 1 1 133 133 PRO HB3 H 1 2.000 0.020 . 2 . . . . 346 PRO HB3 . 15932 1 1351 . 1 1 133 133 PRO HD3 H 1 3.486 0.020 . 1 . . . . 346 PRO HD3 . 15932 1 1352 . 1 1 133 133 PRO HG2 H 1 1.853 0.020 . 1 . . . . 346 PRO HG2 . 15932 1 1353 . 1 1 133 133 PRO HG3 H 1 1.853 0.020 . 1 . . . . 346 PRO HG3 . 15932 1 1354 . 1 1 133 133 PRO C C 13 179.500 0.400 . 1 . . . . 346 PRO C . 15932 1 1355 . 1 1 133 133 PRO CA C 13 62.681 0.400 . 1 . . . . 346 PRO CA . 15932 1 1356 . 1 1 133 133 PRO CB C 13 34.366 0.400 . 1 . . . . 346 PRO CB . 15932 1 1357 . 1 1 133 133 PRO CD C 13 50.112 0.400 . 1 . . . . 346 PRO CD . 15932 1 1358 . 1 1 133 133 PRO CG C 13 24.558 0.400 . 1 . . . . 346 PRO CG . 15932 1 1359 . 1 1 134 134 SER H H 1 8.896 0.020 . 1 . . . . 347 SER H . 15932 1 1360 . 1 1 134 134 SER HA H 1 4.415 0.020 . 1 . . . . 347 SER HA . 15932 1 1361 . 1 1 134 134 SER HB2 H 1 4.090 0.020 . 1 . . . . 347 SER HB2 . 15932 1 1362 . 1 1 134 134 SER HB3 H 1 4.090 0.020 . 1 . . . . 347 SER HB3 . 15932 1 1363 . 1 1 134 134 SER C C 13 174.434 0.400 . 1 . . . . 347 SER C . 15932 1 1364 . 1 1 134 134 SER CA C 13 60.509 0.400 . 1 . . . . 347 SER CA . 15932 1 1365 . 1 1 134 134 SER CB C 13 62.207 0.400 . 1 . . . . 347 SER CB . 15932 1 1366 . 1 1 134 134 SER N N 15 112.882 0.400 . 1 . . . . 347 SER N . 15932 1 1367 . 1 1 135 135 LEU H H 1 7.549 0.020 . 1 . . . . 348 LEU H . 15932 1 1368 . 1 1 135 135 LEU HA H 1 4.466 0.020 . 1 . . . . 348 LEU HA . 15932 1 1369 . 1 1 135 135 LEU HB2 H 1 1.375 0.020 . 2 . . . . 348 LEU HB2 . 15932 1 1370 . 1 1 135 135 LEU HB3 H 1 1.524 0.020 . 2 . . . . 348 LEU HB3 . 15932 1 1371 . 1 1 135 135 LEU HD11 H 1 0.533 0.020 . 2 . . . . 348 LEU HD11 . 15932 1 1372 . 1 1 135 135 LEU HD12 H 1 0.533 0.020 . 2 . . . . 348 LEU HD12 . 15932 1 1373 . 1 1 135 135 LEU HD13 H 1 0.533 0.020 . 2 . . . . 348 LEU HD13 . 15932 1 1374 . 1 1 135 135 LEU HD21 H 1 0.540 0.020 . 2 . . . . 348 LEU HD21 . 15932 1 1375 . 1 1 135 135 LEU HD22 H 1 0.540 0.020 . 2 . . . . 348 LEU HD22 . 15932 1 1376 . 1 1 135 135 LEU HD23 H 1 0.540 0.020 . 2 . . . . 348 LEU HD23 . 15932 1 1377 . 1 1 135 135 LEU HG H 1 0.070 0.020 . 1 . . . . 348 LEU HG . 15932 1 1378 . 1 1 135 135 LEU C C 13 176.458 0.400 . 1 . . . . 348 LEU C . 15932 1 1379 . 1 1 135 135 LEU CA C 13 53.787 0.400 . 1 . . . . 348 LEU CA . 15932 1 1380 . 1 1 135 135 LEU CB C 13 44.189 0.400 . 1 . . . . 348 LEU CB . 15932 1 1381 . 1 1 135 135 LEU CD1 C 13 22.724 0.400 . 1 . . . . 348 LEU CD1 . 15932 1 1382 . 1 1 135 135 LEU CD2 C 13 26.470 0.400 . 1 . . . . 348 LEU CD2 . 15932 1 1383 . 1 1 135 135 LEU CG C 13 25.487 0.400 . 1 . . . . 348 LEU CG . 15932 1 1384 . 1 1 135 135 LEU N N 15 118.501 0.400 . 1 . . . . 348 LEU N . 15932 1 1385 . 1 1 136 136 ALA H H 1 7.776 0.020 . 1 . . . . 349 ALA H . 15932 1 1386 . 1 1 136 136 ALA HA H 1 4.056 0.020 . 1 . . . . 349 ALA HA . 15932 1 1387 . 1 1 136 136 ALA HB1 H 1 1.539 0.020 . 1 . . . . 349 ALA HB1 . 15932 1 1388 . 1 1 136 136 ALA HB2 H 1 1.539 0.020 . 1 . . . . 349 ALA HB2 . 15932 1 1389 . 1 1 136 136 ALA HB3 H 1 1.539 0.020 . 1 . . . . 349 ALA HB3 . 15932 1 1390 . 1 1 136 136 ALA C C 13 178.620 0.400 . 1 . . . . 349 ALA C . 15932 1 1391 . 1 1 136 136 ALA CA C 13 54.406 0.400 . 1 . . . . 349 ALA CA . 15932 1 1392 . 1 1 136 136 ALA CB C 13 17.934 0.400 . 1 . . . . 349 ALA CB . 15932 1 1393 . 1 1 136 136 ALA N N 15 125.801 0.400 . 1 . . . . 349 ALA N . 15932 1 1394 . 1 1 137 137 GLY H H 1 9.371 0.020 . 1 . . . . 350 GLY H . 15932 1 1395 . 1 1 137 137 GLY C C 13 173.026 0.400 . 1 . . . . 350 GLY C . 15932 1 1396 . 1 1 137 137 GLY CA C 13 45.132 0.400 . 1 . . . . 350 GLY CA . 15932 1 1397 . 1 1 137 137 GLY N N 15 111.181 0.400 . 1 . . . . 350 GLY N . 15932 1 1398 . 1 1 138 138 LYS H H 1 8.038 0.020 . 1 . . . . 351 LYS H . 15932 1 1399 . 1 1 138 138 LYS HA H 1 4.660 0.020 . 1 . . . . 351 LYS HA . 15932 1 1400 . 1 1 138 138 LYS C C 13 172.078 0.400 . 1 . . . . 351 LYS C . 15932 1 1401 . 1 1 138 138 LYS CA C 13 52.728 0.400 . 1 . . . . 351 LYS CA . 15932 1 1402 . 1 1 138 138 LYS CB C 13 32.069 0.400 . 1 . . . . 351 LYS CB . 15932 1 1403 . 1 1 138 138 LYS CG C 13 25.375 0.400 . 1 . . . . 351 LYS CG . 15932 1 1404 . 1 1 138 138 LYS N N 15 119.821 0.400 . 1 . . . . 351 LYS N . 15932 1 1405 . 1 1 139 139 PRO HA H 1 4.300 0.020 . 1 . . . . 352 PRO HA . 15932 1 1406 . 1 1 139 139 PRO HB2 H 1 1.105 0.020 . 2 . . . . 352 PRO HB2 . 15932 1 1407 . 1 1 139 139 PRO HB3 H 1 1.609 0.020 . 2 . . . . 352 PRO HB3 . 15932 1 1408 . 1 1 139 139 PRO HD2 H 1 3.170 0.020 . 2 . . . . 352 PRO HD2 . 15932 1 1409 . 1 1 139 139 PRO HD3 H 1 3.982 0.020 . 2 . . . . 352 PRO HD3 . 15932 1 1410 . 1 1 139 139 PRO HG2 H 1 0.535 0.020 . 2 . . . . 352 PRO HG2 . 15932 1 1411 . 1 1 139 139 PRO HG3 H 1 1.748 0.020 . 2 . . . . 352 PRO HG3 . 15932 1 1412 . 1 1 139 139 PRO C C 13 173.954 0.400 . 1 . . . . 352 PRO C . 15932 1 1413 . 1 1 139 139 PRO CA C 13 62.595 0.400 . 1 . . . . 352 PRO CA . 15932 1 1414 . 1 1 139 139 PRO CB C 13 31.399 0.400 . 1 . . . . 352 PRO CB . 15932 1 1415 . 1 1 139 139 PRO CD C 13 49.942 0.400 . 1 . . . . 352 PRO CD . 15932 1 1416 . 1 1 139 139 PRO CG C 13 27.067 0.400 . 1 . . . . 352 PRO CG . 15932 1 1417 . 1 1 140 140 LYS H H 1 8.188 0.020 . 1 . . . . 353 LYS H . 15932 1 1418 . 1 1 140 140 LYS HA H 1 4.610 0.020 . 1 . . . . 353 LYS HA . 15932 1 1419 . 1 1 140 140 LYS C C 13 173.494 0.400 . 1 . . . . 353 LYS C . 15932 1 1420 . 1 1 140 140 LYS CA C 13 55.344 0.400 . 1 . . . . 353 LYS CA . 15932 1 1421 . 1 1 140 140 LYS CB C 13 32.527 0.400 . 1 . . . . 353 LYS CB . 15932 1 1422 . 1 1 140 140 LYS CG C 13 24.516 0.400 . 1 . . . . 353 LYS CG . 15932 1 1423 . 1 1 140 140 LYS N N 15 123.304 0.400 . 1 . . . . 353 LYS N . 15932 1 1424 . 1 1 141 141 VAL H H 1 8.344 0.020 . 1 . . . . 354 VAL H . 15932 1 1425 . 1 1 141 141 VAL HA H 1 4.533 0.020 . 1 . . . . 354 VAL HA . 15932 1 1426 . 1 1 141 141 VAL HB H 1 1.686 0.020 . 1 . . . . 354 VAL HB . 15932 1 1427 . 1 1 141 141 VAL HG11 H 1 0.586 0.020 . 2 . . . . 354 VAL HG11 . 15932 1 1428 . 1 1 141 141 VAL HG12 H 1 0.586 0.020 . 2 . . . . 354 VAL HG12 . 15932 1 1429 . 1 1 141 141 VAL HG13 H 1 0.586 0.020 . 2 . . . . 354 VAL HG13 . 15932 1 1430 . 1 1 141 141 VAL HG21 H 1 0.140 0.020 . 2 . . . . 354 VAL HG21 . 15932 1 1431 . 1 1 141 141 VAL HG22 H 1 0.140 0.020 . 2 . . . . 354 VAL HG22 . 15932 1 1432 . 1 1 141 141 VAL HG23 H 1 0.140 0.020 . 2 . . . . 354 VAL HG23 . 15932 1 1433 . 1 1 141 141 VAL C C 13 172.277 0.400 . 1 . . . . 354 VAL C . 15932 1 1434 . 1 1 141 141 VAL CA C 13 60.596 0.400 . 1 . . . . 354 VAL CA . 15932 1 1435 . 1 1 141 141 VAL CB C 13 33.580 0.400 . 1 . . . . 354 VAL CB . 15932 1 1436 . 1 1 141 141 VAL CG1 C 13 20.502 0.400 . 1 . . . . 354 VAL CG1 . 15932 1 1437 . 1 1 141 141 VAL CG2 C 13 22.152 0.400 . 1 . . . . 354 VAL CG2 . 15932 1 1438 . 1 1 141 141 VAL N N 15 122.550 0.400 . 1 . . . . 354 VAL N . 15932 1 1439 . 1 1 142 142 PHE H H 1 8.985 0.020 . 1 . . . . 355 PHE H . 15932 1 1440 . 1 1 142 142 PHE HA H 1 5.436 0.020 . 1 . . . . 355 PHE HA . 15932 1 1441 . 1 1 142 142 PHE C C 13 173.666 0.400 . 1 . . . . 355 PHE C . 15932 1 1442 . 1 1 142 142 PHE CA C 13 54.968 0.400 . 1 . . . . 355 PHE CA . 15932 1 1443 . 1 1 142 142 PHE CB C 13 42.877 0.400 . 1 . . . . 355 PHE CB . 15932 1 1444 . 1 1 142 142 PHE N N 15 123.850 0.400 . 1 . . . . 355 PHE N . 15932 1 1445 . 1 1 143 143 PHE H H 1 8.584 0.020 . 1 . . . . 356 PHE H . 15932 1 1446 . 1 1 143 143 PHE HA H 1 5.934 0.020 . 1 . . . . 356 PHE HA . 15932 1 1447 . 1 1 143 143 PHE HD1 H 1 7.200 0.020 . 1 . . . . 356 PHE HD1 . 15932 1 1448 . 1 1 143 143 PHE HE1 H 1 6.954 0.020 . 1 . . . . 356 PHE HE1 . 15932 1 1449 . 1 1 143 143 PHE C C 13 174.526 0.400 . 1 . . . . 356 PHE C . 15932 1 1450 . 1 1 143 143 PHE CA C 13 55.909 0.400 . 1 . . . . 356 PHE CA . 15932 1 1451 . 1 1 143 143 PHE CB C 13 39.923 0.400 . 1 . . . . 356 PHE CB . 15932 1 1452 . 1 1 143 143 PHE CD1 C 13 131.836 0.400 . 1 . . . . 356 PHE CD1 . 15932 1 1453 . 1 1 143 143 PHE CE1 C 13 130.382 0.400 . 1 . . . . 356 PHE CE1 . 15932 1 1454 . 1 1 143 143 PHE N N 15 119.801 0.400 . 1 . . . . 356 PHE N . 15932 1 1455 . 1 1 144 144 ILE H H 1 9.020 0.020 . 1 . . . . 357 ILE H . 15932 1 1456 . 1 1 144 144 ILE HA H 1 5.040 0.020 . 1 . . . . 357 ILE HA . 15932 1 1457 . 1 1 144 144 ILE HB H 1 1.768 0.020 . 1 . . . . 357 ILE HB . 15932 1 1458 . 1 1 144 144 ILE HD11 H 1 0.770 0.020 . 1 . . . . 357 ILE HD11 . 15932 1 1459 . 1 1 144 144 ILE HD12 H 1 0.770 0.020 . 1 . . . . 357 ILE HD12 . 15932 1 1460 . 1 1 144 144 ILE HD13 H 1 0.770 0.020 . 1 . . . . 357 ILE HD13 . 15932 1 1461 . 1 1 144 144 ILE HG12 H 1 1.521 0.020 . 2 . . . . 357 ILE HG12 . 15932 1 1462 . 1 1 144 144 ILE HG13 H 1 1.144 0.020 . 2 . . . . 357 ILE HG13 . 15932 1 1463 . 1 1 144 144 ILE HG21 H 1 0.762 0.020 . 1 . . . . 357 ILE HG21 . 15932 1 1464 . 1 1 144 144 ILE HG22 H 1 0.762 0.020 . 1 . . . . 357 ILE HG22 . 15932 1 1465 . 1 1 144 144 ILE HG23 H 1 0.762 0.020 . 1 . . . . 357 ILE HG23 . 15932 1 1466 . 1 1 144 144 ILE C C 13 173.323 0.400 . 1 . . . . 357 ILE C . 15932 1 1467 . 1 1 144 144 ILE CA C 13 59.479 0.400 . 1 . . . . 357 ILE CA . 15932 1 1468 . 1 1 144 144 ILE CB C 13 40.898 0.400 . 1 . . . . 357 ILE CB . 15932 1 1469 . 1 1 144 144 ILE CD1 C 13 13.507 0.400 . 1 . . . . 357 ILE CD1 . 15932 1 1470 . 1 1 144 144 ILE CG1 C 13 27.230 0.400 . 1 . . . . 357 ILE CG1 . 15932 1 1471 . 1 1 144 144 ILE CG2 C 13 17.228 0.400 . 1 . . . . 357 ILE CG2 . 15932 1 1472 . 1 1 144 144 ILE N N 15 121.194 0.400 . 1 . . . . 357 ILE N . 15932 1 1473 . 1 1 145 145 GLN H H 1 8.856 0.020 . 1 . . . . 358 GLN H . 15932 1 1474 . 1 1 145 145 GLN HA H 1 4.670 0.020 . 1 . . . . 358 GLN HA . 15932 1 1475 . 1 1 145 145 GLN C C 13 171.591 0.400 . 1 . . . . 358 GLN C . 15932 1 1476 . 1 1 145 145 GLN CA C 13 53.648 0.400 . 1 . . . . 358 GLN CA . 15932 1 1477 . 1 1 145 145 GLN CB C 13 30.373 0.400 . 1 . . . . 358 GLN CB . 15932 1 1478 . 1 1 145 145 GLN CG C 13 34.111 0.400 . 1 . . . . 358 GLN CG . 15932 1 1479 . 1 1 145 145 GLN N N 15 128.880 0.400 . 1 . . . . 358 GLN N . 15932 1 1480 . 1 1 146 146 ALA H H 1 8.418 0.020 . 1 . . . . 359 ALA H . 15932 1 1481 . 1 1 146 146 ALA HA H 1 5.247 0.020 . 1 . . . . 359 ALA HA . 15932 1 1482 . 1 1 146 146 ALA HB1 H 1 0.995 0.020 . 1 . . . . 359 ALA HB1 . 15932 1 1483 . 1 1 146 146 ALA HB2 H 1 0.995 0.020 . 1 . . . . 359 ALA HB2 . 15932 1 1484 . 1 1 146 146 ALA HB3 H 1 0.995 0.020 . 1 . . . . 359 ALA HB3 . 15932 1 1485 . 1 1 146 146 ALA C C 13 175.319 0.400 . 1 . . . . 359 ALA C . 15932 1 1486 . 1 1 146 146 ALA CA C 13 50.243 0.400 . 1 . . . . 359 ALA CA . 15932 1 1487 . 1 1 146 146 ALA CB C 13 18.786 0.400 . 1 . . . . 359 ALA CB . 15932 1 1488 . 1 1 146 146 ALA N N 15 128.349 0.400 . 1 . . . . 359 ALA N . 15932 1 1489 . 1 1 147 147 ALA H H 1 8.161 0.020 . 1 . . . . 360 ALA H . 15932 1 1490 . 1 1 147 147 ALA HA H 1 4.343 0.020 . 1 . . . . 360 ALA HA . 15932 1 1491 . 1 1 147 147 ALA HB1 H 1 1.337 0.020 . 1 . . . . 360 ALA HB1 . 15932 1 1492 . 1 1 147 147 ALA HB2 H 1 1.337 0.020 . 1 . . . . 360 ALA HB2 . 15932 1 1493 . 1 1 147 147 ALA HB3 H 1 1.337 0.020 . 1 . . . . 360 ALA HB3 . 15932 1 1494 . 1 1 147 147 ALA C C 13 177.238 0.400 . 1 . . . . 360 ALA C . 15932 1 1495 . 1 1 147 147 ALA CA C 13 52.078 0.400 . 1 . . . . 360 ALA CA . 15932 1 1496 . 1 1 147 147 ALA CB C 13 20.003 0.400 . 1 . . . . 360 ALA CB . 15932 1 1497 . 1 1 147 147 ALA N N 15 123.005 0.400 . 1 . . . . 360 ALA N . 15932 1 1498 . 1 1 148 148 GLN H H 1 8.461 0.020 . 1 . . . . 361 GLN H . 15932 1 1499 . 1 1 148 148 GLN HA H 1 4.663 0.020 . 1 . . . . 361 GLN HA . 15932 1 1500 . 1 1 148 148 GLN HB2 H 1 2.173 0.020 . 1 . . . . 361 GLN HB2 . 15932 1 1501 . 1 1 148 148 GLN HB3 H 1 2.173 0.020 . 1 . . . . 361 GLN HB3 . 15932 1 1502 . 1 1 148 148 GLN HG2 H 1 2.488 0.020 . 1 . . . . 361 GLN HG2 . 15932 1 1503 . 1 1 148 148 GLN HG3 H 1 2.488 0.020 . 1 . . . . 361 GLN HG3 . 15932 1 1504 . 1 1 148 148 GLN C C 13 176.333 0.400 . 1 . . . . 361 GLN C . 15932 1 1505 . 1 1 148 148 GLN CA C 13 55.760 0.400 . 1 . . . . 361 GLN CA . 15932 1 1506 . 1 1 148 148 GLN CB C 13 29.937 0.400 . 1 . . . . 361 GLN CB . 15932 1 1507 . 1 1 148 148 GLN CG C 13 34.030 0.400 . 1 . . . . 361 GLN CG . 15932 1 1508 . 1 1 148 148 GLN N N 15 120.296 0.400 . 1 . . . . 361 GLN N . 15932 1 1509 . 1 1 149 149 GLY H H 1 8.631 0.020 . 1 . . . . 362 GLY H . 15932 1 1510 . 1 1 149 149 GLY HA2 H 1 3.858 0.020 . 1 . . . . 362 GLY HA2 . 15932 1 1511 . 1 1 149 149 GLY HA3 H 1 3.858 0.020 . 1 . . . . 362 GLY HA3 . 15932 1 1512 . 1 1 149 149 GLY C C 13 172.022 0.400 . 1 . . . . 362 GLY C . 15932 1 1513 . 1 1 149 149 GLY CA C 13 44.969 0.400 . 1 . . . . 362 GLY CA . 15932 1 1514 . 1 1 149 149 GLY N N 15 109.782 0.400 . 1 . . . . 362 GLY N . 15932 1 1515 . 1 1 150 150 ASP H H 1 7.566 0.020 . 1 . . . . 363 ASP H . 15932 1 1516 . 1 1 150 150 ASP HA H 1 4.661 0.020 . 1 . . . . 363 ASP HA . 15932 1 1517 . 1 1 150 150 ASP HB2 H 1 2.691 0.020 . 2 . . . . 363 ASP HB2 . 15932 1 1518 . 1 1 150 150 ASP HB3 H 1 2.383 0.020 . 2 . . . . 363 ASP HB3 . 15932 1 1519 . 1 1 150 150 ASP C C 13 174.446 0.400 . 1 . . . . 363 ASP C . 15932 1 1520 . 1 1 150 150 ASP CA C 13 57.776 0.400 . 1 . . . . 363 ASP CA . 15932 1 1521 . 1 1 150 150 ASP CB C 13 39.423 0.400 . 1 . . . . 363 ASP CB . 15932 1 1522 . 1 1 150 150 ASP N N 15 118.182 0.400 . 1 . . . . 363 ASP N . 15932 1 1523 . 1 1 153 153 GLN HA H 1 4.665 0.020 . 1 . . . . 366 GLN HA . 15932 1 1524 . 1 1 153 153 GLN HB2 H 1 1.996 0.020 . 2 . . . . 366 GLN HB2 . 15932 1 1525 . 1 1 153 153 GLN HB3 H 1 2.222 0.020 . 2 . . . . 366 GLN HB3 . 15932 1 1526 . 1 1 153 153 GLN HE21 H 1 7.587 0.020 . 2 . . . . 366 GLN HE21 . 15932 1 1527 . 1 1 153 153 GLN HE22 H 1 6.928 0.020 . 2 . . . . 366 GLN HE22 . 15932 1 1528 . 1 1 153 153 GLN HG2 H 1 2.525 0.020 . 1 . . . . 366 GLN HG2 . 15932 1 1529 . 1 1 153 153 GLN HG3 H 1 2.525 0.020 . 1 . . . . 366 GLN HG3 . 15932 1 1530 . 1 1 153 153 GLN CA C 13 53.779 0.400 . 1 . . . . 366 GLN CA . 15932 1 1531 . 1 1 153 153 GLN CB C 13 28.988 0.400 . 1 . . . . 366 GLN CB . 15932 1 1532 . 1 1 153 153 GLN CG C 13 33.652 0.400 . 1 . . . . 366 GLN CG . 15932 1 1533 . 1 1 153 153 GLN NE2 N 15 111.900 0.400 . 1 . . . . 366 GLN NE2 . 15932 1 1534 . 1 1 155 155 GLY HA2 H 1 3.899 0.020 . 1 . . . . 368 GLY HA2 . 15932 1 1535 . 1 1 155 155 GLY HA3 H 1 3.899 0.020 . 1 . . . . 368 GLY HA3 . 15932 1 1536 . 1 1 155 155 GLY CA C 13 45.013 0.400 . 1 . . . . 368 GLY CA . 15932 1 1537 . 1 1 156 156 ILE H H 1 7.871 0.020 . 1 . . . . 369 ILE H . 15932 1 1538 . 1 1 156 156 ILE HA H 1 4.428 0.020 . 1 . . . . 369 ILE HA . 15932 1 1539 . 1 1 156 156 ILE HB H 1 1.824 0.020 . 1 . . . . 369 ILE HB . 15932 1 1540 . 1 1 156 156 ILE HD11 H 1 0.810 0.020 . 1 . . . . 369 ILE HD11 . 15932 1 1541 . 1 1 156 156 ILE HD12 H 1 0.810 0.020 . 1 . . . . 369 ILE HD12 . 15932 1 1542 . 1 1 156 156 ILE HD13 H 1 0.810 0.020 . 1 . . . . 369 ILE HD13 . 15932 1 1543 . 1 1 156 156 ILE HG12 H 1 1.434 0.020 . 2 . . . . 369 ILE HG12 . 15932 1 1544 . 1 1 156 156 ILE HG13 H 1 1.098 0.020 . 2 . . . . 369 ILE HG13 . 15932 1 1545 . 1 1 156 156 ILE HG21 H 1 0.900 0.020 . 1 . . . . 369 ILE HG21 . 15932 1 1546 . 1 1 156 156 ILE HG22 H 1 0.900 0.020 . 1 . . . . 369 ILE HG22 . 15932 1 1547 . 1 1 156 156 ILE HG23 H 1 0.900 0.020 . 1 . . . . 369 ILE HG23 . 15932 1 1548 . 1 1 156 156 ILE C C 13 174.196 0.400 . 1 . . . . 369 ILE C . 15932 1 1549 . 1 1 156 156 ILE CA C 13 58.676 0.400 . 1 . . . . 369 ILE CA . 15932 1 1550 . 1 1 156 156 ILE CB C 13 38.516 0.400 . 1 . . . . 369 ILE CB . 15932 1 1551 . 1 1 156 156 ILE CD1 C 13 12.651 0.400 . 1 . . . . 369 ILE CD1 . 15932 1 1552 . 1 1 156 156 ILE CG1 C 13 26.768 0.400 . 1 . . . . 369 ILE CG1 . 15932 1 1553 . 1 1 156 156 ILE CG2 C 13 17.101 0.400 . 1 . . . . 369 ILE CG2 . 15932 1 1554 . 1 1 156 156 ILE N N 15 120.958 0.400 . 1 . . . . 369 ILE N . 15932 1 1555 . 1 1 157 157 PRO HA H 1 4.386 0.020 . 1 . . . . 370 PRO HA . 15932 1 1556 . 1 1 157 157 PRO HB2 H 1 2.218 0.020 . 2 . . . . 370 PRO HB2 . 15932 1 1557 . 1 1 157 157 PRO HB3 H 1 1.853 0.020 . 2 . . . . 370 PRO HB3 . 15932 1 1558 . 1 1 157 157 PRO HD2 H 1 3.827 0.020 . 2 . . . . 370 PRO HD2 . 15932 1 1559 . 1 1 157 157 PRO HD3 H 1 3.630 0.020 . 2 . . . . 370 PRO HD3 . 15932 1 1560 . 1 1 157 157 PRO HG2 H 1 1.931 0.020 . 1 . . . . 370 PRO HG2 . 15932 1 1561 . 1 1 157 157 PRO HG3 H 1 1.931 0.020 . 1 . . . . 370 PRO HG3 . 15932 1 1562 . 1 1 157 157 PRO C C 13 176.218 0.400 . 1 . . . . 370 PRO C . 15932 1 1563 . 1 1 157 157 PRO CA C 13 63.431 0.400 . 1 . . . . 370 PRO CA . 15932 1 1564 . 1 1 157 157 PRO CB C 13 31.913 0.400 . 1 . . . . 370 PRO CB . 15932 1 1565 . 1 1 157 157 PRO CD C 13 50.923 0.400 . 1 . . . . 370 PRO CD . 15932 1 1566 . 1 1 157 157 PRO CG C 13 27.246 0.400 . 1 . . . . 370 PRO CG . 15932 1 1567 . 1 1 158 158 VAL H H 1 8.137 0.020 . 1 . . . . 371 VAL H . 15932 1 1568 . 1 1 158 158 VAL HA H 1 4.089 0.020 . 1 . . . . 371 VAL HA . 15932 1 1569 . 1 1 158 158 VAL HB H 1 2.040 0.020 . 1 . . . . 371 VAL HB . 15932 1 1570 . 1 1 158 158 VAL HG11 H 1 0.913 0.020 . 2 . . . . 371 VAL HG11 . 15932 1 1571 . 1 1 158 158 VAL HG12 H 1 0.913 0.020 . 2 . . . . 371 VAL HG12 . 15932 1 1572 . 1 1 158 158 VAL HG13 H 1 0.913 0.020 . 2 . . . . 371 VAL HG13 . 15932 1 1573 . 1 1 158 158 VAL HG21 H 1 0.919 0.020 . 2 . . . . 371 VAL HG21 . 15932 1 1574 . 1 1 158 158 VAL HG22 H 1 0.919 0.020 . 2 . . . . 371 VAL HG22 . 15932 1 1575 . 1 1 158 158 VAL HG23 H 1 0.919 0.020 . 2 . . . . 371 VAL HG23 . 15932 1 1576 . 1 1 158 158 VAL C C 13 175.904 0.400 . 1 . . . . 371 VAL C . 15932 1 1577 . 1 1 158 158 VAL CA C 13 62.121 0.400 . 1 . . . . 371 VAL CA . 15932 1 1578 . 1 1 158 158 VAL CB C 13 32.958 0.400 . 1 . . . . 371 VAL CB . 15932 1 1579 . 1 1 158 158 VAL CG1 C 13 20.363 0.400 . 1 . . . . 371 VAL CG1 . 15932 1 1580 . 1 1 158 158 VAL CG2 C 13 21.233 0.400 . 1 . . . . 371 VAL CG2 . 15932 1 1581 . 1 1 158 158 VAL N N 15 119.640 0.400 . 1 . . . . 371 VAL N . 15932 1 1582 . 1 1 159 159 GLU H H 1 8.523 0.020 . 1 . . . . 372 GLU H . 15932 1 1583 . 1 1 159 159 GLU HA H 1 4.345 0.020 . 1 . . . . 372 GLU HA . 15932 1 1584 . 1 1 159 159 GLU HB2 H 1 1.906 0.020 . 2 . . . . 372 GLU HB2 . 15932 1 1585 . 1 1 159 159 GLU HB3 H 1 2.031 0.020 . 2 . . . . 372 GLU HB3 . 15932 1 1586 . 1 1 159 159 GLU HG2 H 1 2.234 0.020 . 1 . . . . 372 GLU HG2 . 15932 1 1587 . 1 1 159 159 GLU HG3 H 1 2.234 0.020 . 1 . . . . 372 GLU HG3 . 15932 1 1588 . 1 1 159 159 GLU C C 13 176.068 0.400 . 1 . . . . 372 GLU C . 15932 1 1589 . 1 1 159 159 GLU CA C 13 56.474 0.400 . 1 . . . . 372 GLU CA . 15932 1 1590 . 1 1 159 159 GLU CB C 13 30.078 0.400 . 1 . . . . 372 GLU CB . 15932 1 1591 . 1 1 159 159 GLU CG C 13 36.281 0.400 . 1 . . . . 372 GLU CG . 15932 1 1592 . 1 1 159 159 GLU N N 15 123.765 0.400 . 1 . . . . 372 GLU N . 15932 1 1593 . 1 1 160 160 THR H H 1 8.096 0.020 . 1 . . . . 373 THR H . 15932 1 1594 . 1 1 160 160 THR HA H 1 4.311 0.020 . 1 . . . . 373 THR HA . 15932 1 1595 . 1 1 160 160 THR HB H 1 4.201 0.020 . 1 . . . . 373 THR HB . 15932 1 1596 . 1 1 160 160 THR HG21 H 1 1.160 0.020 . 1 . . . . 373 THR HG21 . 15932 1 1597 . 1 1 160 160 THR HG22 H 1 1.160 0.020 . 1 . . . . 373 THR HG22 . 15932 1 1598 . 1 1 160 160 THR HG23 H 1 1.160 0.020 . 1 . . . . 373 THR HG23 . 15932 1 1599 . 1 1 160 160 THR C C 13 173.701 0.400 . 1 . . . . 373 THR C . 15932 1 1600 . 1 1 160 160 THR CA C 13 61.845 0.400 . 1 . . . . 373 THR CA . 15932 1 1601 . 1 1 160 160 THR CB C 13 69.760 0.400 . 1 . . . . 373 THR CB . 15932 1 1602 . 1 1 160 160 THR CG2 C 13 21.225 0.400 . 1 . . . . 373 THR CG2 . 15932 1 1603 . 1 1 160 160 THR N N 15 114.143 0.400 . 1 . . . . 373 THR N . 15932 1 1604 . 1 1 161 161 ASP H H 1 8.387 0.020 . 1 . . . . 374 ASP H . 15932 1 1605 . 1 1 161 161 ASP HA H 1 4.625 0.020 . 1 . . . . 374 ASP HA . 15932 1 1606 . 1 1 161 161 ASP HB2 H 1 2.700 0.020 . 2 . . . . 374 ASP HB2 . 15932 1 1607 . 1 1 161 161 ASP HB3 H 1 2.636 0.020 . 2 . . . . 374 ASP HB3 . 15932 1 1608 . 1 1 161 161 ASP C C 13 175.806 0.400 . 1 . . . . 374 ASP C . 15932 1 1609 . 1 1 161 161 ASP CA C 13 54.478 0.400 . 1 . . . . 374 ASP CA . 15932 1 1610 . 1 1 161 161 ASP CB C 13 41.096 0.400 . 1 . . . . 374 ASP CB . 15932 1 1611 . 1 1 161 161 ASP N N 15 122.070 0.400 . 1 . . . . 374 ASP N . 15932 1 1612 . 1 1 162 162 SER H H 1 8.175 0.020 . 1 . . . . 375 SER H . 15932 1 1613 . 1 1 162 162 SER HA H 1 4.385 0.020 . 1 . . . . 375 SER HA . 15932 1 1614 . 1 1 162 162 SER HB2 H 1 3.840 0.020 . 1 . . . . 375 SER HB2 . 15932 1 1615 . 1 1 162 162 SER HB3 H 1 3.840 0.020 . 1 . . . . 375 SER HB3 . 15932 1 1616 . 1 1 162 162 SER C C 13 174.169 0.400 . 1 . . . . 375 SER C . 15932 1 1617 . 1 1 162 162 SER CA C 13 58.631 0.400 . 1 . . . . 375 SER CA . 15932 1 1618 . 1 1 162 162 SER CB C 13 63.814 0.400 . 1 . . . . 375 SER CB . 15932 1 1619 . 1 1 162 162 SER N N 15 115.346 0.400 . 1 . . . . 375 SER N . 15932 1 1620 . 1 1 163 163 GLU H H 1 8.424 0.020 . 1 . . . . 376 GLU H . 15932 1 1621 . 1 1 163 163 GLU HA H 1 4.263 0.020 . 1 . . . . 376 GLU HA . 15932 1 1622 . 1 1 163 163 GLU HB2 H 1 1.907 0.020 . 2 . . . . 376 GLU HB2 . 15932 1 1623 . 1 1 163 163 GLU HB3 H 1 2.044 0.020 . 2 . . . . 376 GLU HB3 . 15932 1 1624 . 1 1 163 163 GLU HG2 H 1 2.237 0.020 . 1 . . . . 376 GLU HG2 . 15932 1 1625 . 1 1 163 163 GLU HG3 H 1 2.237 0.020 . 1 . . . . 376 GLU HG3 . 15932 1 1626 . 1 1 163 163 GLU C C 13 175.959 0.400 . 1 . . . . 376 GLU C . 15932 1 1627 . 1 1 163 163 GLU CA C 13 56.567 0.400 . 1 . . . . 376 GLU CA . 15932 1 1628 . 1 1 163 163 GLU CB C 13 30.044 0.400 . 1 . . . . 376 GLU CB . 15932 1 1629 . 1 1 163 163 GLU CG C 13 36.310 0.400 . 1 . . . . 376 GLU CG . 15932 1 1630 . 1 1 163 163 GLU N N 15 122.034 0.400 . 1 . . . . 376 GLU N . 15932 1 1631 . 1 1 164 164 GLU H H 1 8.298 0.020 . 1 . . . . 377 GLU H . 15932 1 1632 . 1 1 164 164 GLU HA H 1 4.224 0.020 . 1 . . . . 377 GLU HA . 15932 1 1633 . 1 1 164 164 GLU HB2 H 1 1.885 0.020 . 2 . . . . 377 GLU HB2 . 15932 1 1634 . 1 1 164 164 GLU HB3 H 1 1.990 0.020 . 2 . . . . 377 GLU HB3 . 15932 1 1635 . 1 1 164 164 GLU HG2 H 1 2.216 0.020 . 2 . . . . 377 GLU HG2 . 15932 1 1636 . 1 1 164 164 GLU HG3 H 1 1.771 0.020 . 2 . . . . 377 GLU HG3 . 15932 1 1637 . 1 1 164 164 GLU C C 13 175.816 0.400 . 1 . . . . 377 GLU C . 15932 1 1638 . 1 1 164 164 GLU CA C 13 56.489 0.400 . 1 . . . . 377 GLU CA . 15932 1 1639 . 1 1 164 164 GLU CB C 13 30.220 0.400 . 1 . . . . 377 GLU CB . 15932 1 1640 . 1 1 164 164 GLU CG C 13 36.373 0.400 . 1 . . . . 377 GLU CG . 15932 1 1641 . 1 1 164 164 GLU N N 15 120.980 0.400 . 1 . . . . 377 GLU N . 15932 1 1642 . 1 1 165 165 GLN H H 1 8.340 0.020 . 1 . . . . 378 GLN H . 15932 1 1643 . 1 1 165 165 GLN HA H 1 4.563 0.020 . 1 . . . . 378 GLN HA . 15932 1 1644 . 1 1 165 165 GLN HG2 H 1 2.320 0.020 . 1 . . . . 378 GLN HG2 . 15932 1 1645 . 1 1 165 165 GLN C C 13 173.510 0.400 . 1 . . . . 378 GLN C . 15932 1 1646 . 1 1 165 165 GLN CA C 13 53.530 0.400 . 1 . . . . 378 GLN CA . 15932 1 1647 . 1 1 165 165 GLN CB C 13 28.816 0.400 . 1 . . . . 378 GLN CB . 15932 1 1648 . 1 1 165 165 GLN CG C 13 33.391 0.400 . 1 . . . . 378 GLN CG . 15932 1 1649 . 1 1 165 165 GLN N N 15 121.693 0.400 . 1 . . . . 378 GLN N . 15932 1 1650 . 1 1 166 166 PRO HA H 1 4.381 0.020 . 1 . . . . 379 PRO HA . 15932 1 1651 . 1 1 166 166 PRO HB2 H 1 1.851 0.020 . 2 . . . . 379 PRO HB2 . 15932 1 1652 . 1 1 166 166 PRO HB3 H 1 2.214 0.020 . 2 . . . . 379 PRO HB3 . 15932 1 1653 . 1 1 166 166 PRO HD2 H 1 3.826 0.020 . 2 . . . . 379 PRO HD2 . 15932 1 1654 . 1 1 166 166 PRO HD3 H 1 3.632 0.020 . 2 . . . . 379 PRO HD3 . 15932 1 1655 . 1 1 166 166 PRO HG2 H 1 1.929 0.020 . 2 . . . . 379 PRO HG2 . 15932 1 1656 . 1 1 166 166 PRO HG3 H 1 2.004 0.020 . 2 . . . . 379 PRO HG3 . 15932 1 1657 . 1 1 166 166 PRO C C 13 176.081 0.400 . 1 . . . . 379 PRO C . 15932 1 1658 . 1 1 166 166 PRO CA C 13 63.260 0.400 . 1 . . . . 379 PRO CA . 15932 1 1659 . 1 1 166 166 PRO CB C 13 32.010 0.400 . 1 . . . . 379 PRO CB . 15932 1 1660 . 1 1 166 166 PRO CD C 13 50.958 0.400 . 1 . . . . 379 PRO CD . 15932 1 1661 . 1 1 166 166 PRO CG C 13 27.205 0.400 . 1 . . . . 379 PRO CG . 15932 1 1662 . 1 1 167 167 TYR H H 1 8.116 0.020 . 1 . . . . 380 TYR H . 15932 1 1663 . 1 1 167 167 TYR HA H 1 4.513 0.020 . 1 . . . . 380 TYR HA . 15932 1 1664 . 1 1 167 167 TYR HB2 H 1 2.973 0.020 . 1 . . . . 380 TYR HB2 . 15932 1 1665 . 1 1 167 167 TYR HB3 H 1 2.973 0.020 . 1 . . . . 380 TYR HB3 . 15932 1 1666 . 1 1 167 167 TYR HD1 H 1 7.080 0.020 . 1 . . . . 380 TYR HD1 . 15932 1 1667 . 1 1 167 167 TYR HE1 H 1 6.791 0.020 . 1 . . . . 380 TYR HE1 . 15932 1 1668 . 1 1 167 167 TYR C C 13 174.992 0.400 . 1 . . . . 380 TYR C . 15932 1 1669 . 1 1 167 167 TYR CA C 13 57.699 0.400 . 1 . . . . 380 TYR CA . 15932 1 1670 . 1 1 167 167 TYR CB C 13 38.344 0.400 . 1 . . . . 380 TYR CB . 15932 1 1671 . 1 1 167 167 TYR CD1 C 13 133.175 0.400 . 1 . . . . 380 TYR CD1 . 15932 1 1672 . 1 1 167 167 TYR CE1 C 13 118.126 0.400 . 1 . . . . 380 TYR CE1 . 15932 1 1673 . 1 1 167 167 TYR N N 15 119.531 0.400 . 1 . . . . 380 TYR N . 15932 1 1674 . 1 1 168 168 LEU H H 1 7.953 0.020 . 1 . . . . 381 LEU H . 15932 1 1675 . 1 1 168 168 LEU HA H 1 4.267 0.020 . 1 . . . . 381 LEU HA . 15932 1 1676 . 1 1 168 168 LEU HB2 H 1 1.494 0.020 . 1 . . . . 381 LEU HB2 . 15932 1 1677 . 1 1 168 168 LEU HB3 H 1 1.494 0.020 . 1 . . . . 381 LEU HB3 . 15932 1 1678 . 1 1 168 168 LEU HD11 H 1 0.800 0.020 . 2 . . . . 381 LEU HD11 . 15932 1 1679 . 1 1 168 168 LEU HD12 H 1 0.800 0.020 . 2 . . . . 381 LEU HD12 . 15932 1 1680 . 1 1 168 168 LEU HD13 H 1 0.800 0.020 . 2 . . . . 381 LEU HD13 . 15932 1 1681 . 1 1 168 168 LEU HD21 H 1 0.860 0.020 . 2 . . . . 381 LEU HD21 . 15932 1 1682 . 1 1 168 168 LEU HD22 H 1 0.860 0.020 . 2 . . . . 381 LEU HD22 . 15932 1 1683 . 1 1 168 168 LEU HD23 H 1 0.860 0.020 . 2 . . . . 381 LEU HD23 . 15932 1 1684 . 1 1 168 168 LEU HG H 1 1.449 0.020 . 1 . . . . 381 LEU HG . 15932 1 1685 . 1 1 168 168 LEU C C 13 176.162 0.400 . 1 . . . . 381 LEU C . 15932 1 1686 . 1 1 168 168 LEU CA C 13 54.808 0.400 . 1 . . . . 381 LEU CA . 15932 1 1687 . 1 1 168 168 LEU CB C 13 42.735 0.400 . 1 . . . . 381 LEU CB . 15932 1 1688 . 1 1 168 168 LEU CD1 C 13 23.589 0.400 . 1 . . . . 381 LEU CD1 . 15932 1 1689 . 1 1 168 168 LEU CD2 C 13 24.791 0.400 . 1 . . . . 381 LEU CD2 . 15932 1 1690 . 1 1 168 168 LEU CG C 13 26.699 0.400 . 1 . . . . 381 LEU CG . 15932 1 1691 . 1 1 168 168 LEU N N 15 124.133 0.400 . 1 . . . . 381 LEU N . 15932 1 1692 . 1 1 169 169 GLU H H 1 8.190 0.020 . 1 . . . . 382 GLU H . 15932 1 1693 . 1 1 169 169 GLU HA H 1 4.167 0.020 . 1 . . . . 382 GLU HA . 15932 1 1694 . 1 1 169 169 GLU HB2 H 1 2.006 0.020 . 2 . . . . 382 GLU HB2 . 15932 1 1695 . 1 1 169 169 GLU HB3 H 1 1.900 0.020 . 2 . . . . 382 GLU HB3 . 15932 1 1696 . 1 1 169 169 GLU HG2 H 1 2.212 0.020 . 2 . . . . 382 GLU HG2 . 15932 1 1697 . 1 1 169 169 GLU HG3 H 1 1.769 0.020 . 2 . . . . 382 GLU HG3 . 15932 1 1698 . 1 1 169 169 GLU C C 13 175.881 0.400 . 1 . . . . 382 GLU C . 15932 1 1699 . 1 1 169 169 GLU CA C 13 56.655 0.400 . 1 . . . . 382 GLU CA . 15932 1 1700 . 1 1 169 169 GLU CB C 13 30.058 0.400 . 1 . . . . 382 GLU CB . 15932 1 1701 . 1 1 169 169 GLU CG C 13 36.286 0.400 . 1 . . . . 382 GLU CG . 15932 1 1702 . 1 1 169 169 GLU N N 15 121.131 0.400 . 1 . . . . 382 GLU N . 15932 1 1703 . 1 1 170 170 MET H H 1 8.214 0.020 . 1 . . . . 383 MET H . 15932 1 1704 . 1 1 170 170 MET HA H 1 4.377 0.020 . 1 . . . . 383 MET HA . 15932 1 1705 . 1 1 170 170 MET HB2 H 1 2.010 0.020 . 2 . . . . 383 MET HB2 . 15932 1 1706 . 1 1 170 170 MET HB3 H 1 1.951 0.020 . 2 . . . . 383 MET HB3 . 15932 1 1707 . 1 1 170 170 MET HG2 H 1 2.520 0.020 . 2 . . . . 383 MET HG2 . 15932 1 1708 . 1 1 170 170 MET HG3 H 1 2.451 0.020 . 2 . . . . 383 MET HG3 . 15932 1 1709 . 1 1 170 170 MET C C 13 175.132 0.400 . 1 . . . . 383 MET C . 15932 1 1710 . 1 1 170 170 MET CA C 13 55.606 0.400 . 1 . . . . 383 MET CA . 15932 1 1711 . 1 1 170 170 MET CB C 13 33.091 0.400 . 1 . . . . 383 MET CB . 15932 1 1712 . 1 1 170 170 MET CG C 13 31.827 0.400 . 1 . . . . 383 MET CG . 15932 1 1713 . 1 1 170 170 MET N N 15 120.601 0.400 . 1 . . . . 383 MET N . 15932 1 1714 . 1 1 171 171 ASP H H 1 8.358 0.020 . 1 . . . . 384 ASP H . 15932 1 1715 . 1 1 171 171 ASP HA H 1 4.575 0.020 . 1 . . . . 384 ASP HA . 15932 1 1716 . 1 1 171 171 ASP HB2 H 1 2.581 0.020 . 2 . . . . 384 ASP HB2 . 15932 1 1717 . 1 1 171 171 ASP HB3 H 1 2.719 0.020 . 2 . . . . 384 ASP HB3 . 15932 1 1718 . 1 1 171 171 ASP C C 13 175.966 0.400 . 1 . . . . 384 ASP C . 15932 1 1719 . 1 1 171 171 ASP CA C 13 53.741 0.400 . 1 . . . . 384 ASP CA . 15932 1 1720 . 1 1 171 171 ASP CB C 13 40.571 0.400 . 1 . . . . 384 ASP CB . 15932 1 1721 . 1 1 171 171 ASP N N 15 121.104 0.400 . 1 . . . . 384 ASP N . 15932 1 1722 . 1 1 172 172 LEU H H 1 8.285 0.020 . 1 . . . . 385 LEU H . 15932 1 1723 . 1 1 172 172 LEU HA H 1 4.305 0.020 . 1 . . . . 385 LEU HA . 15932 1 1724 . 1 1 172 172 LEU HB2 H 1 1.611 0.020 . 1 . . . . 385 LEU HB2 . 15932 1 1725 . 1 1 172 172 LEU HB3 H 1 1.611 0.020 . 1 . . . . 385 LEU HB3 . 15932 1 1726 . 1 1 172 172 LEU HD11 H 1 0.878 0.020 . 2 . . . . 385 LEU HD11 . 15932 1 1727 . 1 1 172 172 LEU HD12 H 1 0.878 0.020 . 2 . . . . 385 LEU HD12 . 15932 1 1728 . 1 1 172 172 LEU HD13 H 1 0.878 0.020 . 2 . . . . 385 LEU HD13 . 15932 1 1729 . 1 1 172 172 LEU HD21 H 1 0.810 0.020 . 2 . . . . 385 LEU HD21 . 15932 1 1730 . 1 1 172 172 LEU HD22 H 1 0.810 0.020 . 2 . . . . 385 LEU HD22 . 15932 1 1731 . 1 1 172 172 LEU HD23 H 1 0.810 0.020 . 2 . . . . 385 LEU HD23 . 15932 1 1732 . 1 1 172 172 LEU HG H 1 1.611 0.020 . 1 . . . . 385 LEU HG . 15932 1 1733 . 1 1 172 172 LEU C C 13 177.140 0.400 . 1 . . . . 385 LEU C . 15932 1 1734 . 1 1 172 172 LEU CA C 13 55.122 0.400 . 1 . . . . 385 LEU CA . 15932 1 1735 . 1 1 172 172 LEU CB C 13 41.851 0.400 . 1 . . . . 385 LEU CB . 15932 1 1736 . 1 1 172 172 LEU CD1 C 13 24.891 0.400 . 1 . . . . 385 LEU CD1 . 15932 1 1737 . 1 1 172 172 LEU CD2 C 13 23.039 0.400 . 1 . . . . 385 LEU CD2 . 15932 1 1738 . 1 1 172 172 LEU CG C 13 26.752 0.400 . 1 . . . . 385 LEU CG . 15932 1 1739 . 1 1 172 172 LEU N N 15 123.115 0.400 . 1 . . . . 385 LEU N . 15932 1 1740 . 1 1 173 173 SER H H 1 8.290 0.020 . 1 . . . . 386 SER H . 15932 1 1741 . 1 1 173 173 SER N N 15 115.101 0.400 . 1 . . . . 386 SER N . 15932 1 1742 . 1 1 176 176 GLN HA H 1 4.383 0.020 . 1 . . . . 389 GLN HA . 15932 1 1743 . 1 1 176 176 GLN HB2 H 1 2.128 0.020 . 2 . . . . 389 GLN HB2 . 15932 1 1744 . 1 1 176 176 GLN HB3 H 1 1.996 0.020 . 2 . . . . 389 GLN HB3 . 15932 1 1745 . 1 1 176 176 GLN HE21 H 1 6.695 0.020 . 2 . . . . 389 GLN HE21 . 15932 1 1746 . 1 1 176 176 GLN HE22 H 1 7.546 0.020 . 2 . . . . 389 GLN HE22 . 15932 1 1747 . 1 1 176 176 GLN HG2 H 1 2.273 0.020 . 2 . . . . 389 GLN HG2 . 15932 1 1748 . 1 1 176 176 GLN HG3 H 1 2.342 0.020 . 2 . . . . 389 GLN HG3 . 15932 1 1749 . 1 1 176 176 GLN CA C 13 55.991 0.400 . 1 . . . . 389 GLN CA . 15932 1 1750 . 1 1 176 176 GLN CB C 13 29.280 0.400 . 1 . . . . 389 GLN CB . 15932 1 1751 . 1 1 176 176 GLN CG C 13 33.787 0.400 . 1 . . . . 389 GLN CG . 15932 1 1752 . 1 1 176 176 GLN NE2 N 15 111.197 0.400 . 1 . . . . 389 GLN NE2 . 15932 1 1753 . 1 1 177 177 THR H H 1 6.958 0.020 . 1 . . . . 390 THR H . 15932 1 1754 . 1 1 177 177 THR HA H 1 3.970 0.020 . 1 . . . . 390 THR HA . 15932 1 1755 . 1 1 177 177 THR HB H 1 3.839 0.020 . 1 . . . . 390 THR HB . 15932 1 1756 . 1 1 177 177 THR HG21 H 1 0.870 0.020 . 1 . . . . 390 THR HG21 . 15932 1 1757 . 1 1 177 177 THR HG22 H 1 0.870 0.020 . 1 . . . . 390 THR HG22 . 15932 1 1758 . 1 1 177 177 THR HG23 H 1 0.870 0.020 . 1 . . . . 390 THR HG23 . 15932 1 1759 . 1 1 177 177 THR C C 13 172.764 0.400 . 1 . . . . 390 THR C . 15932 1 1760 . 1 1 177 177 THR CA C 13 62.221 0.400 . 1 . . . . 390 THR CA . 15932 1 1761 . 1 1 177 177 THR CB C 13 69.382 0.400 . 1 . . . . 390 THR CB . 15932 1 1762 . 1 1 177 177 THR CG2 C 13 21.389 0.400 . 1 . . . . 390 THR CG2 . 15932 1 1763 . 1 1 177 177 THR N N 15 115.463 0.400 . 1 . . . . 390 THR N . 15932 1 1764 . 1 1 178 178 ARG H H 1 7.873 0.020 . 1 . . . . 391 ARG H . 15932 1 1765 . 1 1 178 178 ARG C C 13 174.982 0.400 . 1 . . . . 391 ARG C . 15932 1 1766 . 1 1 178 178 ARG CA C 13 55.266 0.400 . 1 . . . . 391 ARG CA . 15932 1 1767 . 1 1 178 178 ARG CB C 13 31.052 0.400 . 1 . . . . 391 ARG CB . 15932 1 1768 . 1 1 178 178 ARG CG C 13 26.893 0.400 . 1 . . . . 391 ARG CG . 15932 1 1769 . 1 1 178 178 ARG N N 15 122.116 0.400 . 1 . . . . 391 ARG N . 15932 1 1770 . 1 1 179 179 TYR H H 1 8.812 0.020 . 1 . . . . 392 TYR H . 15932 1 1771 . 1 1 179 179 TYR HA H 1 4.621 0.020 . 1 . . . . 392 TYR HA . 15932 1 1772 . 1 1 179 179 TYR HB2 H 1 3.078 0.020 . 1 . . . . 392 TYR HB2 . 15932 1 1773 . 1 1 179 179 TYR HB3 H 1 3.078 0.020 . 1 . . . . 392 TYR HB3 . 15932 1 1774 . 1 1 179 179 TYR HD1 H 1 6.956 0.020 . 1 . . . . 392 TYR HD1 . 15932 1 1775 . 1 1 179 179 TYR HE1 H 1 6.698 0.020 . 1 . . . . 392 TYR HE1 . 15932 1 1776 . 1 1 179 179 TYR C C 13 174.337 0.400 . 1 . . . . 392 TYR C . 15932 1 1777 . 1 1 179 179 TYR CA C 13 57.444 0.400 . 1 . . . . 392 TYR CA . 15932 1 1778 . 1 1 179 179 TYR CB C 13 40.623 0.400 . 1 . . . . 392 TYR CB . 15932 1 1779 . 1 1 179 179 TYR CD1 C 13 132.157 0.400 . 1 . . . . 392 TYR CD1 . 15932 1 1780 . 1 1 179 179 TYR CE1 C 13 117.925 0.400 . 1 . . . . 392 TYR CE1 . 15932 1 1781 . 1 1 179 179 TYR N N 15 118.296 0.400 . 1 . . . . 392 TYR N . 15932 1 1782 . 1 1 180 180 ILE H H 1 7.254 0.020 . 1 . . . . 393 ILE H . 15932 1 1783 . 1 1 180 180 ILE HA H 1 4.610 0.020 . 1 . . . . 393 ILE HA . 15932 1 1784 . 1 1 180 180 ILE HB H 1 1.301 0.020 . 1 . . . . 393 ILE HB . 15932 1 1785 . 1 1 180 180 ILE HD11 H 1 0.774 0.020 . 1 . . . . 393 ILE HD11 . 15932 1 1786 . 1 1 180 180 ILE HD12 H 1 0.774 0.020 . 1 . . . . 393 ILE HD12 . 15932 1 1787 . 1 1 180 180 ILE HD13 H 1 0.774 0.020 . 1 . . . . 393 ILE HD13 . 15932 1 1788 . 1 1 180 180 ILE HG12 H 1 0.784 0.020 . 2 . . . . 393 ILE HG12 . 15932 1 1789 . 1 1 180 180 ILE HG13 H 1 1.307 0.020 . 2 . . . . 393 ILE HG13 . 15932 1 1790 . 1 1 180 180 ILE HG21 H 1 0.761 0.020 . 1 . . . . 393 ILE HG21 . 15932 1 1791 . 1 1 180 180 ILE HG22 H 1 0.761 0.020 . 1 . . . . 393 ILE HG22 . 15932 1 1792 . 1 1 180 180 ILE HG23 H 1 0.761 0.020 . 1 . . . . 393 ILE HG23 . 15932 1 1793 . 1 1 180 180 ILE C C 13 171.654 0.400 . 1 . . . . 393 ILE C . 15932 1 1794 . 1 1 180 180 ILE CA C 13 56.916 0.400 . 1 . . . . 393 ILE CA . 15932 1 1795 . 1 1 180 180 ILE CB C 13 39.736 0.400 . 1 . . . . 393 ILE CB . 15932 1 1796 . 1 1 180 180 ILE CD1 C 13 14.615 0.400 . 1 . . . . 393 ILE CD1 . 15932 1 1797 . 1 1 180 180 ILE CG1 C 13 24.374 0.400 . 1 . . . . 393 ILE CG1 . 15932 1 1798 . 1 1 180 180 ILE CG2 C 13 19.525 0.400 . 1 . . . . 393 ILE CG2 . 15932 1 1799 . 1 1 180 180 ILE N N 15 108.609 0.400 . 1 . . . . 393 ILE N . 15932 1 1800 . 1 1 181 181 PRO HA H 1 4.709 0.020 . 1 . . . . 394 PRO HA . 15932 1 1801 . 1 1 181 181 PRO HB2 H 1 1.221 0.020 . 1 . . . . 394 PRO HB2 . 15932 1 1802 . 1 1 181 181 PRO HB3 H 1 1.221 0.020 . 1 . . . . 394 PRO HB3 . 15932 1 1803 . 1 1 181 181 PRO HD2 H 1 2.936 0.020 . 1 . . . . 394 PRO HD2 . 15932 1 1804 . 1 1 181 181 PRO HD3 H 1 2.936 0.020 . 1 . . . . 394 PRO HD3 . 15932 1 1805 . 1 1 181 181 PRO HG2 H 1 0.960 0.020 . 1 . . . . 394 PRO HG2 . 15932 1 1806 . 1 1 181 181 PRO HG3 H 1 0.960 0.020 . 1 . . . . 394 PRO HG3 . 15932 1 1807 . 1 1 181 181 PRO C C 13 173.910 0.400 . 1 . . . . 394 PRO C . 15932 1 1808 . 1 1 181 181 PRO CA C 13 62.144 0.400 . 1 . . . . 394 PRO CA . 15932 1 1809 . 1 1 181 181 PRO CB C 13 32.527 0.400 . 1 . . . . 394 PRO CB . 15932 1 1810 . 1 1 181 181 PRO CD C 13 49.066 0.400 . 1 . . . . 394 PRO CD . 15932 1 1811 . 1 1 181 181 PRO CG C 13 28.198 0.400 . 1 . . . . 394 PRO CG . 15932 1 1812 . 1 1 182 182 ASP H H 1 8.296 0.020 . 1 . . . . 395 ASP H . 15932 1 1813 . 1 1 182 182 ASP HA H 1 4.665 0.020 . 1 . . . . 395 ASP HA . 15932 1 1814 . 1 1 182 182 ASP HB2 H 1 2.702 0.020 . 2 . . . . 395 ASP HB2 . 15932 1 1815 . 1 1 182 182 ASP HB3 H 1 2.381 0.020 . 2 . . . . 395 ASP HB3 . 15932 1 1816 . 1 1 182 182 ASP C C 13 175.120 0.400 . 1 . . . . 395 ASP C . 15932 1 1817 . 1 1 182 182 ASP CA C 13 52.455 0.400 . 1 . . . . 395 ASP CA . 15932 1 1818 . 1 1 182 182 ASP CB C 13 38.742 0.400 . 1 . . . . 395 ASP CB . 15932 1 1819 . 1 1 182 182 ASP N N 15 120.042 0.400 . 1 . . . . 395 ASP N . 15932 1 1820 . 1 1 183 183 GLU H H 1 7.651 0.020 . 1 . . . . 396 GLU H . 15932 1 1821 . 1 1 183 183 GLU HA H 1 4.492 0.020 . 1 . . . . 396 GLU HA . 15932 1 1822 . 1 1 183 183 GLU HB2 H 1 2.085 0.020 . 1 . . . . 396 GLU HB2 . 15932 1 1823 . 1 1 183 183 GLU HB3 H 1 2.085 0.020 . 1 . . . . 396 GLU HB3 . 15932 1 1824 . 1 1 183 183 GLU HG2 H 1 2.085 0.020 . 2 . . . . 396 GLU HG2 . 15932 1 1825 . 1 1 183 183 GLU HG3 H 1 2.405 0.020 . 2 . . . . 396 GLU HG3 . 15932 1 1826 . 1 1 183 183 GLU C C 13 173.702 0.400 . 1 . . . . 396 GLU C . 15932 1 1827 . 1 1 183 183 GLU CA C 13 54.897 0.400 . 1 . . . . 396 GLU CA . 15932 1 1828 . 1 1 183 183 GLU CB C 13 32.509 0.400 . 1 . . . . 396 GLU CB . 15932 1 1829 . 1 1 183 183 GLU CG C 13 36.399 0.400 . 1 . . . . 396 GLU CG . 15932 1 1830 . 1 1 183 183 GLU N N 15 117.840 0.400 . 1 . . . . 396 GLU N . 15932 1 1831 . 1 1 184 184 ALA H H 1 8.365 0.020 . 1 . . . . 397 ALA H . 15932 1 1832 . 1 1 184 184 ALA HA H 1 4.394 0.020 . 1 . . . . 397 ALA HA . 15932 1 1833 . 1 1 184 184 ALA HB1 H 1 1.522 0.020 . 1 . . . . 397 ALA HB1 . 15932 1 1834 . 1 1 184 184 ALA HB2 H 1 1.522 0.020 . 1 . . . . 397 ALA HB2 . 15932 1 1835 . 1 1 184 184 ALA HB3 H 1 1.522 0.020 . 1 . . . . 397 ALA HB3 . 15932 1 1836 . 1 1 184 184 ALA C C 13 175.829 0.400 . 1 . . . . 397 ALA C . 15932 1 1837 . 1 1 184 184 ALA CA C 13 52.770 0.400 . 1 . . . . 397 ALA CA . 15932 1 1838 . 1 1 184 184 ALA CB C 13 20.682 0.400 . 1 . . . . 397 ALA CB . 15932 1 1839 . 1 1 184 184 ALA N N 15 121.613 0.400 . 1 . . . . 397 ALA N . 15932 1 1840 . 1 1 185 185 ASP H H 1 7.245 0.020 . 1 . . . . 398 ASP H . 15932 1 1841 . 1 1 185 185 ASP HA H 1 4.092 0.020 . 1 . . . . 398 ASP HA . 15932 1 1842 . 1 1 185 185 ASP HB2 H 1 2.580 0.020 . 2 . . . . 398 ASP HB2 . 15932 1 1843 . 1 1 185 185 ASP HB3 H 1 2.999 0.020 . 2 . . . . 398 ASP HB3 . 15932 1 1844 . 1 1 185 185 ASP C C 13 172.730 0.400 . 1 . . . . 398 ASP C . 15932 1 1845 . 1 1 185 185 ASP CA C 13 56.144 0.400 . 1 . . . . 398 ASP CA . 15932 1 1846 . 1 1 185 185 ASP CB C 13 39.841 0.400 . 1 . . . . 398 ASP CB . 15932 1 1847 . 1 1 185 185 ASP N N 15 105.829 0.400 . 1 . . . . 398 ASP N . 15932 1 1848 . 1 1 186 186 PHE H H 1 8.467 0.020 . 1 . . . . 399 PHE H . 15932 1 1849 . 1 1 186 186 PHE HA H 1 5.486 0.020 . 1 . . . . 399 PHE HA . 15932 1 1850 . 1 1 186 186 PHE HB2 H 1 3.325 0.020 . 1 . . . . 399 PHE HB2 . 15932 1 1851 . 1 1 186 186 PHE HB3 H 1 3.325 0.020 . 1 . . . . 399 PHE HB3 . 15932 1 1852 . 1 1 186 186 PHE C C 13 176.218 0.400 . 1 . . . . 399 PHE C . 15932 1 1853 . 1 1 186 186 PHE CA C 13 57.959 0.400 . 1 . . . . 399 PHE CA . 15932 1 1854 . 1 1 186 186 PHE CB C 13 44.529 0.400 . 1 . . . . 399 PHE CB . 15932 1 1855 . 1 1 186 186 PHE N N 15 116.177 0.400 . 1 . . . . 399 PHE N . 15932 1 1856 . 1 1 187 187 LEU H H 1 8.964 0.020 . 1 . . . . 400 LEU H . 15932 1 1857 . 1 1 187 187 LEU HA H 1 4.963 0.020 . 1 . . . . 400 LEU HA . 15932 1 1858 . 1 1 187 187 LEU HB2 H 1 1.671 0.020 . 1 . . . . 400 LEU HB2 . 15932 1 1859 . 1 1 187 187 LEU HB3 H 1 1.671 0.020 . 1 . . . . 400 LEU HB3 . 15932 1 1860 . 1 1 187 187 LEU HD11 H 1 0.953 0.020 . 2 . . . . 400 LEU HD11 . 15932 1 1861 . 1 1 187 187 LEU HD12 H 1 0.953 0.020 . 2 . . . . 400 LEU HD12 . 15932 1 1862 . 1 1 187 187 LEU HD13 H 1 0.953 0.020 . 2 . . . . 400 LEU HD13 . 15932 1 1863 . 1 1 187 187 LEU HD21 H 1 0.747 0.020 . 2 . . . . 400 LEU HD21 . 15932 1 1864 . 1 1 187 187 LEU HD22 H 1 0.747 0.020 . 2 . . . . 400 LEU HD22 . 15932 1 1865 . 1 1 187 187 LEU HD23 H 1 0.747 0.020 . 2 . . . . 400 LEU HD23 . 15932 1 1866 . 1 1 187 187 LEU HG H 1 1.467 0.020 . 1 . . . . 400 LEU HG . 15932 1 1867 . 1 1 187 187 LEU C C 13 171.747 0.400 . 1 . . . . 400 LEU C . 15932 1 1868 . 1 1 187 187 LEU CA C 13 55.422 0.400 . 1 . . . . 400 LEU CA . 15932 1 1869 . 1 1 187 187 LEU CB C 13 45.641 0.400 . 1 . . . . 400 LEU CB . 15932 1 1870 . 1 1 187 187 LEU CD1 C 13 25.014 0.400 . 1 . . . . 400 LEU CD1 . 15932 1 1871 . 1 1 187 187 LEU CD2 C 13 26.175 0.400 . 1 . . . . 400 LEU CD2 . 15932 1 1872 . 1 1 187 187 LEU CG C 13 27.761 0.400 . 1 . . . . 400 LEU CG . 15932 1 1873 . 1 1 187 187 LEU N N 15 121.383 0.400 . 1 . . . . 400 LEU N . 15932 1 1874 . 1 1 188 188 LEU H H 1 9.312 0.020 . 1 . . . . 401 LEU H . 15932 1 1875 . 1 1 188 188 LEU HA H 1 5.580 0.020 . 1 . . . . 401 LEU HA . 15932 1 1876 . 1 1 188 188 LEU HB2 H 1 1.914 0.020 . 1 . . . . 401 LEU HB2 . 15932 1 1877 . 1 1 188 188 LEU HB3 H 1 1.914 0.020 . 1 . . . . 401 LEU HB3 . 15932 1 1878 . 1 1 188 188 LEU HD11 H 1 0.600 0.020 . 2 . . . . 401 LEU HD11 . 15932 1 1879 . 1 1 188 188 LEU HD12 H 1 0.600 0.020 . 2 . . . . 401 LEU HD12 . 15932 1 1880 . 1 1 188 188 LEU HD13 H 1 0.600 0.020 . 2 . . . . 401 LEU HD13 . 15932 1 1881 . 1 1 188 188 LEU HD21 H 1 0.450 0.020 . 2 . . . . 401 LEU HD21 . 15932 1 1882 . 1 1 188 188 LEU HD22 H 1 0.450 0.020 . 2 . . . . 401 LEU HD22 . 15932 1 1883 . 1 1 188 188 LEU HD23 H 1 0.450 0.020 . 2 . . . . 401 LEU HD23 . 15932 1 1884 . 1 1 188 188 LEU HG H 1 0.831 0.020 . 1 . . . . 401 LEU HG . 15932 1 1885 . 1 1 188 188 LEU C C 13 173.853 0.400 . 1 . . . . 401 LEU C . 15932 1 1886 . 1 1 188 188 LEU CA C 13 53.421 0.400 . 1 . . . . 401 LEU CA . 15932 1 1887 . 1 1 188 188 LEU CB C 13 45.403 0.400 . 1 . . . . 401 LEU CB . 15932 1 1888 . 1 1 188 188 LEU CD1 C 13 24.859 0.400 . 1 . . . . 401 LEU CD1 . 15932 1 1889 . 1 1 188 188 LEU CD2 C 13 24.898 0.400 . 1 . . . . 401 LEU CD2 . 15932 1 1890 . 1 1 188 188 LEU CG C 13 27.558 0.400 . 1 . . . . 401 LEU CG . 15932 1 1891 . 1 1 188 188 LEU N N 15 128.151 0.400 . 1 . . . . 401 LEU N . 15932 1 1892 . 1 1 189 189 GLY H H 1 9.415 0.020 . 1 . . . . 402 GLY H . 15932 1 1893 . 1 1 189 189 GLY HA2 H 1 4.670 0.020 . 2 . . . . 402 GLY HA2 . 15932 1 1894 . 1 1 189 189 GLY HA3 H 1 3.663 0.020 . 2 . . . . 402 GLY HA3 . 15932 1 1895 . 1 1 189 189 GLY C C 13 171.014 0.400 . 1 . . . . 402 GLY C . 15932 1 1896 . 1 1 189 189 GLY CA C 13 44.967 0.400 . 1 . . . . 402 GLY CA . 15932 1 1897 . 1 1 189 189 GLY N N 15 115.881 0.400 . 1 . . . . 402 GLY N . 15932 1 1898 . 1 1 190 190 MET H H 1 8.118 0.020 . 1 . . . . 403 MET H . 15932 1 1899 . 1 1 190 190 MET HA H 1 5.314 0.020 . 1 . . . . 403 MET HA . 15932 1 1900 . 1 1 190 190 MET HB2 H 1 1.696 0.020 . 1 . . . . 403 MET HB2 . 15932 1 1901 . 1 1 190 190 MET HB3 H 1 1.696 0.020 . 1 . . . . 403 MET HB3 . 15932 1 1902 . 1 1 190 190 MET HE1 H 1 1.719 0.020 . 1 . . . . 403 MET HE1 . 15932 1 1903 . 1 1 190 190 MET HE2 H 1 1.719 0.020 . 1 . . . . 403 MET HE2 . 15932 1 1904 . 1 1 190 190 MET HE3 H 1 1.719 0.020 . 1 . . . . 403 MET HE3 . 15932 1 1905 . 1 1 190 190 MET HG2 H 1 2.236 0.020 . 1 . . . . 403 MET HG2 . 15932 1 1906 . 1 1 190 190 MET HG3 H 1 2.236 0.020 . 1 . . . . 403 MET HG3 . 15932 1 1907 . 1 1 190 190 MET C C 13 173.744 0.400 . 1 . . . . 403 MET C . 15932 1 1908 . 1 1 190 190 MET CA C 13 53.284 0.400 . 1 . . . . 403 MET CA . 15932 1 1909 . 1 1 190 190 MET CB C 13 36.614 0.400 . 1 . . . . 403 MET CB . 15932 1 1910 . 1 1 190 190 MET CE C 13 16.712 0.400 . 1 . . . . 403 MET CE . 15932 1 1911 . 1 1 190 190 MET CG C 13 31.088 0.400 . 1 . . . . 403 MET CG . 15932 1 1912 . 1 1 190 190 MET N N 15 122.165 0.400 . 1 . . . . 403 MET N . 15932 1 1913 . 1 1 191 191 ALA H H 1 8.024 0.020 . 1 . . . . 404 ALA H . 15932 1 1914 . 1 1 191 191 ALA HA H 1 3.897 0.020 . 1 . . . . 404 ALA HA . 15932 1 1915 . 1 1 191 191 ALA HB1 H 1 1.113 0.020 . 1 . . . . 404 ALA HB1 . 15932 1 1916 . 1 1 191 191 ALA HB2 H 1 1.113 0.020 . 1 . . . . 404 ALA HB2 . 15932 1 1917 . 1 1 191 191 ALA HB3 H 1 1.113 0.020 . 1 . . . . 404 ALA HB3 . 15932 1 1918 . 1 1 191 191 ALA C C 13 176.708 0.400 . 1 . . . . 404 ALA C . 15932 1 1919 . 1 1 191 191 ALA CA C 13 51.407 0.400 . 1 . . . . 404 ALA CA . 15932 1 1920 . 1 1 191 191 ALA CB C 13 20.384 0.400 . 1 . . . . 404 ALA CB . 15932 1 1921 . 1 1 191 191 ALA N N 15 126.194 0.400 . 1 . . . . 404 ALA N . 15932 1 1922 . 1 1 202 202 PRO HA H 1 4.355 0.020 . 1 . . . . 415 PRO HA . 15932 1 1923 . 1 1 202 202 PRO HB2 H 1 2.160 0.020 . 2 . . . . 415 PRO HB2 . 15932 1 1924 . 1 1 202 202 PRO HB3 H 1 1.727 0.020 . 2 . . . . 415 PRO HB3 . 15932 1 1925 . 1 1 202 202 PRO HD2 H 1 3.596 0.020 . 2 . . . . 415 PRO HD2 . 15932 1 1926 . 1 1 202 202 PRO HD3 H 1 3.743 0.020 . 2 . . . . 415 PRO HD3 . 15932 1 1927 . 1 1 202 202 PRO HG2 H 1 1.916 0.020 . 2 . . . . 415 PRO HG2 . 15932 1 1928 . 1 1 202 202 PRO HG3 H 1 2.010 0.020 . 2 . . . . 415 PRO HG3 . 15932 1 1929 . 1 1 202 202 PRO C C 13 176.037 0.400 . 1 . . . . 415 PRO C . 15932 1 1930 . 1 1 202 202 PRO CA C 13 63.590 0.400 . 1 . . . . 415 PRO CA . 15932 1 1931 . 1 1 202 202 PRO CB C 13 31.887 0.400 . 1 . . . . 415 PRO CB . 15932 1 1932 . 1 1 202 202 PRO CD C 13 50.587 0.400 . 1 . . . . 415 PRO CD . 15932 1 1933 . 1 1 202 202 PRO CG C 13 26.946 0.400 . 1 . . . . 415 PRO CG . 15932 1 1934 . 1 1 203 203 ALA H H 1 8.076 0.020 . 1 . . . . 416 ALA H . 15932 1 1935 . 1 1 203 203 ALA HA H 1 4.228 0.020 . 1 . . . . 416 ALA HA . 15932 1 1936 . 1 1 203 203 ALA HB1 H 1 1.360 0.020 . 1 . . . . 416 ALA HB1 . 15932 1 1937 . 1 1 203 203 ALA HB2 H 1 1.360 0.020 . 1 . . . . 416 ALA HB2 . 15932 1 1938 . 1 1 203 203 ALA HB3 H 1 1.360 0.020 . 1 . . . . 416 ALA HB3 . 15932 1 1939 . 1 1 203 203 ALA C C 13 176.895 0.400 . 1 . . . . 416 ALA C . 15932 1 1940 . 1 1 203 203 ALA CA C 13 52.743 0.400 . 1 . . . . 416 ALA CA . 15932 1 1941 . 1 1 203 203 ALA CB C 13 18.723 0.400 . 1 . . . . 416 ALA CB . 15932 1 1942 . 1 1 203 203 ALA N N 15 119.053 0.400 . 1 . . . . 416 ALA N . 15932 1 1943 . 1 1 204 204 GLU H H 1 7.784 0.020 . 1 . . . . 417 GLU H . 15932 1 1944 . 1 1 204 204 GLU HA H 1 4.350 0.020 . 1 . . . . 417 GLU HA . 15932 1 1945 . 1 1 204 204 GLU HB2 H 1 1.890 0.020 . 1 . . . . 417 GLU HB2 . 15932 1 1946 . 1 1 204 204 GLU HB3 H 1 1.890 0.020 . 1 . . . . 417 GLU HB3 . 15932 1 1947 . 1 1 204 204 GLU HG2 H 1 2.123 0.020 . 1 . . . . 417 GLU HG2 . 15932 1 1948 . 1 1 204 204 GLU HG3 H 1 2.123 0.020 . 1 . . . . 417 GLU HG3 . 15932 1 1949 . 1 1 204 204 GLU C C 13 175.678 0.400 . 1 . . . . 417 GLU C . 15932 1 1950 . 1 1 204 204 GLU CA C 13 55.650 0.400 . 1 . . . . 417 GLU CA . 15932 1 1951 . 1 1 204 204 GLU CB C 13 30.312 0.400 . 1 . . . . 417 GLU CB . 15932 1 1952 . 1 1 204 204 GLU CG C 13 36.305 0.400 . 1 . . . . 417 GLU CG . 15932 1 1953 . 1 1 204 204 GLU N N 15 116.458 0.400 . 1 . . . . 417 GLU N . 15932 1 1954 . 1 1 205 205 GLY H H 1 7.910 0.020 . 1 . . . . 418 GLY H . 15932 1 1955 . 1 1 205 205 GLY CA C 13 43.804 0.400 . 1 . . . . 418 GLY CA . 15932 1 1956 . 1 1 205 205 GLY N N 15 108.024 0.400 . 1 . . . . 418 GLY N . 15932 1 1957 . 1 1 206 206 THR H H 1 8.364 0.020 . 1 . . . . 419 THR H . 15932 1 1958 . 1 1 206 206 THR HA H 1 4.316 0.020 . 1 . . . . 419 THR HA . 15932 1 1959 . 1 1 206 206 THR HB H 1 4.316 0.020 . 1 . . . . 419 THR HB . 15932 1 1960 . 1 1 206 206 THR HG21 H 1 1.320 0.020 . 1 . . . . 419 THR HG21 . 15932 1 1961 . 1 1 206 206 THR HG22 H 1 1.320 0.020 . 1 . . . . 419 THR HG22 . 15932 1 1962 . 1 1 206 206 THR HG23 H 1 1.320 0.020 . 1 . . . . 419 THR HG23 . 15932 1 1963 . 1 1 206 206 THR CA C 13 64.682 0.400 . 1 . . . . 419 THR CA . 15932 1 1964 . 1 1 206 206 THR CB C 13 69.304 0.400 . 1 . . . . 419 THR CB . 15932 1 1965 . 1 1 206 206 THR CG2 C 13 19.707 0.400 . 1 . . . . 419 THR CG2 . 15932 1 1966 . 1 1 206 206 THR N N 15 115.417 0.400 . 1 . . . . 419 THR N . 15932 1 1967 . 1 1 207 207 TRP HA H 1 4.116 0.020 . 1 . . . . 420 TRP HA . 15932 1 1968 . 1 1 207 207 TRP HB2 H 1 3.287 0.020 . 1 . . . . 420 TRP HB2 . 15932 1 1969 . 1 1 207 207 TRP HB3 H 1 3.287 0.020 . 1 . . . . 420 TRP HB3 . 15932 1 1970 . 1 1 207 207 TRP HD1 H 1 7.260 0.020 . 1 . . . . 420 TRP HD1 . 15932 1 1971 . 1 1 207 207 TRP HE1 H 1 10.171 0.020 . 1 . . . . 420 TRP HE1 . 15932 1 1972 . 1 1 207 207 TRP HE3 H 1 7.502 0.020 . 1 . . . . 420 TRP HE3 . 15932 1 1973 . 1 1 207 207 TRP HH2 H 1 7.100 0.020 . 1 . . . . 420 TRP HH2 . 15932 1 1974 . 1 1 207 207 TRP HZ2 H 1 7.426 0.020 . 1 . . . . 420 TRP HZ2 . 15932 1 1975 . 1 1 207 207 TRP HZ3 H 1 7.170 0.020 . 1 . . . . 420 TRP HZ3 . 15932 1 1976 . 1 1 207 207 TRP CA C 13 61.178 0.400 . 1 . . . . 420 TRP CA . 15932 1 1977 . 1 1 207 207 TRP CB C 13 28.670 0.400 . 1 . . . . 420 TRP CB . 15932 1 1978 . 1 1 207 207 TRP CD1 C 13 126.704 0.400 . 1 . . . . 420 TRP CD1 . 15932 1 1979 . 1 1 207 207 TRP CE3 C 13 120.323 0.400 . 1 . . . . 420 TRP CE3 . 15932 1 1980 . 1 1 207 207 TRP CH2 C 13 121.773 0.400 . 1 . . . . 420 TRP CH2 . 15932 1 1981 . 1 1 207 207 TRP CZ2 C 13 114.730 0.400 . 1 . . . . 420 TRP CZ2 . 15932 1 1982 . 1 1 207 207 TRP CZ3 C 13 124.508 0.400 . 1 . . . . 420 TRP CZ3 . 15932 1 1983 . 1 1 207 207 TRP NE1 N 15 129.461 0.400 . 1 . . . . 420 TRP NE1 . 15932 1 1984 . 1 1 209 209 ILE H H 1 6.744 0.020 . 1 . . . . 422 ILE H . 15932 1 1985 . 1 1 209 209 ILE HA H 1 3.349 0.020 . 1 . . . . 422 ILE HA . 15932 1 1986 . 1 1 209 209 ILE HB H 1 2.034 0.020 . 1 . . . . 422 ILE HB . 15932 1 1987 . 1 1 209 209 ILE HD11 H 1 0.508 0.020 . 1 . . . . 422 ILE HD11 . 15932 1 1988 . 1 1 209 209 ILE HD12 H 1 0.508 0.020 . 1 . . . . 422 ILE HD12 . 15932 1 1989 . 1 1 209 209 ILE HD13 H 1 0.508 0.020 . 1 . . . . 422 ILE HD13 . 15932 1 1990 . 1 1 209 209 ILE HG21 H 1 0.627 0.020 . 1 . . . . 422 ILE HG21 . 15932 1 1991 . 1 1 209 209 ILE HG22 H 1 0.627 0.020 . 1 . . . . 422 ILE HG22 . 15932 1 1992 . 1 1 209 209 ILE HG23 H 1 0.627 0.020 . 1 . . . . 422 ILE HG23 . 15932 1 1993 . 1 1 209 209 ILE C C 13 178.143 0.400 . 1 . . . . 422 ILE C . 15932 1 1994 . 1 1 209 209 ILE CA C 13 60.865 0.400 . 1 . . . . 422 ILE CA . 15932 1 1995 . 1 1 209 209 ILE CB C 13 34.371 0.400 . 1 . . . . 422 ILE CB . 15932 1 1996 . 1 1 209 209 ILE CD1 C 13 29.951 0.400 . 1 . . . . 422 ILE CD1 . 15932 1 1997 . 1 1 209 209 ILE CG1 C 13 26.812 0.400 . 1 . . . . 422 ILE CG1 . 15932 1 1998 . 1 1 209 209 ILE CG2 C 13 18.362 0.400 . 1 . . . . 422 ILE CG2 . 15932 1 1999 . 1 1 209 209 ILE N N 15 113.211 0.400 . 1 . . . . 422 ILE N . 15932 1 2000 . 1 1 210 210 GLN H H 1 8.252 0.020 . 1 . . . . 423 GLN H . 15932 1 2001 . 1 1 210 210 GLN HA H 1 3.548 0.020 . 1 . . . . 423 GLN HA . 15932 1 2002 . 1 1 210 210 GLN HB2 H 1 1.825 0.020 . 1 . . . . 423 GLN HB2 . 15932 1 2003 . 1 1 210 210 GLN HB3 H 1 1.825 0.020 . 1 . . . . 423 GLN HB3 . 15932 1 2004 . 1 1 210 210 GLN HG2 H 1 2.324 0.020 . 1 . . . . 423 GLN HG2 . 15932 1 2005 . 1 1 210 210 GLN HG3 H 1 2.324 0.020 . 1 . . . . 423 GLN HG3 . 15932 1 2006 . 1 1 210 210 GLN C C 13 179.079 0.400 . 1 . . . . 423 GLN C . 15932 1 2007 . 1 1 210 210 GLN CA C 13 58.795 0.400 . 1 . . . . 423 GLN CA . 15932 1 2008 . 1 1 210 210 GLN CB C 13 26.704 0.400 . 1 . . . . 423 GLN CB . 15932 1 2009 . 1 1 210 210 GLN CG C 13 33.297 0.400 . 1 . . . . 423 GLN CG . 15932 1 2010 . 1 1 210 210 GLN N N 15 116.455 0.400 . 1 . . . . 423 GLN N . 15932 1 2011 . 1 1 211 211 SER H H 1 8.162 0.020 . 1 . . . . 424 SER H . 15932 1 2012 . 1 1 211 211 SER HA H 1 3.961 0.020 . 1 . . . . 424 SER HA . 15932 1 2013 . 1 1 211 211 SER HB2 H 1 3.356 0.020 . 1 . . . . 424 SER HB2 . 15932 1 2014 . 1 1 211 211 SER HB3 H 1 3.356 0.020 . 1 . . . . 424 SER HB3 . 15932 1 2015 . 1 1 211 211 SER C C 13 179.150 0.400 . 1 . . . . 424 SER C . 15932 1 2016 . 1 1 211 211 SER CA C 13 61.850 0.400 . 1 . . . . 424 SER CA . 15932 1 2017 . 1 1 211 211 SER CB C 13 62.214 0.400 . 1 . . . . 424 SER CB . 15932 1 2018 . 1 1 211 211 SER N N 15 115.041 0.400 . 1 . . . . 424 SER N . 15932 1 2019 . 1 1 212 212 LEU H H 1 8.061 0.020 . 1 . . . . 425 LEU H . 15932 1 2020 . 1 1 212 212 LEU HA H 1 3.540 0.020 . 1 . . . . 425 LEU HA . 15932 1 2021 . 1 1 212 212 LEU HB2 H 1 1.500 0.020 . 1 . . . . 425 LEU HB2 . 15932 1 2022 . 1 1 212 212 LEU HB3 H 1 1.500 0.020 . 1 . . . . 425 LEU HB3 . 15932 1 2023 . 1 1 212 212 LEU HD11 H 1 0.301 0.020 . 2 . . . . 425 LEU HD11 . 15932 1 2024 . 1 1 212 212 LEU HD12 H 1 0.301 0.020 . 2 . . . . 425 LEU HD12 . 15932 1 2025 . 1 1 212 212 LEU HD13 H 1 0.301 0.020 . 2 . . . . 425 LEU HD13 . 15932 1 2026 . 1 1 212 212 LEU HD21 H 1 -0.185 0.020 . 2 . . . . 425 LEU HD21 . 15932 1 2027 . 1 1 212 212 LEU HD22 H 1 -0.185 0.020 . 2 . . . . 425 LEU HD22 . 15932 1 2028 . 1 1 212 212 LEU HD23 H 1 -0.185 0.020 . 2 . . . . 425 LEU HD23 . 15932 1 2029 . 1 1 212 212 LEU HG H 1 0.363 0.020 . 1 . . . . 425 LEU HG . 15932 1 2030 . 1 1 212 212 LEU C C 13 177.566 0.400 . 1 . . . . 425 LEU C . 15932 1 2031 . 1 1 212 212 LEU CA C 13 58.548 0.400 . 1 . . . . 425 LEU CA . 15932 1 2032 . 1 1 212 212 LEU CB C 13 41.665 0.400 . 1 . . . . 425 LEU CB . 15932 1 2033 . 1 1 212 212 LEU CD1 C 13 23.230 0.400 . 1 . . . . 425 LEU CD1 . 15932 1 2034 . 1 1 212 212 LEU CD2 C 13 24.366 0.400 . 1 . . . . 425 LEU CD2 . 15932 1 2035 . 1 1 212 212 LEU CG C 13 26.390 0.400 . 1 . . . . 425 LEU CG . 15932 1 2036 . 1 1 212 212 LEU N N 15 124.082 0.400 . 1 . . . . 425 LEU N . 15932 1 2037 . 1 1 213 213 CYS H H 1 7.940 0.020 . 1 . . . . 426 CYS H . 15932 1 2038 . 1 1 213 213 CYS HA H 1 3.628 0.020 . 1 . . . . 426 CYS HA . 15932 1 2039 . 1 1 213 213 CYS HB2 H 1 2.610 0.020 . 2 . . . . 426 CYS HB2 . 15932 1 2040 . 1 1 213 213 CYS HB3 H 1 2.677 0.020 . 2 . . . . 426 CYS HB3 . 15932 1 2041 . 1 1 213 213 CYS C C 13 175.741 0.400 . 1 . . . . 426 CYS C . 15932 1 2042 . 1 1 213 213 CYS CA C 13 65.159 0.400 . 1 . . . . 426 CYS CA . 15932 1 2043 . 1 1 213 213 CYS CB C 13 49.251 0.400 . 1 . . . . 426 CYS CB . 15932 1 2044 . 1 1 213 213 CYS N N 15 114.351 0.400 . 1 . . . . 426 CYS N . 15932 1 2045 . 1 1 214 214 GLN H H 1 7.510 0.020 . 1 . . . . 427 GLN H . 15932 1 2046 . 1 1 214 214 GLN HA H 1 3.772 0.020 . 1 . . . . 427 GLN HA . 15932 1 2047 . 1 1 214 214 GLN HB2 H 1 2.005 0.020 . 1 . . . . 427 GLN HB2 . 15932 1 2048 . 1 1 214 214 GLN HB3 H 1 2.005 0.020 . 1 . . . . 427 GLN HB3 . 15932 1 2049 . 1 1 214 214 GLN HG2 H 1 2.314 0.020 . 1 . . . . 427 GLN HG2 . 15932 1 2050 . 1 1 214 214 GLN HG3 H 1 2.314 0.020 . 1 . . . . 427 GLN HG3 . 15932 1 2051 . 1 1 214 214 GLN C C 13 177.769 0.400 . 1 . . . . 427 GLN C . 15932 1 2052 . 1 1 214 214 GLN CA C 13 59.019 0.400 . 1 . . . . 427 GLN CA . 15932 1 2053 . 1 1 214 214 GLN CB C 13 27.718 0.400 . 1 . . . . 427 GLN CB . 15932 1 2054 . 1 1 214 214 GLN CG C 13 33.197 0.400 . 1 . . . . 427 GLN CG . 15932 1 2055 . 1 1 214 214 GLN N N 15 117.399 0.400 . 1 . . . . 427 GLN N . 15932 1 2056 . 1 1 215 215 SER H H 1 7.906 0.020 . 1 . . . . 428 SER H . 15932 1 2057 . 1 1 215 215 SER HA H 1 4.173 0.020 . 1 . . . . 428 SER HA . 15932 1 2058 . 1 1 215 215 SER HB2 H 1 3.596 0.020 . 2 . . . . 428 SER HB2 . 15932 1 2059 . 1 1 215 215 SER HB3 H 1 3.800 0.020 . 2 . . . . 428 SER HB3 . 15932 1 2060 . 1 1 215 215 SER CA C 13 62.653 0.400 . 1 . . . . 428 SER CA . 15932 1 2061 . 1 1 215 215 SER CB C 13 62.889 0.400 . 1 . . . . 428 SER CB . 15932 1 2062 . 1 1 215 215 SER N N 15 113.799 0.400 . 1 . . . . 428 SER N . 15932 1 2063 . 1 1 216 216 LEU H H 1 8.505 0.020 . 1 . . . . 429 LEU H . 15932 1 2064 . 1 1 216 216 LEU HA H 1 4.156 0.020 . 1 . . . . 429 LEU HA . 15932 1 2065 . 1 1 216 216 LEU HB2 H 1 1.600 0.020 . 1 . . . . 429 LEU HB2 . 15932 1 2066 . 1 1 216 216 LEU HB3 H 1 1.600 0.020 . 1 . . . . 429 LEU HB3 . 15932 1 2067 . 1 1 216 216 LEU HD11 H 1 0.690 0.020 . 1 . . . . 429 LEU HD11 . 15932 1 2068 . 1 1 216 216 LEU HD12 H 1 0.690 0.020 . 1 . . . . 429 LEU HD12 . 15932 1 2069 . 1 1 216 216 LEU HD13 H 1 0.690 0.020 . 1 . . . . 429 LEU HD13 . 15932 1 2070 . 1 1 216 216 LEU HG H 1 0.358 0.020 . 1 . . . . 429 LEU HG . 15932 1 2071 . 1 1 216 216 LEU C C 13 178.848 0.400 . 1 . . . . 429 LEU C . 15932 1 2072 . 1 1 216 216 LEU CA C 13 58.053 0.400 . 1 . . . . 429 LEU CA . 15932 1 2073 . 1 1 216 216 LEU CB C 13 41.222 0.400 . 1 . . . . 429 LEU CB . 15932 1 2074 . 1 1 216 216 LEU CD1 C 13 23.506 0.400 . 1 . . . . 429 LEU CD1 . 15932 1 2075 . 1 1 216 216 LEU CG C 13 26.582 0.400 . 1 . . . . 429 LEU CG . 15932 1 2076 . 1 1 216 216 LEU N N 15 121.357 0.400 . 1 . . . . 429 LEU N . 15932 1 2077 . 1 1 217 217 ARG H H 1 7.972 0.020 . 1 . . . . 430 ARG H . 15932 1 2078 . 1 1 217 217 ARG HA H 1 3.850 0.020 . 1 . . . . 430 ARG HA . 15932 1 2079 . 1 1 217 217 ARG HB2 H 1 1.725 0.020 . 1 . . . . 430 ARG HB2 . 15932 1 2080 . 1 1 217 217 ARG HB3 H 1 1.725 0.020 . 1 . . . . 430 ARG HB3 . 15932 1 2081 . 1 1 217 217 ARG HD2 H 1 3.086 0.020 . 2 . . . . 430 ARG HD2 . 15932 1 2082 . 1 1 217 217 ARG HD3 H 1 2.928 0.020 . 2 . . . . 430 ARG HD3 . 15932 1 2083 . 1 1 217 217 ARG HG2 H 1 1.486 0.020 . 2 . . . . 430 ARG HG2 . 15932 1 2084 . 1 1 217 217 ARG HG3 H 1 1.923 0.020 . 2 . . . . 430 ARG HG3 . 15932 1 2085 . 1 1 217 217 ARG C C 13 178.237 0.400 . 1 . . . . 430 ARG C . 15932 1 2086 . 1 1 217 217 ARG CA C 13 59.472 0.400 . 1 . . . . 430 ARG CA . 15932 1 2087 . 1 1 217 217 ARG CB C 13 30.256 0.400 . 1 . . . . 430 ARG CB . 15932 1 2088 . 1 1 217 217 ARG CD C 13 43.440 0.400 . 1 . . . . 430 ARG CD . 15932 1 2089 . 1 1 217 217 ARG CG C 13 27.823 0.400 . 1 . . . . 430 ARG CG . 15932 1 2090 . 1 1 217 217 ARG N N 15 116.018 0.400 . 1 . . . . 430 ARG N . 15932 1 2091 . 1 1 218 218 GLU H H 1 7.583 0.020 . 1 . . . . 431 GLU H . 15932 1 2092 . 1 1 218 218 GLU HA H 1 4.119 0.020 . 1 . . . . 431 GLU HA . 15932 1 2093 . 1 1 218 218 GLU HB2 H 1 2.128 0.020 . 1 . . . . 431 GLU HB2 . 15932 1 2094 . 1 1 218 218 GLU HB3 H 1 2.128 0.020 . 1 . . . . 431 GLU HB3 . 15932 1 2095 . 1 1 218 218 GLU HG3 H 1 2.369 0.020 . 1 . . . . 431 GLU HG3 . 15932 1 2096 . 1 1 218 218 GLU C C 13 178.377 0.400 . 1 . . . . 431 GLU C . 15932 1 2097 . 1 1 218 218 GLU CA C 13 58.207 0.400 . 1 . . . . 431 GLU CA . 15932 1 2098 . 1 1 218 218 GLU CB C 13 30.548 0.400 . 1 . . . . 431 GLU CB . 15932 1 2099 . 1 1 218 218 GLU CG C 13 36.188 0.400 . 1 . . . . 431 GLU CG . 15932 1 2100 . 1 1 218 218 GLU N N 15 113.645 0.400 . 1 . . . . 431 GLU N . 15932 1 2101 . 1 1 219 219 ARG H H 1 8.621 0.020 . 1 . . . . 432 ARG H . 15932 1 2102 . 1 1 219 219 ARG HA H 1 4.180 0.020 . 1 . . . . 432 ARG HA . 15932 1 2103 . 1 1 219 219 ARG C C 13 178.455 0.400 . 1 . . . . 432 ARG C . 15932 1 2104 . 1 1 219 219 ARG CA C 13 58.428 0.400 . 1 . . . . 432 ARG CA . 15932 1 2105 . 1 1 219 219 ARG CB C 13 30.936 0.400 . 1 . . . . 432 ARG CB . 15932 1 2106 . 1 1 219 219 ARG CG C 13 27.806 0.400 . 1 . . . . 432 ARG CG . 15932 1 2107 . 1 1 219 219 ARG N N 15 114.272 0.400 . 1 . . . . 432 ARG N . 15932 1 2108 . 1 1 220 220 CYS H H 1 8.828 0.020 . 1 . . . . 433 CYS H . 15932 1 2109 . 1 1 220 220 CYS HA H 1 4.464 0.020 . 1 . . . . 433 CYS HA . 15932 1 2110 . 1 1 220 220 CYS HB2 H 1 3.010 0.020 . 2 . . . . 433 CYS HB2 . 15932 1 2111 . 1 1 220 220 CYS HB3 H 1 3.582 0.020 . 2 . . . . 433 CYS HB3 . 15932 1 2112 . 1 1 220 220 CYS C C 13 176.708 0.400 . 1 . . . . 433 CYS C . 15932 1 2113 . 1 1 220 220 CYS CA C 13 66.312 0.400 . 1 . . . . 433 CYS CA . 15932 1 2114 . 1 1 220 220 CYS CB C 13 47.095 0.400 . 1 . . . . 433 CYS CB . 15932 1 2115 . 1 1 220 220 CYS N N 15 120.012 0.400 . 1 . . . . 433 CYS N . 15932 1 2116 . 1 1 221 221 PRO HA H 1 4.463 0.020 . 1 . . . . 434 PRO HA . 15932 1 2117 . 1 1 221 221 PRO HB2 H 1 2.402 0.020 . 1 . . . . 434 PRO HB2 . 15932 1 2118 . 1 1 221 221 PRO HB3 H 1 2.402 0.020 . 1 . . . . 434 PRO HB3 . 15932 1 2119 . 1 1 221 221 PRO HD2 H 1 3.323 0.020 . 2 . . . . 434 PRO HD2 . 15932 1 2120 . 1 1 221 221 PRO HD3 H 1 3.588 0.020 . 2 . . . . 434 PRO HD3 . 15932 1 2121 . 1 1 221 221 PRO HG2 H 1 1.899 0.020 . 2 . . . . 434 PRO HG2 . 15932 1 2122 . 1 1 221 221 PRO HG3 H 1 2.053 0.020 . 2 . . . . 434 PRO HG3 . 15932 1 2123 . 1 1 221 221 PRO C C 13 177.064 0.400 . 1 . . . . 434 PRO C . 15932 1 2124 . 1 1 221 221 PRO CA C 13 65.717 0.400 . 1 . . . . 434 PRO CA . 15932 1 2125 . 1 1 221 221 PRO CB C 13 31.169 0.400 . 1 . . . . 434 PRO CB . 15932 1 2126 . 1 1 221 221 PRO CD C 13 51.995 0.400 . 1 . . . . 434 PRO CD . 15932 1 2127 . 1 1 221 221 PRO CG C 13 28.137 0.400 . 1 . . . . 434 PRO CG . 15932 1 2128 . 1 1 222 222 ARG H H 1 6.904 0.020 . 1 . . . . 435 ARG H . 15932 1 2129 . 1 1 222 222 ARG HA H 1 4.331 0.020 . 1 . . . . 435 ARG HA . 15932 1 2130 . 1 1 222 222 ARG HB2 H 1 2.039 0.020 . 2 . . . . 435 ARG HB2 . 15932 1 2131 . 1 1 222 222 ARG HB3 H 1 1.910 0.020 . 2 . . . . 435 ARG HB3 . 15932 1 2132 . 1 1 222 222 ARG HD2 H 1 3.233 0.020 . 2 . . . . 435 ARG HD2 . 15932 1 2133 . 1 1 222 222 ARG HD3 H 1 3.166 0.020 . 2 . . . . 435 ARG HD3 . 15932 1 2134 . 1 1 222 222 ARG HG2 H 1 1.740 0.020 . 1 . . . . 435 ARG HG2 . 15932 1 2135 . 1 1 222 222 ARG HG3 H 1 1.740 0.020 . 1 . . . . 435 ARG HG3 . 15932 1 2136 . 1 1 222 222 ARG C C 13 176.536 0.400 . 1 . . . . 435 ARG C . 15932 1 2137 . 1 1 222 222 ARG CA C 13 55.901 0.400 . 1 . . . . 435 ARG CA . 15932 1 2138 . 1 1 222 222 ARG CB C 13 30.116 0.400 . 1 . . . . 435 ARG CB . 15932 1 2139 . 1 1 222 222 ARG CD C 13 43.871 0.400 . 1 . . . . 435 ARG CD . 15932 1 2140 . 1 1 222 222 ARG CG C 13 26.975 0.400 . 1 . . . . 435 ARG CG . 15932 1 2141 . 1 1 222 222 ARG N N 15 112.486 0.400 . 1 . . . . 435 ARG N . 15932 1 2142 . 1 1 223 223 GLY H H 1 8.160 0.020 . 1 . . . . 436 GLY H . 15932 1 2143 . 1 1 223 223 GLY HA2 H 1 4.237 0.020 . 2 . . . . 436 GLY HA2 . 15932 1 2144 . 1 1 223 223 GLY HA3 H 1 3.643 0.020 . 2 . . . . 436 GLY HA3 . 15932 1 2145 . 1 1 223 223 GLY C C 13 173.338 0.400 . 1 . . . . 436 GLY C . 15932 1 2146 . 1 1 223 223 GLY CA C 13 43.988 0.400 . 1 . . . . 436 GLY CA . 15932 1 2147 . 1 1 223 223 GLY N N 15 105.931 0.400 . 1 . . . . 436 GLY N . 15932 1 2148 . 1 1 224 224 ASP H H 1 6.891 0.020 . 1 . . . . 437 ASP H . 15932 1 2149 . 1 1 224 224 ASP HA H 1 4.500 0.020 . 1 . . . . 437 ASP HA . 15932 1 2150 . 1 1 224 224 ASP HB3 H 1 2.321 0.020 . 1 . . . . 437 ASP HB3 . 15932 1 2151 . 1 1 224 224 ASP C C 13 173.806 0.400 . 1 . . . . 437 ASP C . 15932 1 2152 . 1 1 224 224 ASP CA C 13 54.576 0.400 . 1 . . . . 437 ASP CA . 15932 1 2153 . 1 1 224 224 ASP CB C 13 40.588 0.400 . 1 . . . . 437 ASP CB . 15932 1 2154 . 1 1 224 224 ASP N N 15 119.342 0.400 . 1 . . . . 437 ASP N . 15932 1 2155 . 1 1 225 225 ASP H H 1 8.054 0.020 . 1 . . . . 438 ASP H . 15932 1 2156 . 1 1 225 225 ASP HA H 1 4.912 0.020 . 1 . . . . 438 ASP HA . 15932 1 2157 . 1 1 225 225 ASP HB2 H 1 2.835 0.020 . 2 . . . . 438 ASP HB2 . 15932 1 2158 . 1 1 225 225 ASP HB3 H 1 2.369 0.020 . 2 . . . . 438 ASP HB3 . 15932 1 2159 . 1 1 225 225 ASP C C 13 175.631 0.400 . 1 . . . . 438 ASP C . 15932 1 2160 . 1 1 225 225 ASP CA C 13 52.579 0.400 . 1 . . . . 438 ASP CA . 15932 1 2161 . 1 1 225 225 ASP CB C 13 42.616 0.400 . 1 . . . . 438 ASP CB . 15932 1 2162 . 1 1 225 225 ASP N N 15 117.877 0.400 . 1 . . . . 438 ASP N . 15932 1 2163 . 1 1 226 226 ILE H H 1 9.101 0.020 . 1 . . . . 439 ILE H . 15932 1 2164 . 1 1 226 226 ILE HA H 1 3.621 0.020 . 1 . . . . 439 ILE HA . 15932 1 2165 . 1 1 226 226 ILE HB H 1 1.669 0.020 . 1 . . . . 439 ILE HB . 15932 1 2166 . 1 1 226 226 ILE HD11 H 1 0.640 0.020 . 1 . . . . 439 ILE HD11 . 15932 1 2167 . 1 1 226 226 ILE HD12 H 1 0.640 0.020 . 1 . . . . 439 ILE HD12 . 15932 1 2168 . 1 1 226 226 ILE HD13 H 1 0.640 0.020 . 1 . . . . 439 ILE HD13 . 15932 1 2169 . 1 1 226 226 ILE HG12 H 1 1.290 0.020 . 2 . . . . 439 ILE HG12 . 15932 1 2170 . 1 1 226 226 ILE HG13 H 1 0.785 0.020 . 2 . . . . 439 ILE HG13 . 15932 1 2171 . 1 1 226 226 ILE HG21 H 1 0.829 0.020 . 1 . . . . 439 ILE HG21 . 15932 1 2172 . 1 1 226 226 ILE HG22 H 1 0.829 0.020 . 1 . . . . 439 ILE HG22 . 15932 1 2173 . 1 1 226 226 ILE HG23 H 1 0.829 0.020 . 1 . . . . 439 ILE HG23 . 15932 1 2174 . 1 1 226 226 ILE C C 13 176.146 0.400 . 1 . . . . 439 ILE C . 15932 1 2175 . 1 1 226 226 ILE CA C 13 62.602 0.400 . 1 . . . . 439 ILE CA . 15932 1 2176 . 1 1 226 226 ILE CB C 13 36.530 0.400 . 1 . . . . 439 ILE CB . 15932 1 2177 . 1 1 226 226 ILE CD1 C 13 11.934 0.400 . 1 . . . . 439 ILE CD1 . 15932 1 2178 . 1 1 226 226 ILE CG1 C 13 28.418 0.400 . 1 . . . . 439 ILE CG1 . 15932 1 2179 . 1 1 226 226 ILE CG2 C 13 18.612 0.400 . 1 . . . . 439 ILE CG2 . 15932 1 2180 . 1 1 226 226 ILE N N 15 118.352 0.400 . 1 . . . . 439 ILE N . 15932 1 2181 . 1 1 227 227 LEU H H 1 7.814 0.020 . 1 . . . . 440 LEU H . 15932 1 2182 . 1 1 227 227 LEU HA H 1 3.918 0.020 . 1 . . . . 440 LEU HA . 15932 1 2183 . 1 1 227 227 LEU HB2 H 1 1.541 0.020 . 2 . . . . 440 LEU HB2 . 15932 1 2184 . 1 1 227 227 LEU HB3 H 1 1.362 0.020 . 2 . . . . 440 LEU HB3 . 15932 1 2185 . 1 1 227 227 LEU HD11 H 1 0.260 0.020 . 2 . . . . 440 LEU HD11 . 15932 1 2186 . 1 1 227 227 LEU HD12 H 1 0.260 0.020 . 2 . . . . 440 LEU HD12 . 15932 1 2187 . 1 1 227 227 LEU HD13 H 1 0.260 0.020 . 2 . . . . 440 LEU HD13 . 15932 1 2188 . 1 1 227 227 LEU HD21 H 1 0.196 0.020 . 2 . . . . 440 LEU HD21 . 15932 1 2189 . 1 1 227 227 LEU HD22 H 1 0.196 0.020 . 2 . . . . 440 LEU HD22 . 15932 1 2190 . 1 1 227 227 LEU HD23 H 1 0.196 0.020 . 2 . . . . 440 LEU HD23 . 15932 1 2191 . 1 1 227 227 LEU HG H 1 1.284 0.020 . 1 . . . . 440 LEU HG . 15932 1 2192 . 1 1 227 227 LEU C C 13 179.397 0.400 . 1 . . . . 440 LEU C . 15932 1 2193 . 1 1 227 227 LEU CA C 13 58.566 0.400 . 1 . . . . 440 LEU CA . 15932 1 2194 . 1 1 227 227 LEU CB C 13 40.819 0.400 . 1 . . . . 440 LEU CB . 15932 1 2195 . 1 1 227 227 LEU CD1 C 13 23.739 0.400 . 1 . . . . 440 LEU CD1 . 15932 1 2196 . 1 1 227 227 LEU CD2 C 13 23.835 0.400 . 1 . . . . 440 LEU CD2 . 15932 1 2197 . 1 1 227 227 LEU CG C 13 26.486 0.400 . 1 . . . . 440 LEU CG . 15932 1 2198 . 1 1 227 227 LEU N N 15 119.906 0.400 . 1 . . . . 440 LEU N . 15932 1 2199 . 1 1 228 228 THR H H 1 7.665 0.020 . 1 . . . . 441 THR H . 15932 1 2200 . 1 1 228 228 THR HA H 1 4.289 0.020 . 1 . . . . 441 THR HA . 15932 1 2201 . 1 1 228 228 THR HB H 1 4.961 0.020 . 1 . . . . 441 THR HB . 15932 1 2202 . 1 1 228 228 THR HG21 H 1 1.255 0.020 . 1 . . . . 441 THR HG21 . 15932 1 2203 . 1 1 228 228 THR HG22 H 1 1.255 0.020 . 1 . . . . 441 THR HG22 . 15932 1 2204 . 1 1 228 228 THR HG23 H 1 1.255 0.020 . 1 . . . . 441 THR HG23 . 15932 1 2205 . 1 1 228 228 THR C C 13 179.489 0.400 . 1 . . . . 441 THR C . 15932 1 2206 . 1 1 228 228 THR CA C 13 61.837 0.400 . 1 . . . . 441 THR CA . 15932 1 2207 . 1 1 228 228 THR CB C 13 69.979 0.400 . 1 . . . . 441 THR CB . 15932 1 2208 . 1 1 228 228 THR CG2 C 13 22.776 0.400 . 1 . . . . 441 THR CG2 . 15932 1 2209 . 1 1 228 228 THR N N 15 120.011 0.400 . 1 . . . . 441 THR N . 15932 1 2210 . 1 1 229 229 ILE H H 1 7.807 0.020 . 1 . . . . 442 ILE H . 15932 1 2211 . 1 1 229 229 ILE HA H 1 3.300 0.020 . 1 . . . . 442 ILE HA . 15932 1 2212 . 1 1 229 229 ILE HB H 1 1.733 0.020 . 1 . . . . 442 ILE HB . 15932 1 2213 . 1 1 229 229 ILE HD11 H 1 0.632 0.020 . 1 . . . . 442 ILE HD11 . 15932 1 2214 . 1 1 229 229 ILE HD12 H 1 0.632 0.020 . 1 . . . . 442 ILE HD12 . 15932 1 2215 . 1 1 229 229 ILE HD13 H 1 0.632 0.020 . 1 . . . . 442 ILE HD13 . 15932 1 2216 . 1 1 229 229 ILE HG12 H 1 0.463 0.020 . 1 . . . . 442 ILE HG12 . 15932 1 2217 . 1 1 229 229 ILE HG13 H 1 0.463 0.020 . 1 . . . . 442 ILE HG13 . 15932 1 2218 . 1 1 229 229 ILE HG21 H 1 0.661 0.020 . 1 . . . . 442 ILE HG21 . 15932 1 2219 . 1 1 229 229 ILE HG22 H 1 0.661 0.020 . 1 . . . . 442 ILE HG22 . 15932 1 2220 . 1 1 229 229 ILE HG23 H 1 0.661 0.020 . 1 . . . . 442 ILE HG23 . 15932 1 2221 . 1 1 229 229 ILE C C 13 177.728 0.400 . 1 . . . . 442 ILE C . 15932 1 2222 . 1 1 229 229 ILE CA C 13 66.069 0.400 . 1 . . . . 442 ILE CA . 15932 1 2223 . 1 1 229 229 ILE CB C 13 38.260 0.400 . 1 . . . . 442 ILE CB . 15932 1 2224 . 1 1 229 229 ILE CD1 C 13 15.695 0.400 . 1 . . . . 442 ILE CD1 . 15932 1 2225 . 1 1 229 229 ILE CG1 C 13 28.475 0.400 . 1 . . . . 442 ILE CG1 . 15932 1 2226 . 1 1 229 229 ILE CG2 C 13 16.603 0.400 . 1 . . . . 442 ILE CG2 . 15932 1 2227 . 1 1 229 229 ILE N N 15 119.411 0.400 . 1 . . . . 442 ILE N . 15932 1 2228 . 1 1 230 230 LEU H H 1 8.530 0.020 . 1 . . . . 443 LEU H . 15932 1 2229 . 1 1 230 230 LEU HA H 1 3.958 0.020 . 1 . . . . 443 LEU HA . 15932 1 2230 . 1 1 230 230 LEU HB2 H 1 1.831 0.020 . 2 . . . . 443 LEU HB2 . 15932 1 2231 . 1 1 230 230 LEU HB3 H 1 1.672 0.020 . 2 . . . . 443 LEU HB3 . 15932 1 2232 . 1 1 230 230 LEU HD11 H 1 0.968 0.020 . 2 . . . . 443 LEU HD11 . 15932 1 2233 . 1 1 230 230 LEU HD12 H 1 0.968 0.020 . 2 . . . . 443 LEU HD12 . 15932 1 2234 . 1 1 230 230 LEU HD13 H 1 0.968 0.020 . 2 . . . . 443 LEU HD13 . 15932 1 2235 . 1 1 230 230 LEU HD21 H 1 0.904 0.020 . 2 . . . . 443 LEU HD21 . 15932 1 2236 . 1 1 230 230 LEU HD22 H 1 0.904 0.020 . 2 . . . . 443 LEU HD22 . 15932 1 2237 . 1 1 230 230 LEU HD23 H 1 0.904 0.020 . 2 . . . . 443 LEU HD23 . 15932 1 2238 . 1 1 230 230 LEU HG H 1 1.984 0.020 . 1 . . . . 443 LEU HG . 15932 1 2239 . 1 1 230 230 LEU C C 13 178.689 0.400 . 1 . . . . 443 LEU C . 15932 1 2240 . 1 1 230 230 LEU CA C 13 57.697 0.400 . 1 . . . . 443 LEU CA . 15932 1 2241 . 1 1 230 230 LEU CB C 13 42.191 0.400 . 1 . . . . 443 LEU CB . 15932 1 2242 . 1 1 230 230 LEU CD1 C 13 25.957 0.400 . 1 . . . . 443 LEU CD1 . 15932 1 2243 . 1 1 230 230 LEU CD2 C 13 23.493 0.400 . 1 . . . . 443 LEU CD2 . 15932 1 2244 . 1 1 230 230 LEU CG C 13 26.901 0.400 . 1 . . . . 443 LEU CG . 15932 1 2245 . 1 1 230 230 LEU N N 15 116.186 0.400 . 1 . . . . 443 LEU N . 15932 1 2246 . 1 1 231 231 THR H H 1 8.008 0.020 . 1 . . . . 444 THR H . 15932 1 2247 . 1 1 231 231 THR HA H 1 4.153 0.020 . 1 . . . . 444 THR HA . 15932 1 2248 . 1 1 231 231 THR HB H 1 4.389 0.020 . 1 . . . . 444 THR HB . 15932 1 2249 . 1 1 231 231 THR HG21 H 1 1.274 0.020 . 1 . . . . 444 THR HG21 . 15932 1 2250 . 1 1 231 231 THR HG22 H 1 1.274 0.020 . 1 . . . . 444 THR HG22 . 15932 1 2251 . 1 1 231 231 THR HG23 H 1 1.274 0.020 . 1 . . . . 444 THR HG23 . 15932 1 2252 . 1 1 231 231 THR C C 13 175.208 0.400 . 1 . . . . 444 THR C . 15932 1 2253 . 1 1 231 231 THR CA C 13 65.327 0.400 . 1 . . . . 444 THR CA . 15932 1 2254 . 1 1 231 231 THR CB C 13 69.718 0.400 . 1 . . . . 444 THR CB . 15932 1 2255 . 1 1 231 231 THR CG2 C 13 21.116 0.400 . 1 . . . . 444 THR CG2 . 15932 1 2256 . 1 1 231 231 THR N N 15 112.075 0.400 . 1 . . . . 444 THR N . 15932 1 2257 . 1 1 232 232 GLU H H 1 7.717 0.020 . 1 . . . . 445 GLU H . 15932 1 2258 . 1 1 232 232 GLU HA H 1 4.186 0.020 . 1 . . . . 445 GLU HA . 15932 1 2259 . 1 1 232 232 GLU C C 13 177.156 0.400 . 1 . . . . 445 GLU C . 15932 1 2260 . 1 1 232 232 GLU CA C 13 57.891 0.400 . 1 . . . . 445 GLU CA . 15932 1 2261 . 1 1 232 232 GLU CB C 13 28.836 0.400 . 1 . . . . 445 GLU CB . 15932 1 2262 . 1 1 232 232 GLU CG C 13 36.730 0.400 . 1 . . . . 445 GLU CG . 15932 1 2263 . 1 1 232 232 GLU N N 15 120.074 0.400 . 1 . . . . 445 GLU N . 15932 1 2264 . 1 1 233 233 VAL H H 1 7.839 0.020 . 1 . . . . 446 VAL H . 15932 1 2265 . 1 1 233 233 VAL HA H 1 3.849 0.020 . 1 . . . . 446 VAL HA . 15932 1 2266 . 1 1 233 233 VAL HB H 1 2.055 0.020 . 1 . . . . 446 VAL HB . 15932 1 2267 . 1 1 233 233 VAL HG11 H 1 0.910 0.020 . 2 . . . . 446 VAL HG11 . 15932 1 2268 . 1 1 233 233 VAL HG12 H 1 0.910 0.020 . 2 . . . . 446 VAL HG12 . 15932 1 2269 . 1 1 233 233 VAL HG13 H 1 0.910 0.020 . 2 . . . . 446 VAL HG13 . 15932 1 2270 . 1 1 233 233 VAL HG21 H 1 0.742 0.020 . 2 . . . . 446 VAL HG21 . 15932 1 2271 . 1 1 233 233 VAL HG22 H 1 0.742 0.020 . 2 . . . . 446 VAL HG22 . 15932 1 2272 . 1 1 233 233 VAL HG23 H 1 0.742 0.020 . 2 . . . . 446 VAL HG23 . 15932 1 2273 . 1 1 233 233 VAL C C 13 175.709 0.400 . 1 . . . . 446 VAL C . 15932 1 2274 . 1 1 233 233 VAL CA C 13 64.520 0.400 . 1 . . . . 446 VAL CA . 15932 1 2275 . 1 1 233 233 VAL CB C 13 31.894 0.400 . 1 . . . . 446 VAL CB . 15932 1 2276 . 1 1 233 233 VAL CG1 C 13 22.002 0.400 . 1 . . . . 446 VAL CG1 . 15932 1 2277 . 1 1 233 233 VAL CG2 C 13 21.138 0.400 . 1 . . . . 446 VAL CG2 . 15932 1 2278 . 1 1 233 233 VAL N N 15 121.342 0.400 . 1 . . . . 446 VAL N . 15932 1 2279 . 1 1 234 234 ASN HD21 H 1 7.477 0.020 . 2 . . . . 447 ASN HD21 . 15932 1 2280 . 1 1 234 234 ASN HD22 H 1 6.829 0.020 . 2 . . . . 447 ASN HD22 . 15932 1 2281 . 1 1 234 234 ASN ND2 N 15 111.888 0.400 . 1 . . . . 447 ASN ND2 . 15932 1 2282 . 1 1 251 251 PRO HA H 1 4.525 0.020 . 1 . . . . 464 PRO HA . 15932 1 2283 . 1 1 251 251 PRO HB2 H 1 1.951 0.020 . 2 . . . . 464 PRO HB2 . 15932 1 2284 . 1 1 251 251 PRO HB3 H 1 2.308 0.020 . 2 . . . . 464 PRO HB3 . 15932 1 2285 . 1 1 251 251 PRO HD2 H 1 3.833 0.020 . 1 . . . . 464 PRO HD2 . 15932 1 2286 . 1 1 251 251 PRO HD3 H 1 3.833 0.020 . 1 . . . . 464 PRO HD3 . 15932 1 2287 . 1 1 251 251 PRO HG2 H 1 1.941 0.020 . 1 . . . . 464 PRO HG2 . 15932 1 2288 . 1 1 251 251 PRO HG3 H 1 1.941 0.020 . 1 . . . . 464 PRO HG3 . 15932 1 2289 . 1 1 251 251 PRO C C 13 176.149 0.400 . 1 . . . . 464 PRO C . 15932 1 2290 . 1 1 251 251 PRO CA C 13 63.027 0.400 . 1 . . . . 464 PRO CA . 15932 1 2291 . 1 1 251 251 PRO CB C 13 31.966 0.400 . 1 . . . . 464 PRO CB . 15932 1 2292 . 1 1 251 251 PRO CD C 13 50.774 0.400 . 1 . . . . 464 PRO CD . 15932 1 2293 . 1 1 251 251 PRO CG C 13 27.547 0.400 . 1 . . . . 464 PRO CG . 15932 1 2294 . 1 1 252 252 GLN H H 1 8.586 0.020 . 1 . . . . 465 GLN H . 15932 1 2295 . 1 1 252 252 GLN HA H 1 4.689 0.020 . 1 . . . . 465 GLN HA . 15932 1 2296 . 1 1 252 252 GLN C C 13 174.446 0.400 . 1 . . . . 465 GLN C . 15932 1 2297 . 1 1 252 252 GLN CA C 13 53.682 0.400 . 1 . . . . 465 GLN CA . 15932 1 2298 . 1 1 252 252 GLN CB C 13 28.537 0.400 . 1 . . . . 465 GLN CB . 15932 1 2299 . 1 1 252 252 GLN CG C 13 33.844 0.400 . 1 . . . . 465 GLN CG . 15932 1 2300 . 1 1 252 252 GLN N N 15 121.782 0.400 . 1 . . . . 465 GLN N . 15932 1 2301 . 1 1 253 253 PRO HA H 1 4.902 0.020 . 1 . . . . 466 PRO HA . 15932 1 2302 . 1 1 253 253 PRO C C 13 174.937 0.400 . 1 . . . . 466 PRO C . 15932 1 2303 . 1 1 253 253 PRO CA C 13 63.075 0.400 . 1 . . . . 466 PRO CA . 15932 1 2304 . 1 1 253 253 PRO CB C 13 32.384 0.400 . 1 . . . . 466 PRO CB . 15932 1 2305 . 1 1 253 253 PRO CD C 13 50.260 0.400 . 1 . . . . 466 PRO CD . 15932 1 2306 . 1 1 253 253 PRO CG C 13 27.322 0.400 . 1 . . . . 466 PRO CG . 15932 1 2307 . 1 1 254 254 THR H H 1 8.556 0.020 . 1 . . . . 467 THR H . 15932 1 2308 . 1 1 254 254 THR HA H 1 4.659 0.020 . 1 . . . . 467 THR HA . 15932 1 2309 . 1 1 254 254 THR HB H 1 4.120 0.020 . 1 . . . . 467 THR HB . 15932 1 2310 . 1 1 254 254 THR HG21 H 1 1.271 0.020 . 1 . . . . 467 THR HG21 . 15932 1 2311 . 1 1 254 254 THR HG22 H 1 1.271 0.020 . 1 . . . . 467 THR HG22 . 15932 1 2312 . 1 1 254 254 THR HG23 H 1 1.271 0.020 . 1 . . . . 467 THR HG23 . 15932 1 2313 . 1 1 254 254 THR C C 13 172.995 0.400 . 1 . . . . 467 THR C . 15932 1 2314 . 1 1 254 254 THR CA C 13 61.740 0.400 . 1 . . . . 467 THR CA . 15932 1 2315 . 1 1 254 254 THR CB C 13 70.195 0.400 . 1 . . . . 467 THR CB . 15932 1 2316 . 1 1 254 254 THR CG2 C 13 21.329 0.400 . 1 . . . . 467 THR CG2 . 15932 1 2317 . 1 1 254 254 THR N N 15 115.754 0.400 . 1 . . . . 467 THR N . 15932 1 2318 . 1 1 255 255 PHE H H 1 8.560 0.020 . 1 . . . . 468 PHE H . 15932 1 2319 . 1 1 255 255 PHE HA H 1 5.502 0.020 . 1 . . . . 468 PHE HA . 15932 1 2320 . 1 1 255 255 PHE HB2 H 1 3.080 0.020 . 2 . . . . 468 PHE HB2 . 15932 1 2321 . 1 1 255 255 PHE HB3 H 1 3.376 0.020 . 2 . . . . 468 PHE HB3 . 15932 1 2322 . 1 1 255 255 PHE C C 13 173.198 0.400 . 1 . . . . 468 PHE C . 15932 1 2323 . 1 1 255 255 PHE CA C 13 56.283 0.400 . 1 . . . . 468 PHE CA . 15932 1 2324 . 1 1 255 255 PHE CB C 13 43.426 0.400 . 1 . . . . 468 PHE CB . 15932 1 2325 . 1 1 255 255 PHE N N 15 120.481 0.400 . 1 . . . . 468 PHE N . 15932 1 2326 . 1 1 256 256 THR H H 1 9.702 0.020 . 1 . . . . 469 THR H . 15932 1 2327 . 1 1 256 256 THR HA H 1 4.662 0.020 . 1 . . . . 469 THR HA . 15932 1 2328 . 1 1 256 256 THR HB H 1 4.734 0.020 . 1 . . . . 469 THR HB . 15932 1 2329 . 1 1 256 256 THR HG21 H 1 1.121 0.020 . 1 . . . . 469 THR HG21 . 15932 1 2330 . 1 1 256 256 THR HG22 H 1 1.121 0.020 . 1 . . . . 469 THR HG22 . 15932 1 2331 . 1 1 256 256 THR HG23 H 1 1.121 0.020 . 1 . . . . 469 THR HG23 . 15932 1 2332 . 1 1 256 256 THR C C 13 176.561 0.400 . 1 . . . . 469 THR C . 15932 1 2333 . 1 1 256 256 THR CA C 13 59.948 0.400 . 1 . . . . 469 THR CA . 15932 1 2334 . 1 1 256 256 THR CB C 13 69.145 0.400 . 1 . . . . 469 THR CB . 15932 1 2335 . 1 1 256 256 THR CG2 C 13 22.278 0.400 . 1 . . . . 469 THR CG2 . 15932 1 2336 . 1 1 256 256 THR N N 15 108.601 0.400 . 1 . . . . 469 THR N . 15932 1 2337 . 1 1 257 257 LEU H H 1 7.235 0.020 . 1 . . . . 470 LEU H . 15932 1 2338 . 1 1 257 257 LEU HA H 1 4.401 0.020 . 1 . . . . 470 LEU HA . 15932 1 2339 . 1 1 257 257 LEU HB2 H 1 1.550 0.020 . 2 . . . . 470 LEU HB2 . 15932 1 2340 . 1 1 257 257 LEU HB3 H 1 0.830 0.020 . 2 . . . . 470 LEU HB3 . 15932 1 2341 . 1 1 257 257 LEU HD11 H 1 0.875 0.020 . 2 . . . . 470 LEU HD11 . 15932 1 2342 . 1 1 257 257 LEU HD12 H 1 0.875 0.020 . 2 . . . . 470 LEU HD12 . 15932 1 2343 . 1 1 257 257 LEU HD13 H 1 0.875 0.020 . 2 . . . . 470 LEU HD13 . 15932 1 2344 . 1 1 257 257 LEU HD21 H 1 0.810 0.020 . 2 . . . . 470 LEU HD21 . 15932 1 2345 . 1 1 257 257 LEU HD22 H 1 0.810 0.020 . 2 . . . . 470 LEU HD22 . 15932 1 2346 . 1 1 257 257 LEU HD23 H 1 0.810 0.020 . 2 . . . . 470 LEU HD23 . 15932 1 2347 . 1 1 257 257 LEU HG H 1 1.113 0.020 . 1 . . . . 470 LEU HG . 15932 1 2348 . 1 1 257 257 LEU C C 13 175.975 0.400 . 1 . . . . 470 LEU C . 15932 1 2349 . 1 1 257 257 LEU CA C 13 55.492 0.400 . 1 . . . . 470 LEU CA . 15932 1 2350 . 1 1 257 257 LEU CB C 13 41.850 0.400 . 1 . . . . 470 LEU CB . 15932 1 2351 . 1 1 257 257 LEU CD1 C 13 24.947 0.400 . 1 . . . . 470 LEU CD1 . 15932 1 2352 . 1 1 257 257 LEU CD2 C 13 23.101 0.400 . 1 . . . . 470 LEU CD2 . 15932 1 2353 . 1 1 257 257 LEU CG C 13 26.997 0.400 . 1 . . . . 470 LEU CG . 15932 1 2354 . 1 1 257 257 LEU N N 15 120.802 0.400 . 1 . . . . 470 LEU N . 15932 1 2355 . 1 1 258 258 ARG H H 1 8.228 0.020 . 1 . . . . 471 ARG H . 15932 1 2356 . 1 1 258 258 ARG HA H 1 4.631 0.020 . 1 . . . . 471 ARG HA . 15932 1 2357 . 1 1 258 258 ARG HB2 H 1 2.013 0.020 . 2 . . . . 471 ARG HB2 . 15932 1 2358 . 1 1 258 258 ARG HB3 H 1 1.835 0.020 . 2 . . . . 471 ARG HB3 . 15932 1 2359 . 1 1 258 258 ARG HD2 H 1 3.254 0.020 . 1 . . . . 471 ARG HD2 . 15932 1 2360 . 1 1 258 258 ARG HD3 H 1 3.254 0.020 . 1 . . . . 471 ARG HD3 . 15932 1 2361 . 1 1 258 258 ARG HG2 H 1 1.750 0.020 . 2 . . . . 471 ARG HG2 . 15932 1 2362 . 1 1 258 258 ARG HG3 H 1 1.865 0.020 . 2 . . . . 471 ARG HG3 . 15932 1 2363 . 1 1 258 258 ARG C C 13 174.114 0.400 . 1 . . . . 471 ARG C . 15932 1 2364 . 1 1 258 258 ARG CA C 13 55.071 0.400 . 1 . . . . 471 ARG CA . 15932 1 2365 . 1 1 258 258 ARG CB C 13 32.470 0.400 . 1 . . . . 471 ARG CB . 15932 1 2366 . 1 1 258 258 ARG CD C 13 43.046 0.400 . 1 . . . . 471 ARG CD . 15932 1 2367 . 1 1 258 258 ARG CG C 13 27.003 0.400 . 1 . . . . 471 ARG CG . 15932 1 2368 . 1 1 258 258 ARG N N 15 118.883 0.400 . 1 . . . . 471 ARG N . 15932 1 2369 . 1 1 259 259 LYS H H 1 7.217 0.020 . 1 . . . . 472 LYS H . 15932 1 2370 . 1 1 259 259 LYS HA H 1 4.260 0.020 . 1 . . . . 472 LYS HA . 15932 1 2371 . 1 1 259 259 LYS HB2 H 1 -0.117 0.020 . 2 . . . . 472 LYS HB2 . 15932 1 2372 . 1 1 259 259 LYS HB3 H 1 1.021 0.020 . 2 . . . . 472 LYS HB3 . 15932 1 2373 . 1 1 259 259 LYS HD2 H 1 0.989 0.020 . 1 . . . . 472 LYS HD2 . 15932 1 2374 . 1 1 259 259 LYS HD3 H 1 0.989 0.020 . 1 . . . . 472 LYS HD3 . 15932 1 2375 . 1 1 259 259 LYS HE2 H 1 2.580 0.020 . 1 . . . . 472 LYS HE2 . 15932 1 2376 . 1 1 259 259 LYS HE3 H 1 2.580 0.020 . 1 . . . . 472 LYS HE3 . 15932 1 2377 . 1 1 259 259 LYS HG2 H 1 0.492 0.020 . 1 . . . . 472 LYS HG2 . 15932 1 2378 . 1 1 259 259 LYS HG3 H 1 0.492 0.020 . 1 . . . . 472 LYS HG3 . 15932 1 2379 . 1 1 259 259 LYS C C 13 174.571 0.400 . 1 . . . . 472 LYS C . 15932 1 2380 . 1 1 259 259 LYS CA C 13 53.269 0.400 . 1 . . . . 472 LYS CA . 15932 1 2381 . 1 1 259 259 LYS CB C 13 36.332 0.400 . 1 . . . . 472 LYS CB . 15932 1 2382 . 1 1 259 259 LYS CD C 13 29.585 0.400 . 1 . . . . 472 LYS CD . 15932 1 2383 . 1 1 259 259 LYS CE C 13 41.908 0.400 . 1 . . . . 472 LYS CE . 15932 1 2384 . 1 1 259 259 LYS CG C 13 25.387 0.400 . 1 . . . . 472 LYS CG . 15932 1 2385 . 1 1 259 259 LYS N N 15 116.031 0.400 . 1 . . . . 472 LYS N . 15932 1 2386 . 1 1 260 260 LYS H H 1 8.357 0.020 . 1 . . . . 473 LYS H . 15932 1 2387 . 1 1 260 260 LYS HA H 1 4.297 0.020 . 1 . . . . 473 LYS HA . 15932 1 2388 . 1 1 260 260 LYS HB2 H 1 1.925 0.020 . 1 . . . . 473 LYS HB2 . 15932 1 2389 . 1 1 260 260 LYS HB3 H 1 1.925 0.020 . 1 . . . . 473 LYS HB3 . 15932 1 2390 . 1 1 260 260 LYS HD2 H 1 1.333 0.020 . 2 . . . . 473 LYS HD2 . 15932 1 2391 . 1 1 260 260 LYS HD3 H 1 1.603 0.020 . 2 . . . . 473 LYS HD3 . 15932 1 2392 . 1 1 260 260 LYS HE2 H 1 2.857 0.020 . 1 . . . . 473 LYS HE2 . 15932 1 2393 . 1 1 260 260 LYS HE3 H 1 2.857 0.020 . 1 . . . . 473 LYS HE3 . 15932 1 2394 . 1 1 260 260 LYS HG2 H 1 1.556 0.020 . 2 . . . . 473 LYS HG2 . 15932 1 2395 . 1 1 260 260 LYS HG3 H 1 1.323 0.020 . 2 . . . . 473 LYS HG3 . 15932 1 2396 . 1 1 260 260 LYS C C 13 174.137 0.400 . 1 . . . . 473 LYS C . 15932 1 2397 . 1 1 260 260 LYS CA C 13 57.258 0.400 . 1 . . . . 473 LYS CA . 15932 1 2398 . 1 1 260 260 LYS CB C 13 33.561 0.400 . 1 . . . . 473 LYS CB . 15932 1 2399 . 1 1 260 260 LYS CD C 13 28.917 0.400 . 1 . . . . 473 LYS CD . 15932 1 2400 . 1 1 260 260 LYS CE C 13 41.967 0.400 . 1 . . . . 473 LYS CE . 15932 1 2401 . 1 1 260 260 LYS CG C 13 25.739 0.400 . 1 . . . . 473 LYS CG . 15932 1 2402 . 1 1 260 260 LYS N N 15 119.377 0.400 . 1 . . . . 473 LYS N . 15932 1 2403 . 1 1 261 261 LEU H H 1 9.288 0.020 . 1 . . . . 474 LEU H . 15932 1 2404 . 1 1 261 261 LEU HA H 1 5.048 0.020 . 1 . . . . 474 LEU HA . 15932 1 2405 . 1 1 261 261 LEU HB2 H 1 1.989 0.020 . 1 . . . . 474 LEU HB2 . 15932 1 2406 . 1 1 261 261 LEU HB3 H 1 1.989 0.020 . 1 . . . . 474 LEU HB3 . 15932 1 2407 . 1 1 261 261 LEU HD11 H 1 0.785 0.020 . 2 . . . . 474 LEU HD11 . 15932 1 2408 . 1 1 261 261 LEU HD12 H 1 0.785 0.020 . 2 . . . . 474 LEU HD12 . 15932 1 2409 . 1 1 261 261 LEU HD13 H 1 0.785 0.020 . 2 . . . . 474 LEU HD13 . 15932 1 2410 . 1 1 261 261 LEU HD21 H 1 0.530 0.020 . 2 . . . . 474 LEU HD21 . 15932 1 2411 . 1 1 261 261 LEU HD22 H 1 0.530 0.020 . 2 . . . . 474 LEU HD22 . 15932 1 2412 . 1 1 261 261 LEU HD23 H 1 0.530 0.020 . 2 . . . . 474 LEU HD23 . 15932 1 2413 . 1 1 261 261 LEU HG H 1 0.540 0.020 . 1 . . . . 474 LEU HG . 15932 1 2414 . 1 1 261 261 LEU C C 13 172.558 0.400 . 1 . . . . 474 LEU C . 15932 1 2415 . 1 1 261 261 LEU CA C 13 53.327 0.400 . 1 . . . . 474 LEU CA . 15932 1 2416 . 1 1 261 261 LEU CB C 13 44.313 0.400 . 1 . . . . 474 LEU CB . 15932 1 2417 . 1 1 261 261 LEU CD1 C 13 24.515 0.400 . 1 . . . . 474 LEU CD1 . 15932 1 2418 . 1 1 261 261 LEU CD2 C 13 22.802 0.400 . 1 . . . . 474 LEU CD2 . 15932 1 2419 . 1 1 261 261 LEU CG C 13 26.564 0.400 . 1 . . . . 474 LEU CG . 15932 1 2420 . 1 1 261 261 LEU N N 15 126.482 0.400 . 1 . . . . 474 LEU N . 15932 1 2421 . 1 1 262 262 VAL H H 1 8.876 0.020 . 1 . . . . 475 VAL H . 15932 1 2422 . 1 1 262 262 VAL HA H 1 4.238 0.020 . 1 . . . . 475 VAL HA . 15932 1 2423 . 1 1 262 262 VAL HB H 1 1.947 0.020 . 1 . . . . 475 VAL HB . 15932 1 2424 . 1 1 262 262 VAL HG11 H 1 0.725 0.020 . 2 . . . . 475 VAL HG11 . 15932 1 2425 . 1 1 262 262 VAL HG12 H 1 0.725 0.020 . 2 . . . . 475 VAL HG12 . 15932 1 2426 . 1 1 262 262 VAL HG13 H 1 0.725 0.020 . 2 . . . . 475 VAL HG13 . 15932 1 2427 . 1 1 262 262 VAL HG21 H 1 0.769 0.020 . 2 . . . . 475 VAL HG21 . 15932 1 2428 . 1 1 262 262 VAL HG22 H 1 0.769 0.020 . 2 . . . . 475 VAL HG22 . 15932 1 2429 . 1 1 262 262 VAL HG23 H 1 0.769 0.020 . 2 . . . . 475 VAL HG23 . 15932 1 2430 . 1 1 262 262 VAL C C 13 174.243 0.400 . 1 . . . . 475 VAL C . 15932 1 2431 . 1 1 262 262 VAL CA C 13 59.734 0.400 . 1 . . . . 475 VAL CA . 15932 1 2432 . 1 1 262 262 VAL CB C 13 34.790 0.400 . 1 . . . . 475 VAL CB . 15932 1 2433 . 1 1 262 262 VAL CG1 C 13 20.943 0.400 . 1 . . . . 475 VAL CG1 . 15932 1 2434 . 1 1 262 262 VAL CG2 C 13 19.788 0.400 . 1 . . . . 475 VAL CG2 . 15932 1 2435 . 1 1 262 262 VAL N N 15 124.316 0.400 . 1 . . . . 475 VAL N . 15932 1 2436 . 1 1 263 263 PHE H H 1 8.826 0.020 . 1 . . . . 476 PHE H . 15932 1 2437 . 1 1 263 263 PHE HA H 1 5.518 0.020 . 1 . . . . 476 PHE HA . 15932 1 2438 . 1 1 263 263 PHE HB2 H 1 3.328 0.020 . 2 . . . . 476 PHE HB2 . 15932 1 2439 . 1 1 263 263 PHE HB3 H 1 3.497 0.020 . 2 . . . . 476 PHE HB3 . 15932 1 2440 . 1 1 263 263 PHE HD1 H 1 7.503 0.020 . 1 . . . . 476 PHE HD1 . 15932 1 2441 . 1 1 263 263 PHE HE1 H 1 7.286 0.020 . 1 . . . . 476 PHE HE1 . 15932 1 2442 . 1 1 263 263 PHE HZ H 1 6.889 0.020 . 1 . . . . 476 PHE HZ . 15932 1 2443 . 1 1 263 263 PHE C C 13 171.887 0.400 . 1 . . . . 476 PHE C . 15932 1 2444 . 1 1 263 263 PHE CA C 13 52.082 0.400 . 1 . . . . 476 PHE CA . 15932 1 2445 . 1 1 263 263 PHE CB C 13 39.792 0.400 . 1 . . . . 476 PHE CB . 15932 1 2446 . 1 1 263 263 PHE CD1 C 13 131.618 0.400 . 1 . . . . 476 PHE CD1 . 15932 1 2447 . 1 1 263 263 PHE CE1 C 13 130.344 0.400 . 1 . . . . 476 PHE CE1 . 15932 1 2448 . 1 1 263 263 PHE CZ C 13 127.522 0.400 . 1 . . . . 476 PHE CZ . 15932 1 2449 . 1 1 263 263 PHE N N 15 122.867 0.400 . 1 . . . . 476 PHE N . 15932 1 2450 . 1 1 264 264 PRO HA H 1 4.649 0.020 . 1 . . . . 477 PRO HA . 15932 1 2451 . 1 1 264 264 PRO HB2 H 1 2.054 0.020 . 2 . . . . 477 PRO HB2 . 15932 1 2452 . 1 1 264 264 PRO HB3 H 1 2.447 0.020 . 2 . . . . 477 PRO HB3 . 15932 1 2453 . 1 1 264 264 PRO HD2 H 1 3.599 0.020 . 2 . . . . 477 PRO HD2 . 15932 1 2454 . 1 1 264 264 PRO HD3 H 1 4.175 0.020 . 2 . . . . 477 PRO HD3 . 15932 1 2455 . 1 1 264 264 PRO HG2 H 1 2.200 0.020 . 1 . . . . 477 PRO HG2 . 15932 1 2456 . 1 1 264 264 PRO HG3 H 1 2.200 0.020 . 1 . . . . 477 PRO HG3 . 15932 1 2457 . 1 1 264 264 PRO C C 13 178.322 0.400 . 1 . . . . 477 PRO C . 15932 1 2458 . 1 1 264 264 PRO CA C 13 62.333 0.400 . 1 . . . . 477 PRO CA . 15932 1 2459 . 1 1 264 264 PRO CB C 13 32.553 0.400 . 1 . . . . 477 PRO CB . 15932 1 2460 . 1 1 264 264 PRO CD C 13 51.218 0.400 . 1 . . . . 477 PRO CD . 15932 1 2461 . 1 1 264 264 PRO CG C 13 27.322 0.400 . 1 . . . . 477 PRO CG . 15932 1 2462 . 1 1 265 265 SER H H 1 8.763 0.020 . 1 . . . . 478 SER H . 15932 1 2463 . 1 1 265 265 SER HA H 1 4.494 0.020 . 1 . . . . 478 SER HA . 15932 1 2464 . 1 1 265 265 SER HB2 H 1 3.765 0.020 . 2 . . . . 478 SER HB2 . 15932 1 2465 . 1 1 265 265 SER HB3 H 1 3.960 0.020 . 2 . . . . 478 SER HB3 . 15932 1 2466 . 1 1 265 265 SER C C 13 173.725 0.400 . 1 . . . . 478 SER C . 15932 1 2467 . 1 1 265 265 SER CA C 13 59.060 0.400 . 1 . . . . 478 SER CA . 15932 1 2468 . 1 1 265 265 SER CB C 13 64.038 0.400 . 1 . . . . 478 SER CB . 15932 1 2469 . 1 1 265 265 SER N N 15 116.725 0.400 . 1 . . . . 478 SER N . 15932 1 2470 . 1 1 266 266 ASP H H 1 7.954 0.020 . 1 . . . . 479 ASP H . 15932 1 2471 . 1 1 266 266 ASP HA H 1 4.401 0.020 . 1 . . . . 479 ASP HA . 15932 1 2472 . 1 1 266 266 ASP HB2 H 1 2.583 0.020 . 2 . . . . 479 ASP HB2 . 15932 1 2473 . 1 1 266 266 ASP HB3 H 1 2.517 0.020 . 2 . . . . 479 ASP HB3 . 15932 1 2474 . 1 1 266 266 ASP C C 13 179.999 0.400 . 1 . . . . 479 ASP C . 15932 1 2475 . 1 1 266 266 ASP CA C 13 55.657 0.400 . 1 . . . . 479 ASP CA . 15932 1 2476 . 1 1 266 266 ASP CB C 13 42.353 0.400 . 1 . . . . 479 ASP CB . 15932 1 2477 . 1 1 266 266 ASP N N 15 126.669 0.400 . 1 . . . . 479 ASP N . 15932 1 stop_ save_