data_10053 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N assignments of a 59 kDa Salmonella typhimurium periplasmic oligopeptide binding protein OppA ; _BMRB_accession_number 10053 _BMRB_flat_file_name bmr10053.str _Entry_type original _Submission_date 2006-11-26 _Accession_date 2006-11-26 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kurashima-Ito Kaori . . 2 Moromisato Kayano . . 3 Nishimura Kaoru . . 4 Waelchli Markus . . 5 Tame Jeremy . . 6 Ito Yutaka . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 435 "13C chemical shifts" 1371 "15N chemical shifts" 434 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-08-31 update BMRB 'added PubMed ID' 2009-07-14 update BMRB 'completed entry citation' 2007-08-22 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title 'Backbone 1H, 13C and 15N assignments of a 59 kDa Salmonella typhimurium periplasmic oligopeptide binding protein, OppA' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636820 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kurashima-Ito Kaori . . 2 Moromisato Kayano . . 3 Nishimura Kaoru . . 4 Walchli Markus . . 5 Tame Jeremy R.H. . 6 Ito Yutaka . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 1 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 37 _Page_last 39 _Year 2007 _Details . loop_ _Keyword Deuteration 'NMR assignments' oligopeptide OppA TROSY stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name OppA _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label OppA $OppA stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state 'protein monomer' _System_paramagnetic no _System_thiol_state unknown _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_OppA _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common OppA _Molecular_mass . _Mol_thiol_state unkown _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 517 _Mol_residue_sequence ; ADVPAGVQLADKQTLVRNNG SEVQSLDPHKIEGVPESNVS RDLFEGLLISDVEGHPSPGV AEKWENKDFKVWTFHLRENA KWSDGTPVTAHDFVYSWQRL ADPNTASPYASYLQYGHIAN IDDIIAGKKPATDLGVKALD DHTFEVTLSEPVPYFYKLLV HPSVSPVPKSAVEKFGDKWT QPANIVTNGAYKLKNWVVNE RIVLERNPQYWDNAKTVINQ VTYLPISSEVTDVNRYRSGE IDMTYNNMPIELFQKLKKEI PNEVRVDPYLCTYYYEINNQ KAPFNDVRVRTALKLALDRD IIVNKVKNQGDLPAYSYTPP YTDGAKLVEPEWFKWSQQKR NEEAKKLLAEAGFTADKPLT FDLLYNTSDLHKKLAIAVAS IWKKNLGVNVNLENQEWKTF LDTRHQGTFDVARAGWCANY NEPTSFLNTMLSDSSNNTAH YKSPAFDKLIADTLKVADDT QRSELYAKAEQQLDKDSAIV PVYYYVNARLVKPWVGGYTG KDPLDNIYVKNLYIIKH ; loop_ _Residue_seq_code _Residue_label 1 ALA 2 ASP 3 VAL 4 PRO 5 ALA 6 GLY 7 VAL 8 GLN 9 LEU 10 ALA 11 ASP 12 LYS 13 GLN 14 THR 15 LEU 16 VAL 17 ARG 18 ASN 19 ASN 20 GLY 21 SER 22 GLU 23 VAL 24 GLN 25 SER 26 LEU 27 ASP 28 PRO 29 HIS 30 LYS 31 ILE 32 GLU 33 GLY 34 VAL 35 PRO 36 GLU 37 SER 38 ASN 39 VAL 40 SER 41 ARG 42 ASP 43 LEU 44 PHE 45 GLU 46 GLY 47 LEU 48 LEU 49 ILE 50 SER 51 ASP 52 VAL 53 GLU 54 GLY 55 HIS 56 PRO 57 SER 58 PRO 59 GLY 60 VAL 61 ALA 62 GLU 63 LYS 64 TRP 65 GLU 66 ASN 67 LYS 68 ASP 69 PHE 70 LYS 71 VAL 72 TRP 73 THR 74 PHE 75 HIS 76 LEU 77 ARG 78 GLU 79 ASN 80 ALA 81 LYS 82 TRP 83 SER 84 ASP 85 GLY 86 THR 87 PRO 88 VAL 89 THR 90 ALA 91 HIS 92 ASP 93 PHE 94 VAL 95 TYR 96 SER 97 TRP 98 GLN 99 ARG 100 LEU 101 ALA 102 ASP 103 PRO 104 ASN 105 THR 106 ALA 107 SER 108 PRO 109 TYR 110 ALA 111 SER 112 TYR 113 LEU 114 GLN 115 TYR 116 GLY 117 HIS 118 ILE 119 ALA 120 ASN 121 ILE 122 ASP 123 ASP 124 ILE 125 ILE 126 ALA 127 GLY 128 LYS 129 LYS 130 PRO 131 ALA 132 THR 133 ASP 134 LEU 135 GLY 136 VAL 137 LYS 138 ALA 139 LEU 140 ASP 141 ASP 142 HIS 143 THR 144 PHE 145 GLU 146 VAL 147 THR 148 LEU 149 SER 150 GLU 151 PRO 152 VAL 153 PRO 154 TYR 155 PHE 156 TYR 157 LYS 158 LEU 159 LEU 160 VAL 161 HIS 162 PRO 163 SER 164 VAL 165 SER 166 PRO 167 VAL 168 PRO 169 LYS 170 SER 171 ALA 172 VAL 173 GLU 174 LYS 175 PHE 176 GLY 177 ASP 178 LYS 179 TRP 180 THR 181 GLN 182 PRO 183 ALA 184 ASN 185 ILE 186 VAL 187 THR 188 ASN 189 GLY 190 ALA 191 TYR 192 LYS 193 LEU 194 LYS 195 ASN 196 TRP 197 VAL 198 VAL 199 ASN 200 GLU 201 ARG 202 ILE 203 VAL 204 LEU 205 GLU 206 ARG 207 ASN 208 PRO 209 GLN 210 TYR 211 TRP 212 ASP 213 ASN 214 ALA 215 LYS 216 THR 217 VAL 218 ILE 219 ASN 220 GLN 221 VAL 222 THR 223 TYR 224 LEU 225 PRO 226 ILE 227 SER 228 SER 229 GLU 230 VAL 231 THR 232 ASP 233 VAL 234 ASN 235 ARG 236 TYR 237 ARG 238 SER 239 GLY 240 GLU 241 ILE 242 ASP 243 MET 244 THR 245 TYR 246 ASN 247 ASN 248 MET 249 PRO 250 ILE 251 GLU 252 LEU 253 PHE 254 GLN 255 LYS 256 LEU 257 LYS 258 LYS 259 GLU 260 ILE 261 PRO 262 ASN 263 GLU 264 VAL 265 ARG 266 VAL 267 ASP 268 PRO 269 TYR 270 LEU 271 CYS 272 THR 273 TYR 274 TYR 275 TYR 276 GLU 277 ILE 278 ASN 279 ASN 280 GLN 281 LYS 282 ALA 283 PRO 284 PHE 285 ASN 286 ASP 287 VAL 288 ARG 289 VAL 290 ARG 291 THR 292 ALA 293 LEU 294 LYS 295 LEU 296 ALA 297 LEU 298 ASP 299 ARG 300 ASP 301 ILE 302 ILE 303 VAL 304 ASN 305 LYS 306 VAL 307 LYS 308 ASN 309 GLN 310 GLY 311 ASP 312 LEU 313 PRO 314 ALA 315 TYR 316 SER 317 TYR 318 THR 319 PRO 320 PRO 321 TYR 322 THR 323 ASP 324 GLY 325 ALA 326 LYS 327 LEU 328 VAL 329 GLU 330 PRO 331 GLU 332 TRP 333 PHE 334 LYS 335 TRP 336 SER 337 GLN 338 GLN 339 LYS 340 ARG 341 ASN 342 GLU 343 GLU 344 ALA 345 LYS 346 LYS 347 LEU 348 LEU 349 ALA 350 GLU 351 ALA 352 GLY 353 PHE 354 THR 355 ALA 356 ASP 357 LYS 358 PRO 359 LEU 360 THR 361 PHE 362 ASP 363 LEU 364 LEU 365 TYR 366 ASN 367 THR 368 SER 369 ASP 370 LEU 371 HIS 372 LYS 373 LYS 374 LEU 375 ALA 376 ILE 377 ALA 378 VAL 379 ALA 380 SER 381 ILE 382 TRP 383 LYS 384 LYS 385 ASN 386 LEU 387 GLY 388 VAL 389 ASN 390 VAL 391 ASN 392 LEU 393 GLU 394 ASN 395 GLN 396 GLU 397 TRP 398 LYS 399 THR 400 PHE 401 LEU 402 ASP 403 THR 404 ARG 405 HIS 406 GLN 407 GLY 408 THR 409 PHE 410 ASP 411 VAL 412 ALA 413 ARG 414 ALA 415 GLY 416 TRP 417 CYS 418 ALA 419 ASN 420 TYR 421 ASN 422 GLU 423 PRO 424 THR 425 SER 426 PHE 427 LEU 428 ASN 429 THR 430 MET 431 LEU 432 SER 433 ASP 434 SER 435 SER 436 ASN 437 ASN 438 THR 439 ALA 440 HIS 441 TYR 442 LYS 443 SER 444 PRO 445 ALA 446 PHE 447 ASP 448 LYS 449 LEU 450 ILE 451 ALA 452 ASP 453 THR 454 LEU 455 LYS 456 VAL 457 ALA 458 ASP 459 ASP 460 THR 461 GLN 462 ARG 463 SER 464 GLU 465 LEU 466 TYR 467 ALA 468 LYS 469 ALA 470 GLU 471 GLN 472 GLN 473 LEU 474 ASP 475 LYS 476 ASP 477 SER 478 ALA 479 ILE 480 VAL 481 PRO 482 VAL 483 TYR 484 TYR 485 TYR 486 VAL 487 ASN 488 ALA 489 ARG 490 LEU 491 VAL 492 LYS 493 PRO 494 TRP 495 VAL 496 GLY 497 GLY 498 TYR 499 THR 500 GLY 501 LYS 502 ASP 503 PRO 504 LEU 505 ASP 506 ASN 507 ILE 508 TYR 509 VAL 510 LYS 511 ASN 512 LEU 513 TYR 514 ILE 515 ILE 516 LYS 517 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-05 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 1B05 "Structure Of Oligo-Peptide Binding Protein Complexed With Lys-Cys-Lys" 100.00 517 99.81 100.00 0.00e+00 PDB 1B0H "Oligo-Peptide Binding Protein Complexed With Lysyl- Napthylalanyl-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B1H "Oligo-Peptide Binding ProteinTRIPEPTIDE (LYS HPE LYS) Complex" 100.00 517 99.81 100.00 0.00e+00 PDB 1B2H "Oligo-Peptide Binding Protein Complexed With Lysyl-Ornithyl-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B32 "Oligo-Peptide Binding Protein (Oppa) Complexed With Kmk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B3F "Oligo-Peptide Binding Protein (Oppa) Complexed With Khk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B3G "Oligo-Peptide Binding Protein (Oppa) Complexed With Kik" 100.00 517 99.81 100.00 0.00e+00 PDB 1B3H "Oligo-Peptide Binding Protein Complexed With Lysyl- Cyclohexylalanyl-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B3L "Oligo-Peptide Binding Protein (Oppa) Complexed With Kgk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B40 "Oligo-Peptide Binding Protein (Oppa) Complexed With Kfk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B46 "Oligo-Peptide Binding Protein (Oppa) Complexed With Kpk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B4H "Oligo-Peptide Binding Protein Complexed With Lysyl- Diaminobutyric Acid-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B4Z "Oligo-Peptide Binding Protein (Oppa) Complexed With Kdk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B51 "Oligo-Peptide Binding Protein (Oppa) Complexed With Ksk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B52 "Oligo-Peptide Binding Protein (Oppa) Complexed With Ktk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B58 "Oligo-Peptide Binding Protein (Oppa) Complexed With Kyk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B5H "Oligo-Peptide Binding Protein Complexed With Lysyl-Diaminopropanoic Acid-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B5I "Oligo-Peptide Binding Protein (Oppa) Complexed With Knk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B5J "Oligo-Peptide Binding Protein (Oppa) Complexed With Kqk" 100.00 517 99.81 100.00 0.00e+00 PDB 1B6H "Oligo-Peptide Binding Protein Complexed With Lysyl-Norvalyl- Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B7H "Oligo-Peptide Binding Protein Complexed With Lysyl- Norleucyl-Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 1B9J "Oligo-Peptide Binding Protein (Oppa) Complexed With Klk" 100.00 517 99.81 100.00 0.00e+00 PDB 1JET "Oligo-Peptide Binding Protein (Oppa) Complexed With Kak" 100.00 517 99.81 100.00 0.00e+00 PDB 1JEU "Oligo-Peptide Binding Protein (Oppa) Complexed With Kek" 100.00 517 99.81 100.00 0.00e+00 PDB 1JEV "Oligo-peptide Binding Protein (oppa) Complexed With Kwk" 100.00 517 99.81 100.00 0.00e+00 PDB 1OLA "The Structural Basis Of Multispecificity In The Oligopeptide-binding Protein Oppa" 100.00 517 99.81 100.00 0.00e+00 PDB 1OLC "Oligo-Peptide Binding Protein (Oppa) Complexed With Lys-Lys- Lys-Ala" 100.00 517 99.81 100.00 0.00e+00 PDB 1QKA "Oligo-Peptide Binding Protein (Oppa) Complexed With Krk" 100.00 517 99.81 100.00 0.00e+00 PDB 1QKB "Oligo-Peptide Binding Protein (Oppa) Complexed With Kvk" 100.00 517 99.81 100.00 0.00e+00 PDB 1RKM "Structure Of Oppa" 100.00 517 99.81 100.00 0.00e+00 PDB 2OLB "Oligopeptide Binding Protein (Oppa) Complexed With Tri- Lysine" 100.00 517 99.81 100.00 0.00e+00 PDB 2RKM "Structure Of Oppa Complexed With Lys-Lys" 100.00 517 99.81 100.00 0.00e+00 DBJ BAJ36712 "periplasmic oligopeptide-binding protein [Salmonella enterica subsp. enterica serovar Typhimurium str. T000240]" 100.00 543 99.81 100.00 0.00e+00 DBJ BAP07611 "periplasmic oligopeptide-binding protein precursor [Salmonella enterica subsp. enterica serovar Typhimurium str. L-3553]" 100.00 582 99.81 100.00 0.00e+00 EMBL CAA27785 "unnamed protein product [Salmonella enterica subsp. enterica serovar Typhimurium]" 100.00 542 99.81 100.00 0.00e+00 EMBL CAA29039 "unnamed protein product [Salmonella enterica subsp. enterica serovar Typhimurium]" 100.00 542 99.81 100.00 0.00e+00 EMBL CAD08386 "periplasmic oligopeptide-binding protein precursor [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" 100.00 582 99.23 99.61 0.00e+00 EMBL CAR32867 "periplasmic oligopeptide-binding protein precursor (OppA) [Salmonella enterica subsp. enterica serovar Enteritidis str. P125109" 100.00 543 99.42 99.61 0.00e+00 EMBL CAR37243 "periplasmic oligopeptide-binding protein precursor (OppA) [Salmonella enterica subsp. enterica serovar Gallinarum str. 287/91]" 100.00 543 99.23 99.42 0.00e+00 GB AAL20664 "oligopeptide transport protein with chaperone properties [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" 100.00 582 99.81 100.00 0.00e+00 GB AAO69284 "periplasmic oligopeptide-binding protein precursor [Salmonella enterica subsp. enterica serovar Typhi str. Ty2]" 100.00 582 99.23 99.61 0.00e+00 GB AAV77092 "periplasmic oligopeptide-binding protein precursor [Salmonella enterica subsp. enterica serovar Paratyphi A str. ATCC 9150]" 100.00 582 99.03 99.23 0.00e+00 GB AAX65648 "ABC superfamily (periplasm), oligopeptide transport protein with chaperone properties [Salmonella enterica subsp. enterica sero" 100.00 582 99.42 99.61 0.00e+00 GB ABX66895 "hypothetical protein SPAB_01497 [Salmonella enterica subsp. enterica serovar Paratyphi B str. SPB7]" 100.00 543 99.81 100.00 0.00e+00 PIR AG0650 "periplasmic oligopeptide-binding protein precursor [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" 100.00 582 99.23 99.61 0.00e+00 REF NP_455753 "oligopeptide ABC transporter substrate-binding protein OppA [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" 100.00 582 99.23 99.61 0.00e+00 REF NP_460705 "oligopeptide ABC transporter substrate-binding protein OppA [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" 100.00 543 99.81 100.00 0.00e+00 REF WP_000065807 "peptide ABC transporter substrate-binding protein [Salmonella bongori]" 100.00 543 97.49 99.03 0.00e+00 REF WP_000065811 "peptide ABC transporter substrate-binding protein [Salmonella enterica]" 100.00 543 99.81 100.00 0.00e+00 REF WP_000065812 "peptide ABC transporter substrate-binding protein [Salmonella enterica]" 100.00 543 99.23 99.42 0.00e+00 SP P06202 "RecName: Full=Periplasmic oligopeptide-binding protein; Flags: Precursor" 100.00 543 99.81 100.00 0.00e+00 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Fraction $OppA 'Salmonella typhimurium' 602 Bacteria . Salmonella typhimurium no stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $OppA 'recombinant technology' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $OppA . mM 0.7 0.8 '[U-2H; U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name xwinnmr _Version 3.5 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task 'data collection' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name TOPSPIN _Version 1.3 loop_ _Vendor _Address _Electronic_address Bruker . . stop_ loop_ _Task 'data collection' stop_ _Details . save_ save_software_3 _Saveframe_category software _Name AZARA _Version 2.7 loop_ _Vendor _Address _Electronic_address 'Wayne Boucher & Univ. Cambridge' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_4 _Saveframe_category software _Name ANSIG-for-OpenGL _Version 1.0.6 loop_ _Task assignment stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H-15N_TROSY-HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC' _Sample_label $sample_1 save_ save_3D_TROSY-HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _Sample_label $sample_1 save_ save_3D_TROSY-HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CO)CA' _Sample_label $sample_1 save_ save_3D_TROSY-HN(CA)CB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CA)CB' _Sample_label $sample_1 save_ save_3D_TROSY-HN(COCA)CB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(COCA)CB' _Sample_label $sample_1 save_ save_3D_TROSY-HN(CA)CO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CA)CO' _Sample_label $sample_1 save_ save_3D_TROSY-HNCO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCO' _Sample_label $sample_1 save_ save_1H-15N_TROSY-HSQC_800MHz_8 _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC 800MHz' _Sample_label $sample_1 save_ save_1H-15N_TROSY-HSQC _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC' _BMRB_pulse_sequence_accession_number . _Details . save_ save_3D_TROSY-HNCA _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_3D_TROSY-HN(CO)CA _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CO)CA' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_3D_TROSY-HN(CA)CB _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CA)CB' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_3D_TROSY-HN(COCA)CB _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(COCA)CB' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_3D_TROSY-HN(CA)CO _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CA)CO' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_3D_TROSY-HNCO _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCO' _BMRB_pulse_sequence_accession_number . _Details 'nonlinear sampling for t1 and t2' save_ save_1H-15N_TROSY-HSQC_800MHz _Saveframe_category NMR_applied_experiment _Experiment_name '1H-15N TROSY-HSQC 800MHz' _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_condition_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 5.6 0.01 pH temperature 298 0.1 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.0 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.0 . indirect . . . 0.101329118 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_pH56 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '1H-15N TROSY-HSQC' '3D TROSY-HNCA' '3D TROSY-HN(CO)CA' '3D TROSY-HN(CA)CB' '3D TROSY-HN(COCA)CB' '3D TROSY-HN(CA)CO' '3D TROSY-HNCO' '1H-15N TROSY-HSQC 800MHz' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $condition_1 _Chem_shift_reference_set_label $reference_1 _Mol_system_component_name OppA _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 1 ALA C C 172.30 0.02 1 2 1 1 ALA CA C 51.56 0.02 1 3 1 1 ALA CB C 18.64 0.02 1 4 2 2 ASP H H 8.71 0.02 1 5 2 2 ASP C C 173.77 0.02 1 6 2 2 ASP CA C 52.21 0.02 1 7 2 2 ASP CB C 40.58 0.19 1 8 2 2 ASP N N 125.02 0.12 1 9 3 3 VAL H H 8.51 0.02 1 10 3 3 VAL C C 174.55 0.02 1 11 3 3 VAL CA C 59.62 0.02 1 12 3 3 VAL CB C 30.86 0.02 1 13 3 3 VAL N N 129.04 0.12 1 14 4 4 PRO C C 176.15 0.02 1 15 4 4 PRO CA C 62.07 0.02 1 16 4 4 PRO CB C 31.14 0.02 1 17 5 5 ALA H H 8.30 0.02 1 18 5 5 ALA C C 179.00 0.04 1 19 5 5 ALA CA C 52.79 0.03 1 20 5 5 ALA CB C 17.11 0.05 1 21 5 5 ALA N N 126.02 0.10 1 22 6 6 GLY H H 8.56 0.02 1 23 6 6 GLY C C 174.36 0.02 1 24 6 6 GLY CA C 44.65 0.03 1 25 6 6 GLY N N 111.60 0.11 1 26 7 7 VAL H H 7.16 0.02 1 27 7 7 VAL C C 175.19 0.02 1 28 7 7 VAL CA C 62.12 0.02 1 29 7 7 VAL CB C 31.43 0.04 1 30 7 7 VAL N N 123.34 0.13 1 31 8 8 GLN H H 8.77 0.02 1 32 8 8 GLN C C 174.97 0.03 1 33 8 8 GLN CA C 53.62 0.02 1 34 8 8 GLN CB C 28.57 0.03 1 35 8 8 GLN N N 128.97 0.07 1 36 9 9 LEU H H 8.66 0.02 1 37 9 9 LEU C C 177.66 0.03 1 38 9 9 LEU CA C 53.44 0.12 1 39 9 9 LEU CB C 41.17 0.07 1 40 9 9 LEU N N 127.29 0.08 1 41 10 10 ALA H H 7.88 0.02 1 42 10 10 ALA C C 177.52 0.04 1 43 10 10 ALA CA C 50.98 0.04 1 44 10 10 ALA CB C 18.40 0.27 1 45 10 10 ALA N N 125.65 0.13 1 46 11 11 ASP H H 8.59 0.02 1 47 11 11 ASP C C 175.82 0.03 1 48 11 11 ASP CA C 56.09 0.07 1 49 11 11 ASP CB C 39.71 0.13 1 50 11 11 ASP N N 123.68 0.09 1 51 12 12 LYS H H 7.50 0.02 1 52 12 12 LYS C C 175.45 0.02 1 53 12 12 LYS CA C 54.50 0.02 1 54 12 12 LYS CB C 31.49 0.02 1 55 12 12 LYS N N 120.38 0.03 1 56 13 13 GLN H H 8.80 0.02 1 57 13 13 GLN C C 174.53 0.02 1 58 13 13 GLN CA C 52.22 0.02 1 59 13 13 GLN CB C 26.94 0.04 1 60 13 13 GLN N N 130.16 0.08 1 61 14 14 THR H H 6.97 0.02 1 62 14 14 THR C C 171.30 0.02 1 63 14 14 THR CA C 58.68 0.02 1 64 14 14 THR CB C 70.63 0.04 1 65 14 14 THR N N 114.82 0.12 1 66 15 15 LEU H H 7.85 0.02 1 67 15 15 LEU C C 174.98 0.02 1 68 15 15 LEU CA C 52.71 0.02 1 69 15 15 LEU CB C 46.90 0.12 1 70 15 15 LEU N N 123.42 0.11 1 71 16 16 VAL H H 9.99 0.02 1 72 16 16 VAL C C 175.35 0.02 1 73 16 16 VAL CA C 61.29 0.02 1 74 16 16 VAL CB C 32.42 0.02 1 75 16 16 VAL N N 132.52 0.11 1 76 17 17 ARG H H 9.17 0.02 1 77 17 17 ARG C C 175.83 0.02 1 78 17 17 ARG CA C 53.18 0.04 1 79 17 17 ARG CB C 32.12 0.12 1 80 17 17 ARG N N 127.76 0.09 1 81 18 18 ASN H H 8.44 0.02 1 82 18 18 ASN C C 175.73 0.05 1 83 18 18 ASN CA C 53.72 0.07 1 84 18 18 ASN CB C 39.63 0.05 1 85 18 18 ASN N N 120.62 0.05 1 86 19 19 ASN H H 9.47 0.02 1 87 19 19 ASN C C 175.10 0.02 1 88 19 19 ASN CA C 50.91 0.03 1 89 19 19 ASN CB C 42.05 0.02 1 90 19 19 ASN N N 129.42 0.15 1 91 20 20 GLY H H 6.26 0.02 1 92 20 20 GLY C C 173.43 0.06 1 93 20 20 GLY CA C 46.05 0.16 1 94 20 20 GLY N N 105.14 0.20 1 95 21 21 SER H H 7.40 0.02 1 96 21 21 SER C C 172.17 0.04 1 97 21 21 SER CA C 56.64 0.13 1 98 21 21 SER CB C 64.02 0.13 1 99 21 21 SER N N 114.20 0.13 1 100 22 22 GLU H H 8.23 0.02 1 101 22 22 GLU C C 177.16 0.02 1 102 22 22 GLU CA C 55.42 0.02 1 103 22 22 GLU CB C 29.15 0.16 1 104 22 22 GLU N N 124.94 0.14 1 105 23 23 VAL H H 8.07 0.02 1 106 23 23 VAL C C 175.03 0.02 1 107 23 23 VAL CA C 61.46 0.04 1 108 23 23 VAL CB C 31.59 0.06 1 109 23 23 VAL N N 128.23 0.14 1 110 24 24 GLN H H 9.22 0.02 1 111 24 24 GLN C C 176.64 0.02 1 112 24 24 GLN CA C 56.02 0.02 1 113 24 24 GLN CB C 28.35 0.19 1 114 24 24 GLN N N 124.23 0.17 1 115 25 25 SER H H 7.72 0.02 1 116 25 25 SER C C 172.30 0.02 1 117 25 25 SER CA C 56.16 0.08 1 118 25 25 SER CB C 63.56 0.38 1 119 25 25 SER N N 113.84 0.13 1 120 26 26 LEU H H 8.09 0.02 1 121 26 26 LEU C C 175.58 0.09 1 122 26 26 LEU CA C 52.93 0.02 1 123 26 26 LEU CB C 41.16 0.02 1 124 26 26 LEU N N 124.59 0.30 1 125 27 27 ASP H H 8.33 0.02 1 126 27 27 ASP C C 174.65 0.02 1 127 27 27 ASP CA C 50.12 0.02 1 128 27 27 ASP CB C 41.36 0.02 1 129 27 27 ASP N N 125.02 0.06 1 130 30 30 LYS C C 177.31 0.02 1 131 30 30 LYS CA C 52.82 0.02 1 132 31 31 ILE H H 6.91 0.02 1 133 31 31 ILE C C 174.31 0.07 1 134 31 31 ILE CA C 61.61 0.02 1 135 31 31 ILE CB C 39.35 0.02 1 136 31 31 ILE N N 116.98 0.06 1 137 32 32 GLU H H 8.51 0.02 1 138 32 32 GLU C C 176.04 0.07 1 139 32 32 GLU CA C 56.32 0.02 1 140 32 32 GLU CB C 31.46 0.06 1 141 32 32 GLU N N 117.85 0.13 1 142 33 33 GLY H H 7.85 0.02 1 143 33 33 GLY C C 174.61 0.02 1 144 33 33 GLY CA C 43.89 0.02 1 145 33 33 GLY N N 111.48 0.15 1 146 34 34 VAL H H 8.77 0.02 1 147 34 34 VAL C C 174.64 0.02 1 148 34 34 VAL CA C 67.41 0.02 1 149 34 34 VAL CB C 28.77 0.02 1 150 34 34 VAL N N 123.83 0.12 1 151 35 35 PRO C C 180.81 0.02 1 152 35 35 PRO CA C 65.81 0.02 1 153 35 35 PRO CB C 30.30 0.02 1 154 36 36 GLU H H 8.30 0.02 1 155 36 36 GLU C C 179.94 0.02 1 156 36 36 GLU CA C 59.01 0.10 1 157 36 36 GLU CB C 28.01 0.48 1 158 36 36 GLU N N 116.75 0.02 1 159 37 37 SER H H 8.04 0.02 1 160 37 37 SER C C 174.26 0.02 1 161 37 37 SER CA C 62.24 0.07 1 162 37 37 SER N N 121.58 0.10 1 163 38 38 ASN H H 8.26 0.02 1 164 38 38 ASN C C 176.52 0.02 1 165 38 38 ASN CA C 54.04 0.04 1 166 38 38 ASN CB C 36.48 0.20 1 167 38 38 ASN N N 121.40 0.08 1 168 39 39 VAL H H 6.25 0.02 1 169 39 39 VAL C C 177.35 0.05 1 170 39 39 VAL CA C 64.13 0.04 1 171 39 39 VAL CB C 30.36 0.12 1 172 39 39 VAL N N 116.96 0.18 1 173 40 40 SER H H 7.49 0.02 1 174 40 40 SER C C 177.54 0.02 1 175 40 40 SER CA C 61.95 0.02 1 176 40 40 SER CB C 63.89 0.12 1 177 40 40 SER N N 115.16 0.24 1 178 41 41 ARG H H 7.50 0.02 1 179 41 41 ARG C C 177.66 0.08 1 180 41 41 ARG CA C 57.93 0.05 1 181 41 41 ARG CB C 28.84 0.04 1 182 41 41 ARG N N 116.15 0.11 1 183 42 42 ASP H H 6.89 0.03 1 184 42 42 ASP C C 175.47 0.02 1 185 42 42 ASP CA C 56.51 0.02 1 186 42 42 ASP CB C 41.43 0.36 1 187 42 42 ASP N N 120.42 0.13 1 188 43 43 LEU H H 7.01 0.02 1 189 43 43 LEU C C 176.93 0.02 1 190 43 43 LEU CA C 55.35 0.02 1 191 43 43 LEU CB C 45.42 0.07 1 192 43 43 LEU N N 118.79 0.02 1 193 44 44 PHE H H 9.13 0.04 1 194 44 44 PHE C C 174.38 0.03 1 195 44 44 PHE CA C 56.59 0.02 1 196 44 44 PHE CB C 42.10 0.20 1 197 44 44 PHE N N 119.43 0.12 1 198 45 45 GLU H H 9.17 0.04 1 199 45 45 GLU C C 174.14 0.02 1 200 45 45 GLU CA C 55.64 0.04 1 201 45 45 GLU CB C 34.37 0.02 1 202 45 45 GLU N N 126.78 0.14 1 203 46 46 GLY H H 8.80 0.04 1 204 46 46 GLY C C 173.35 0.02 1 205 46 46 GLY CA C 42.87 0.03 1 206 46 46 GLY N N 116.59 0.13 1 207 47 47 LEU H H 9.70 0.04 1 208 47 47 LEU C C 176.28 0.02 1 209 47 47 LEU CA C 57.53 0.02 1 210 47 47 LEU CB C 40.31 0.14 1 211 47 47 LEU N N 122.42 0.10 1 212 48 48 LEU H H 6.69 0.04 1 213 48 48 LEU C C 173.99 0.04 1 214 48 48 LEU CA C 54.42 0.07 1 215 48 48 LEU CB C 45.85 0.08 1 216 48 48 LEU N N 115.67 0.10 1 217 49 49 ILE H H 8.69 0.03 1 218 49 49 ILE C C 175.09 0.02 1 219 49 49 ILE CA C 59.22 0.19 1 220 49 49 ILE CB C 41.26 0.02 1 221 49 49 ILE N N 114.55 0.10 1 222 50 50 SER H H 8.14 0.02 1 223 50 50 SER C C 173.82 0.02 1 224 50 50 SER CA C 57.90 0.02 1 225 50 50 SER CB C 63.52 0.43 1 226 50 50 SER N N 119.55 0.25 1 227 51 51 ASP H H 8.64 0.02 1 228 51 51 ASP C C 179.40 0.02 1 229 51 51 ASP CA C 51.86 0.02 1 230 51 51 ASP CB C 40.13 0.40 1 231 51 51 ASP N N 124.87 0.14 1 232 52 52 VAL H H 7.82 0.02 1 233 52 52 VAL C C 176.92 0.02 1 234 52 52 VAL CA C 63.68 0.02 1 235 52 52 VAL CB C 30.36 0.15 1 236 52 52 VAL N N 111.96 0.16 1 237 53 53 GLU H H 8.23 0.02 1 238 53 53 GLU C C 174.72 0.02 1 239 53 53 GLU CA C 54.63 0.08 1 240 53 53 GLU CB C 28.71 0.06 1 241 53 53 GLU N N 123.05 0.17 1 242 54 54 GLY H H 7.97 0.02 1 243 54 54 GLY C C 174.44 0.03 1 244 54 54 GLY CA C 44.94 0.15 1 245 54 54 GLY N N 108.15 0.11 1 246 55 55 HIS H H 8.70 0.02 1 247 55 55 HIS C C 173.15 0.02 1 248 55 55 HIS CA C 52.13 0.02 1 249 55 55 HIS CB C 27.24 0.02 1 250 55 55 HIS N N 123.78 0.15 1 251 56 56 PRO C C 176.18 0.02 1 252 56 56 PRO CA C 63.10 0.07 1 253 56 56 PRO CB C 30.73 0.03 1 254 57 57 SER H H 9.52 0.03 1 255 57 57 SER CA C 56.29 0.02 1 256 57 57 SER CB C 65.26 0.02 1 257 57 57 SER N N 124.02 0.10 1 258 58 58 PRO C C 175.19 0.02 1 259 58 58 PRO CA C 65.87 0.02 1 260 58 58 PRO CB C 32.51 0.04 1 261 59 59 GLY H H 7.85 0.02 1 262 59 59 GLY C C 172.99 0.02 1 263 59 59 GLY CA C 44.10 0.10 1 264 59 59 GLY N N 116.48 0.14 1 265 60 60 VAL H H 8.93 0.03 1 266 60 60 VAL C C 176.18 0.03 1 267 60 60 VAL CA C 65.94 0.06 1 268 60 60 VAL CB C 31.41 0.20 1 269 60 60 VAL N N 129.87 0.12 1 270 61 61 ALA H H 8.83 0.03 1 271 61 61 ALA C C 174.26 0.02 1 272 61 61 ALA CA C 50.97 0.02 1 273 61 61 ALA CB C 19.17 0.02 1 274 61 61 ALA N N 120.62 0.12 1 275 62 62 GLU H H 8.51 0.02 1 276 62 62 GLU C C 176.09 0.02 1 277 62 62 GLU CA C 55.78 0.11 1 278 62 62 GLU CB C 30.16 0.02 1 279 62 62 GLU N N 120.99 0.16 1 280 63 63 LYS H H 7.75 0.02 1 281 63 63 LYS C C 173.83 0.04 1 282 63 63 LYS CA C 54.75 0.06 1 283 63 63 LYS CB C 34.52 0.15 1 284 63 63 LYS N N 116.92 0.14 1 285 64 64 TRP H H 7.81 0.02 1 286 64 64 TRP C C 173.41 0.02 1 287 64 64 TRP CA C 55.57 0.02 1 288 64 64 TRP CB C 31.33 0.16 1 289 64 64 TRP N N 122.09 0.09 1 290 65 65 GLU H H 8.35 0.02 1 291 65 65 GLU C C 173.73 0.04 1 292 65 65 GLU CA C 54.17 0.02 1 293 65 65 GLU CB C 31.53 0.04 1 294 65 65 GLU N N 117.25 0.11 1 295 66 66 ASN H H 8.37 0.02 1 296 66 66 ASN C C 172.28 0.02 1 297 66 66 ASN CA C 51.62 0.05 1 298 66 66 ASN CB C 42.15 0.05 1 299 66 66 ASN N N 116.47 0.16 1 300 67 67 LYS H H 8.26 0.02 1 301 67 67 LYS C C 176.39 0.02 1 302 67 67 LYS CA C 54.08 0.06 1 303 67 67 LYS CB C 32.63 0.02 1 304 67 67 LYS N N 122.36 0.17 1 305 68 68 ASP H H 9.04 0.02 1 306 68 68 ASP C C 173.59 0.02 1 307 68 68 ASP CA C 55.23 0.05 1 308 68 68 ASP CB C 38.96 0.05 1 309 68 68 ASP N N 128.02 0.13 1 310 69 69 PHE H H 8.07 0.02 1 311 69 69 PHE C C 175.31 0.03 1 312 69 69 PHE CA C 57.92 0.04 1 313 69 69 PHE CB C 36.40 0.10 1 314 69 69 PHE N N 110.82 0.12 1 315 70 70 LYS H H 8.31 0.02 1 316 70 70 LYS C C 174.12 0.03 1 317 70 70 LYS CA C 57.08 0.06 1 318 70 70 LYS CB C 34.89 0.13 1 319 70 70 LYS N N 122.60 0.08 1 320 71 71 VAL H H 7.18 0.02 1 321 71 71 VAL C C 176.42 0.04 1 322 71 71 VAL CA C 60.90 0.03 1 323 71 71 VAL CB C 32.91 0.02 1 324 71 71 VAL N N 120.39 0.15 1 325 72 72 TRP H H 9.83 0.03 1 326 72 72 TRP C C 173.70 0.02 1 327 72 72 TRP CA C 55.56 0.04 1 328 72 72 TRP CB C 31.07 0.02 1 329 72 72 TRP N N 134.10 0.14 1 330 73 73 THR H H 8.71 0.03 1 331 73 73 THR C C 172.21 0.05 1 332 73 73 THR CA C 61.96 0.14 1 333 73 73 THR CB C 68.77 0.28 1 334 73 73 THR N N 122.77 0.10 1 335 74 74 PHE H H 9.50 0.02 1 336 74 74 PHE C C 173.86 0.02 1 337 74 74 PHE CA C 56.67 0.02 1 338 74 74 PHE CB C 40.73 0.06 1 339 74 74 PHE N N 125.17 0.09 1 340 75 75 HIS H H 8.95 0.03 1 341 75 75 HIS C C 173.81 0.03 1 342 75 75 HIS CA C 54.13 0.02 1 343 75 75 HIS CB C 27.42 0.18 1 344 75 75 HIS N N 125.62 0.07 1 345 76 76 LEU H H 9.25 0.03 1 346 76 76 LEU C C 176.66 0.02 1 347 76 76 LEU CA C 54.48 0.07 1 348 76 76 LEU CB C 39.94 0.02 1 349 76 76 LEU N N 128.03 0.15 1 350 77 77 ARG H H 8.57 0.03 1 351 77 77 ARG C C 177.85 0.02 1 352 77 77 ARG CA C 55.17 0.02 1 353 77 77 ARG CB C 29.02 0.02 1 354 77 77 ARG N N 124.09 0.19 1 355 78 78 GLU H H 8.94 0.04 1 356 78 78 GLU C C 176.47 0.03 1 357 78 78 GLU CA C 58.17 0.05 1 358 78 78 GLU CB C 28.17 0.26 1 359 78 78 GLU N N 125.31 0.18 1 360 79 79 ASN H H 8.21 0.02 1 361 79 79 ASN C C 174.55 0.02 1 362 79 79 ASN CA C 51.48 0.05 1 363 79 79 ASN CB C 36.19 0.02 1 364 79 79 ASN N N 114.73 0.10 1 365 80 80 ALA H H 6.97 0.03 1 366 80 80 ALA C C 176.62 0.02 1 367 80 80 ALA CA C 52.91 0.06 1 368 80 80 ALA CB C 17.59 0.08 1 369 80 80 ALA N N 123.77 0.11 1 370 81 81 LYS H H 8.41 0.03 1 371 81 81 LYS C C 176.55 0.05 1 372 81 81 LYS CA C 55.86 0.08 1 373 81 81 LYS CB C 37.72 0.13 1 374 81 81 LYS N N 128.29 0.15 1 375 82 82 TRP H H 9.31 0.03 1 376 82 82 TRP C C 179.54 0.02 1 377 82 82 TRP CA C 56.01 0.02 1 378 82 82 TRP CB C 30.98 0.02 1 379 82 82 TRP N N 123.24 0.15 1 380 83 83 SER C C 174.78 0.02 1 381 83 83 SER CA C 60.76 0.02 1 382 83 83 SER CB C 61.30 0.02 1 383 84 84 ASP H H 7.60 0.02 1 384 84 84 ASP C C 177.17 0.02 1 385 84 84 ASP CA C 52.75 0.07 1 386 84 84 ASP CB C 39.60 0.02 1 387 84 84 ASP N N 122.58 0.09 1 388 85 85 GLY H H 8.73 0.02 1 389 85 85 GLY C C 174.02 0.02 1 390 85 85 GLY CA C 44.50 0.10 1 391 85 85 GLY N N 110.99 0.08 1 392 86 86 THR H H 8.04 0.02 1 393 86 86 THR C C 172.08 0.02 1 394 86 86 THR CA C 60.27 0.02 1 395 86 86 THR CB C 68.44 0.02 1 396 86 86 THR N N 117.84 0.11 1 397 87 87 PRO C C 177.07 0.02 1 398 87 87 PRO CA C 63.24 0.02 1 399 87 87 PRO CB C 31.00 0.02 1 400 88 88 VAL H H 7.86 0.02 1 401 88 88 VAL C C 176.29 0.03 1 402 88 88 VAL CA C 60.89 0.02 1 403 88 88 VAL CB C 29.95 0.09 1 404 88 88 VAL N N 125.48 0.14 1 405 89 89 THR H H 9.13 0.02 1 406 89 89 THR C C 176.79 0.04 1 407 89 89 THR CA C 58.97 0.02 1 408 89 89 THR CB C 73.50 0.11 1 409 89 89 THR N N 118.04 0.11 1 410 90 90 ALA H H 8.76 0.02 1 411 90 90 ALA C C 178.79 0.06 1 412 90 90 ALA CA C 54.10 0.09 1 413 90 90 ALA CB C 18.27 0.18 1 414 90 90 ALA N N 123.01 0.11 1 415 91 91 HIS H H 7.34 0.02 1 416 91 91 HIS C C 178.37 0.03 1 417 91 91 HIS CA C 57.41 0.02 1 418 91 91 HIS CB C 28.01 0.28 1 419 91 91 HIS N N 116.98 0.35 1 420 92 92 ASP H H 7.67 0.02 1 421 92 92 ASP C C 179.82 0.02 1 422 92 92 ASP CA C 57.81 0.11 1 423 92 92 ASP CB C 40.92 0.40 1 424 92 92 ASP N N 121.41 0.05 1 425 93 93 PHE H H 6.90 0.03 1 426 93 93 PHE C C 175.47 0.03 1 427 93 93 PHE CA C 63.27 0.09 1 428 93 93 PHE CB C 36.87 0.09 1 429 93 93 PHE N N 122.66 0.17 1 430 94 94 VAL H H 7.77 0.02 1 431 94 94 VAL C C 176.13 0.04 1 432 94 94 VAL CA C 66.40 0.08 1 433 94 94 VAL CB C 31.48 0.06 1 434 94 94 VAL N N 122.49 0.23 1 435 95 95 TYR H H 7.72 0.03 1 436 95 95 TYR C C 177.90 0.02 1 437 95 95 TYR CA C 60.43 0.02 1 438 95 95 TYR CB C 38.50 0.02 1 439 95 95 TYR N N 118.17 0.13 1 440 97 97 TRP C C 177.89 0.02 1 441 97 97 TRP CA C 58.95 0.02 1 442 97 97 TRP CB C 27.29 0.02 1 443 98 98 GLN H H 7.62 0.02 1 444 98 98 GLN C C 176.74 0.02 1 445 98 98 GLN CA C 59.31 0.02 1 446 98 98 GLN CB C 26.38 0.06 1 447 98 98 GLN N N 118.54 0.15 1 448 99 99 ARG H H 7.63 0.03 1 449 99 99 ARG C C 178.37 0.05 1 450 99 99 ARG CA C 59.03 0.02 1 451 99 99 ARG CB C 28.55 0.05 1 452 99 99 ARG N N 122.05 0.10 1 453 100 100 LEU H H 7.85 0.03 1 454 100 100 LEU C C 176.71 0.02 1 455 100 100 LEU CA C 57.05 0.08 1 456 100 100 LEU CB C 40.26 0.11 1 457 100 100 LEU N N 123.37 0.25 1 458 101 101 ALA H H 7.21 0.03 1 459 101 101 ALA C C 176.75 0.02 1 460 101 101 ALA CA C 52.69 0.02 1 461 101 101 ALA CB C 19.08 0.02 1 462 101 101 ALA N N 119.33 0.11 1 463 102 102 ASP H H 7.21 0.03 1 464 102 102 ASP C C 176.54 0.02 1 465 102 102 ASP CA C 51.86 0.02 1 466 102 102 ASP CB C 41.22 0.02 1 467 102 102 ASP N N 119.20 0.03 1 468 103 103 PRO C C 179.64 0.02 1 469 103 103 PRO CA C 64.70 0.03 1 470 103 103 PRO CB C 30.99 0.02 1 471 104 104 ASN H H 8.82 0.02 1 472 104 104 ASN C C 176.76 0.02 1 473 104 104 ASN CA C 55.41 0.02 1 474 104 104 ASN CB C 37.79 0.05 1 475 104 104 ASN N N 118.19 0.10 1 476 105 105 THR H H 8.04 0.02 1 477 105 105 THR C C 173.80 0.02 1 478 105 105 THR CA C 62.63 0.02 1 479 105 105 THR CB C 67.24 0.10 1 480 105 105 THR N N 119.64 0.20 1 481 106 106 ALA H H 7.41 0.02 1 482 106 106 ALA C C 177.16 0.02 1 483 106 106 ALA CA C 51.65 0.04 1 484 106 106 ALA CB C 15.21 0.08 1 485 106 106 ALA N N 121.70 0.13 1 486 107 107 SER H H 8.77 0.02 1 487 107 107 SER C C 177.59 0.02 1 488 107 107 SER CA C 56.25 0.02 1 489 107 107 SER CB C 64.01 0.02 1 490 107 107 SER N N 116.50 0.11 1 491 108 108 PRO C C 177.44 0.02 1 492 108 108 PRO CA C 63.46 0.02 1 493 108 108 PRO CB C 31.53 0.02 1 494 109 109 TYR H H 8.23 0.02 1 495 109 109 TYR C C 175.84 0.02 1 496 109 109 TYR CA C 56.57 0.04 1 497 109 109 TYR CB C 37.31 0.02 1 498 109 109 TYR N N 117.16 0.26 1 499 110 110 ALA H H 7.36 0.02 1 500 110 110 ALA C C 178.75 0.03 1 501 110 110 ALA CA C 56.00 0.02 1 502 110 110 ALA CB C 18.10 0.27 1 503 110 110 ALA N N 127.40 0.15 1 504 111 111 SER H H 8.00 0.02 1 505 111 111 SER C C 176.67 0.08 1 506 111 111 SER CA C 58.77 0.06 1 507 111 111 SER CB C 62.35 0.49 1 508 111 111 SER N N 106.95 0.08 1 509 112 112 TYR H H 8.29 0.02 1 510 112 112 TYR C C 178.13 0.02 1 511 112 112 TYR CA C 61.25 0.02 1 512 112 112 TYR CB C 38.31 0.10 1 513 112 112 TYR N N 130.61 0.15 1 514 113 113 LEU H H 7.14 0.03 1 515 113 113 LEU C C 179.54 0.10 1 516 113 113 LEU CA C 55.72 0.03 1 517 113 113 LEU CB C 40.76 0.02 1 518 113 113 LEU N N 114.63 0.22 1 519 114 114 GLN H H 7.36 0.02 1 520 114 114 GLN C C 179.36 0.04 1 521 114 114 GLN CA C 58.07 0.03 1 522 114 114 GLN CB C 27.68 0.19 1 523 114 114 GLN N N 118.33 0.10 1 524 115 115 TYR H H 7.15 0.02 1 525 115 115 TYR C C 176.66 0.03 1 526 115 115 TYR CA C 58.70 0.06 1 527 115 115 TYR CB C 36.00 0.10 1 528 115 115 TYR N N 120.22 0.20 1 529 116 116 GLY H H 6.82 0.02 1 530 116 116 GLY C C 170.30 0.04 1 531 116 116 GLY CA C 43.90 0.04 1 532 116 116 GLY N N 102.08 0.11 1 533 117 117 HIS H H 6.94 0.02 1 534 117 117 HIS C C 173.38 0.02 1 535 117 117 HIS CA C 55.41 0.02 1 536 117 117 HIS CB C 24.39 0.14 1 537 117 117 HIS N N 108.61 0.17 1 538 118 118 ILE H H 6.43 0.02 1 539 118 118 ILE C C 177.59 0.02 1 540 118 118 ILE CA C 62.23 0.07 1 541 118 118 ILE CB C 36.95 0.02 1 542 118 118 ILE N N 118.49 0.14 1 543 119 119 ALA H H 9.65 0.02 1 544 119 119 ALA C C 177.79 0.02 1 545 119 119 ALA CA C 54.79 0.02 1 546 119 119 ALA CB C 17.07 0.07 1 547 119 119 ALA N N 134.80 0.10 1 548 120 120 ASN H H 8.91 0.02 1 549 120 120 ASN C C 176.03 0.02 1 550 120 120 ASN CA C 54.96 0.19 1 551 120 120 ASN CB C 35.96 0.23 1 552 120 120 ASN N N 113.34 0.10 1 553 121 121 ILE H H 8.00 0.02 1 554 121 121 ILE C C 174.70 0.08 1 555 121 121 ILE CA C 61.30 0.04 1 556 121 121 ILE CB C 36.74 0.16 1 557 121 121 ILE N N 121.00 0.13 1 558 122 122 ASP H H 8.26 0.02 1 559 122 122 ASP C C 179.00 0.03 1 560 122 122 ASP CA C 57.51 0.13 1 561 122 122 ASP CB C 38.72 0.03 1 562 122 122 ASP N N 124.80 0.09 1 563 123 123 ASP H H 7.86 0.02 1 564 123 123 ASP C C 178.12 0.07 1 565 123 123 ASP CA C 56.04 0.09 1 566 123 123 ASP CB C 39.82 0.18 1 567 123 123 ASP N N 121.35 0.22 1 568 124 124 ILE H H 7.98 0.02 1 569 124 124 ILE C C 180.37 0.10 1 570 124 124 ILE CA C 63.62 0.03 1 571 124 124 ILE CB C 37.40 0.26 1 572 124 124 ILE N N 125.37 0.12 1 573 125 125 ILE H H 8.39 0.02 1 574 125 125 ILE C C 177.18 0.03 1 575 125 125 ILE CA C 64.59 0.07 1 576 125 125 ILE CB C 36.64 0.02 1 577 125 125 ILE N N 124.81 0.13 1 578 126 126 ALA H H 7.26 0.02 1 579 126 126 ALA C C 177.57 0.06 1 580 126 126 ALA CA C 51.62 0.07 1 581 126 126 ALA CB C 18.59 0.02 1 582 126 126 ALA N N 119.44 0.13 1 583 127 127 GLY H H 7.83 0.02 1 584 127 127 GLY C C 174.56 0.03 1 585 127 127 GLY CA C 44.96 0.04 1 586 127 127 GLY N N 109.01 0.08 1 587 128 128 LYS H H 8.35 0.02 1 588 128 128 LYS C C 176.27 0.02 1 589 128 128 LYS CA C 56.34 0.14 1 590 128 128 LYS CB C 32.72 0.03 1 591 128 128 LYS N N 120.66 0.11 1 592 129 129 LYS H H 6.94 0.02 1 593 129 129 LYS C C 172.41 0.02 1 594 129 129 LYS CA C 52.73 0.02 1 595 129 129 LYS CB C 35.31 0.02 1 596 129 129 LYS N N 119.33 0.12 1 597 130 130 PRO C C 177.48 0.02 1 598 130 130 PRO CA C 61.12 0.02 1 599 130 130 PRO CB C 31.50 0.02 1 600 131 131 ALA H H 8.85 0.02 1 601 131 131 ALA C C 177.96 0.04 1 602 131 131 ALA CA C 54.38 0.17 1 603 131 131 ALA CB C 16.89 0.07 1 604 131 131 ALA N N 124.89 0.13 1 605 132 132 THR H H 7.06 0.02 1 606 132 132 THR C C 175.62 0.02 1 607 132 132 THR CA C 62.41 0.03 1 608 132 132 THR CB C 67.30 0.07 1 609 132 132 THR N N 105.49 0.15 1 610 133 133 ASP H H 8.02 0.02 1 611 133 133 ASP C C 176.60 0.02 1 612 133 133 ASP CA C 54.15 0.03 1 613 133 133 ASP CB C 38.86 0.20 1 614 133 133 ASP N N 123.50 0.20 1 615 134 134 LEU H H 7.75 0.02 1 616 134 134 LEU C C 178.97 0.04 1 617 134 134 LEU CA C 55.69 0.02 1 618 134 134 LEU CB C 41.20 0.19 1 619 134 134 LEU N N 128.00 0.10 1 620 135 135 GLY H H 8.28 0.02 1 621 135 135 GLY C C 172.50 0.03 1 622 135 135 GLY CA C 49.09 0.04 1 623 135 135 GLY N N 116.26 0.15 1 624 136 136 VAL H H 8.89 0.02 1 625 136 136 VAL C C 174.67 0.02 1 626 136 136 VAL CA C 57.61 0.02 1 627 136 136 VAL CB C 33.96 0.10 1 628 136 136 VAL N N 117.72 0.10 1 629 137 137 LYS H H 8.45 0.03 1 630 137 137 LYS C C 173.35 0.02 1 631 137 137 LYS CA C 55.27 0.03 1 632 137 137 LYS CB C 36.54 0.02 1 633 137 137 LYS N N 122.62 0.18 1 634 138 138 ALA H H 8.93 0.02 1 635 138 138 ALA C C 176.39 0.02 1 636 138 138 ALA CA C 49.10 0.02 1 637 138 138 ALA CB C 17.38 0.02 1 638 138 138 ALA N N 129.32 0.10 1 639 139 139 LEU H H 8.06 0.02 1 640 139 139 LEU C C 177.62 0.02 1 641 139 139 LEU CA C 56.37 0.02 1 642 139 139 LEU CB C 39.93 0.08 1 643 139 139 LEU N N 127.78 0.20 1 644 140 140 ASP H H 8.08 0.02 1 645 140 140 ASP C C 176.00 0.06 1 646 140 140 ASP CA C 52.52 0.05 1 647 140 140 ASP CB C 39.48 0.03 1 648 140 140 ASP N N 114.29 0.18 1 649 141 141 ASP H H 8.70 0.02 1 650 141 141 ASP C C 177.61 0.02 1 651 141 141 ASP CA C 57.49 0.03 1 652 141 141 ASP CB C 39.54 0.25 1 653 141 141 ASP N N 116.73 0.09 1 654 142 142 HIS H H 8.64 0.04 1 655 142 142 HIS C C 173.59 0.02 1 656 142 142 HIS CA C 54.26 0.02 1 657 142 142 HIS CB C 29.01 0.06 1 658 142 142 HIS N N 115.91 0.13 1 659 143 143 THR H H 7.21 0.03 1 660 143 143 THR C C 171.74 0.02 1 661 143 143 THR CA C 62.36 0.04 1 662 143 143 THR CB C 68.53 0.09 1 663 143 143 THR N N 120.62 0.07 1 664 144 144 PHE H H 8.96 0.03 1 665 144 144 PHE C C 171.64 0.05 1 666 144 144 PHE CA C 54.32 0.04 1 667 144 144 PHE CB C 43.02 0.07 1 668 144 144 PHE N N 132.62 0.10 1 669 145 145 GLU H H 9.26 0.03 1 670 145 145 GLU C C 174.28 0.02 1 671 145 145 GLU CA C 54.16 0.06 1 672 145 145 GLU CB C 33.72 0.02 1 673 145 145 GLU N N 132.78 0.10 1 674 146 146 VAL H H 9.78 0.03 1 675 146 146 VAL C C 174.12 0.02 1 676 146 146 VAL CA C 60.20 0.04 1 677 146 146 VAL CB C 33.86 0.05 1 678 146 146 VAL N N 133.78 0.11 1 679 147 147 THR H H 9.31 0.03 1 680 147 147 THR C C 172.44 0.02 1 681 147 147 THR CA C 62.53 0.02 1 682 147 147 THR CB C 69.77 0.02 1 683 147 147 THR N N 127.46 0.10 1 684 148 148 LEU H H 9.42 0.04 1 685 148 148 LEU C C 177.55 0.02 1 686 148 148 LEU CA C 52.09 0.02 1 687 148 148 LEU CB C 41.52 0.18 1 688 148 148 LEU N N 128.37 0.10 1 689 149 149 SER H H 9.14 0.02 1 690 149 149 SER C C 173.68 0.04 1 691 149 149 SER CA C 58.26 0.02 1 692 149 149 SER CB C 63.59 0.11 1 693 149 149 SER N N 114.36 0.15 1 694 150 150 GLU H H 7.49 0.03 1 695 150 150 GLU C C 170.66 0.02 1 696 150 150 GLU CA C 52.44 0.02 1 697 150 150 GLU CB C 30.34 0.02 1 698 150 150 GLU N N 120.64 0.07 1 699 168 168 PRO C C 175.23 0.02 1 700 168 168 PRO CA C 60.39 0.02 1 701 168 168 PRO CB C 26.88 0.04 1 702 169 169 LYS H H 8.32 0.02 1 703 169 169 LYS C C 176.65 0.02 1 704 169 169 LYS CA C 59.08 0.02 1 705 169 169 LYS CB C 31.52 0.20 1 706 169 169 LYS N N 133.18 0.07 1 707 170 170 SER H H 8.41 0.02 1 708 170 170 SER C C 176.50 0.10 1 709 170 170 SER CA C 60.13 0.02 1 710 170 170 SER CB C 61.32 0.26 1 711 170 170 SER N N 112.54 0.16 1 712 171 171 ALA H H 6.77 0.02 1 713 171 171 ALA C C 178.70 0.06 1 714 171 171 ALA CA C 53.65 0.03 1 715 171 171 ALA CB C 17.30 0.42 1 716 171 171 ALA N N 125.54 0.26 1 717 172 172 VAL H H 7.62 0.02 1 718 172 172 VAL C C 180.36 0.02 1 719 172 172 VAL CA C 65.73 0.12 1 720 172 172 VAL CB C 29.94 0.22 1 721 172 172 VAL N N 122.53 0.29 1 722 173 173 GLU H H 8.42 0.02 1 723 173 173 GLU C C 177.96 0.05 1 724 173 173 GLU CA C 58.48 0.02 1 725 173 173 GLU CB C 28.08 0.07 1 726 173 173 GLU N N 120.01 0.19 1 727 174 174 LYS H H 7.05 0.02 1 728 174 174 LYS C C 178.10 0.02 1 729 174 174 LYS CA C 58.18 0.05 1 730 174 174 LYS CB C 32.08 0.08 1 731 174 174 LYS N N 119.61 0.10 1 732 175 175 PHE H H 8.22 0.02 1 733 175 175 PHE C C 177.53 0.02 1 734 175 175 PHE CA C 57.13 0.02 1 735 175 175 PHE CB C 39.54 0.02 1 736 175 175 PHE N N 115.38 0.12 1 737 176 176 GLY H H 8.41 0.02 1 738 176 176 GLY C C 175.62 0.02 1 739 176 176 GLY CA C 45.96 0.02 1 740 176 176 GLY N N 116.61 0.20 1 741 177 177 ASP H H 8.99 0.02 1 742 177 177 ASP C C 177.45 0.04 1 743 177 177 ASP CA C 55.85 0.04 1 744 177 177 ASP CB C 39.30 0.06 1 745 177 177 ASP N N 126.45 0.05 1 746 178 178 LYS H H 7.84 0.02 1 747 178 178 LYS C C 178.92 0.02 1 748 178 178 LYS CA C 55.07 0.04 1 749 178 178 LYS CB C 30.15 0.04 1 750 178 178 LYS N N 119.47 0.17 1 751 179 179 TRP H H 8.69 0.02 1 752 179 179 TRP C C 173.26 0.02 1 753 179 179 TRP CA C 60.23 0.03 1 754 179 179 TRP CB C 26.61 0.12 1 755 179 179 TRP N N 126.99 0.23 1 756 180 180 THR H H 6.17 0.02 1 757 180 180 THR C C 174.28 0.02 1 758 180 180 THR CA C 59.80 0.11 1 759 180 180 THR CB C 67.80 0.09 1 760 180 180 THR N N 104.01 0.13 1 761 181 181 GLN H H 6.98 0.02 1 762 181 181 GLN CA C 54.12 0.02 1 763 181 181 GLN CB C 25.88 0.02 1 764 181 181 GLN N N 120.20 0.08 1 765 182 182 PRO C C 176.90 0.02 1 766 182 182 PRO CA C 65.75 0.02 1 767 182 182 PRO CB C 30.68 0.05 1 768 183 183 ALA H H 8.19 0.02 1 769 183 183 ALA C C 176.97 0.02 1 770 183 183 ALA CA C 53.17 0.09 1 771 183 183 ALA CB C 17.77 0.02 1 772 183 183 ALA N N 117.59 0.10 1 773 184 184 ASN H H 7.49 0.02 1 774 184 184 ASN C C 174.89 0.02 1 775 184 184 ASN CA C 51.97 0.15 1 776 184 184 ASN CB C 39.10 0.29 1 777 184 184 ASN N N 115.20 0.22 1 778 185 185 ILE H H 7.40 0.03 1 779 185 185 ILE C C 173.86 0.03 1 780 185 185 ILE CA C 63.72 0.04 1 781 185 185 ILE CB C 37.37 0.44 1 782 185 185 ILE N N 123.37 0.06 1 783 186 186 VAL H H 6.42 0.04 1 784 186 186 VAL C C 173.93 0.03 1 785 186 186 VAL CA C 60.56 0.06 1 786 186 186 VAL CB C 35.01 0.02 1 787 186 186 VAL N N 126.23 0.16 1 788 187 187 THR H H 8.59 0.03 1 789 187 187 THR C C 175.03 0.02 1 790 187 187 THR CA C 60.14 0.02 1 791 187 187 THR CB C 68.87 0.29 1 792 187 187 THR N N 113.24 0.09 1 793 188 188 ASN H H 7.66 0.02 1 794 188 188 ASN C C 174.34 0.02 1 795 188 188 ASN CA C 52.48 0.09 1 796 188 188 ASN CB C 38.26 0.09 1 797 188 188 ASN N N 120.01 0.08 1 798 189 189 GLY H H 8.38 0.03 1 799 189 189 GLY C C 170.43 0.03 1 800 189 189 GLY CA C 42.03 0.06 1 801 189 189 GLY N N 113.36 0.10 1 802 190 190 ALA H H 7.97 0.03 1 803 190 190 ALA C C 176.56 0.02 1 804 190 190 ALA CA C 52.84 0.02 1 805 190 190 ALA CB C 19.72 0.02 1 806 190 190 ALA N N 120.71 0.11 1 807 191 191 TYR H H 8.00 0.03 1 808 191 191 TYR C C 172.65 0.02 1 809 191 191 TYR CA C 57.15 0.05 1 810 191 191 TYR CB C 41.34 0.03 1 811 191 191 TYR N N 116.99 0.11 1 812 192 192 LYS H H 9.42 0.03 1 813 192 192 LYS C C 175.05 0.02 1 814 192 192 LYS CA C 53.01 0.04 1 815 192 192 LYS CB C 34.94 0.02 1 816 196 196 TRP H H 8.92 0.02 1 817 196 196 TRP C C 173.59 0.02 1 818 196 196 TRP CA C 54.52 0.04 1 819 196 196 TRP CB C 30.67 0.14 1 820 196 196 TRP N N 127.98 0.09 1 821 197 197 VAL H H 9.22 0.02 1 822 197 197 VAL C C 175.98 0.10 1 823 197 197 VAL CA C 60.62 0.02 1 824 197 197 VAL CB C 30.94 0.06 1 825 197 197 VAL N N 130.90 0.16 1 826 198 198 VAL H H 8.55 0.02 1 827 198 198 VAL C C 176.35 0.02 1 828 198 198 VAL CA C 63.96 0.02 1 829 198 198 VAL CB C 30.16 0.02 1 830 198 198 VAL N N 134.09 0.20 1 831 199 199 ASN C C 173.93 0.02 1 832 199 199 ASN CA C 54.90 0.09 1 833 199 199 ASN CB C 40.94 0.02 1 834 200 200 GLU H H 8.35 0.02 1 835 200 200 GLU C C 174.24 0.02 1 836 200 200 GLU CA C 58.23 0.02 1 837 200 200 GLU CB C 31.79 0.08 1 838 200 200 GLU N N 120.54 0.21 1 839 201 201 ARG H H 8.50 0.02 1 840 201 201 ARG C C 172.79 0.02 1 841 201 201 ARG CA C 55.87 0.06 1 842 201 201 ARG CB C 30.09 0.02 1 843 201 201 ARG N N 113.41 0.13 1 844 202 202 ILE H H 8.42 0.02 1 845 202 202 ILE C C 173.73 0.06 1 846 202 202 ILE CA C 60.70 0.10 1 847 202 202 ILE CB C 40.13 0.02 1 848 202 202 ILE N N 124.01 0.05 1 849 203 203 VAL H H 9.13 0.02 1 850 203 203 VAL C C 174.67 0.02 1 851 203 203 VAL CA C 60.64 0.11 1 852 203 203 VAL CB C 32.55 0.15 1 853 203 203 VAL N N 129.21 0.17 1 854 204 204 LEU H H 9.72 0.02 1 855 204 204 LEU C C 175.38 0.02 1 856 204 204 LEU CA C 51.87 0.02 1 857 204 204 LEU CB C 40.90 0.19 1 858 204 204 LEU N N 129.80 0.08 1 859 205 205 GLU H H 8.99 0.02 1 860 205 205 GLU C C 174.64 0.02 1 861 205 205 GLU CA C 52.35 0.06 1 862 205 205 GLU CB C 33.29 0.06 1 863 205 205 GLU N N 120.02 0.15 1 864 206 206 ARG H H 8.06 0.02 1 865 206 206 ARG C C 173.83 0.04 1 866 206 206 ARG CA C 56.94 0.04 1 867 206 206 ARG CB C 30.99 0.04 1 868 206 206 ARG N N 125.63 0.08 1 869 207 207 ASN H H 8.53 0.02 1 870 207 207 ASN CA C 48.23 0.02 1 871 207 207 ASN CB C 37.34 0.02 1 872 207 207 ASN N N 125.21 0.06 1 873 208 208 PRO C C 176.54 0.02 1 874 208 208 PRO CA C 62.78 0.02 1 875 208 208 PRO CB C 30.81 0.04 1 876 209 209 GLN H H 6.78 0.02 1 877 209 209 GLN C C 175.54 0.04 1 878 209 209 GLN CA C 54.27 0.04 1 879 209 209 GLN CB C 27.89 0.02 1 880 209 209 GLN N N 114.94 0.09 1 881 210 210 TYR H H 7.32 0.02 1 882 210 210 TYR C C 179.91 0.02 1 883 210 210 TYR CA C 56.41 0.07 1 884 210 210 TYR CB C 37.47 0.25 1 885 210 210 TYR N N 123.19 0.10 1 886 211 211 TRP H H 7.90 0.02 1 887 211 211 TRP C C 175.89 0.03 1 888 211 211 TRP CA C 59.04 0.03 1 889 211 211 TRP CB C 26.61 0.02 1 890 211 211 TRP N N 133.59 0.07 1 891 212 212 ASP H H 3.56 0.02 1 892 212 212 ASP C C 178.02 0.02 1 893 212 212 ASP CA C 50.78 0.02 1 894 212 212 ASP CB C 38.93 0.02 1 895 212 212 ASP N N 121.44 0.02 1 896 213 213 ASN H H 7.39 0.02 1 897 213 213 ASN C C 176.21 0.02 1 898 213 213 ASN CA C 56.60 0.05 1 899 213 213 ASN CB C 38.89 0.21 1 900 213 213 ASN N N 121.54 0.16 1 901 214 214 ALA H H 8.76 0.02 1 902 214 214 ALA C C 178.94 0.02 1 903 214 214 ALA CA C 54.01 0.02 1 904 214 214 ALA CB C 16.76 0.04 1 905 214 214 ALA N N 121.68 0.11 1 906 215 215 LYS H H 7.36 0.02 1 907 215 215 LYS C C 177.02 0.02 1 908 215 215 LYS CA C 54.92 0.02 1 909 215 215 LYS CB C 30.68 0.10 1 910 215 215 LYS N N 116.03 0.13 1 911 216 216 THR H H 7.71 0.02 1 912 216 216 THR C C 173.81 0.09 1 913 216 216 THR CA C 63.52 0.06 1 914 216 216 THR CB C 67.95 0.02 1 915 216 216 THR N N 125.74 0.10 1 916 217 217 VAL H H 8.25 0.03 1 917 217 217 VAL CA C 63.33 0.22 1 918 217 217 VAL CB C 33.12 0.28 1 919 217 217 VAL N N 131.35 0.06 1 920 218 218 ILE H H 9.50 0.04 1 921 218 218 ILE C C 177.21 0.10 1 922 218 218 ILE CA C 61.22 0.10 1 923 218 218 ILE CB C 35.30 0.24 1 924 218 218 ILE N N 122.78 0.04 1 925 219 219 ASN H H 8.74 0.03 1 926 219 219 ASN C C 175.65 0.06 1 927 219 219 ASN CA C 54.93 0.02 1 928 219 219 ASN CB C 39.78 0.02 1 929 219 219 ASN N N 127.97 0.13 1 930 220 220 GLN H H 7.25 0.02 1 931 220 220 GLN C C 172.45 0.02 1 932 220 220 GLN CA C 54.64 0.06 1 933 220 220 GLN CB C 32.88 0.07 1 934 220 220 GLN N N 120.82 0.10 1 935 221 221 VAL H H 8.50 0.02 1 936 221 221 VAL C C 171.92 0.03 1 937 221 221 VAL CA C 56.92 0.05 1 938 221 221 VAL CB C 33.08 0.10 1 939 221 221 VAL N N 125.39 0.09 1 940 222 222 THR H H 8.47 0.02 1 941 222 222 THR C C 172.47 0.04 1 942 222 222 THR CA C 60.64 0.02 1 943 222 222 THR CB C 69.96 0.18 1 944 222 222 THR N N 126.63 0.12 1 945 223 223 TYR H H 9.56 0.02 1 946 223 223 TYR C C 176.62 0.04 1 947 223 223 TYR CA C 56.97 0.02 1 948 223 223 TYR CB C 39.63 0.07 1 949 223 223 TYR N N 127.56 0.12 1 950 224 224 LEU H H 8.48 0.02 1 951 224 224 LEU C C 174.83 0.02 1 952 224 224 LEU CA C 50.77 0.02 1 953 224 224 LEU CB C 41.39 0.02 1 954 224 224 LEU N N 127.27 0.17 1 955 225 225 PRO C C 174.89 0.02 1 956 225 225 PRO CA C 61.14 0.02 1 957 225 225 PRO CB C 26.93 0.02 1 958 226 226 ILE H H 7.78 0.02 1 959 226 226 ILE C C 176.54 0.07 1 960 226 226 ILE CA C 62.05 0.02 1 961 226 226 ILE CB C 36.37 0.12 1 962 226 226 ILE N N 123.02 0.10 1 963 227 227 SER H H 8.11 0.02 1 964 227 227 SER C C 174.75 0.02 1 965 227 227 SER CA C 58.11 0.09 1 966 227 227 SER CB C 63.13 0.26 1 967 227 227 SER N N 125.34 0.14 1 968 228 228 SER H H 7.21 0.02 1 969 228 228 SER CA C 55.56 0.02 1 970 228 228 SER CB C 62.52 0.02 1 971 228 228 SER N N 117.92 0.10 1 972 231 231 THR H H 7.32 0.02 1 973 231 231 THR C C 175.05 0.02 1 974 231 231 THR CA C 65.90 0.02 1 975 231 231 THR CB C 67.75 0.07 1 976 231 231 THR N N 120.66 0.02 1 977 232 232 ASP H H 7.88 0.02 1 978 232 232 ASP C C 176.27 0.08 1 979 232 232 ASP CA C 56.44 0.04 1 980 232 232 ASP CB C 40.99 0.06 1 981 232 232 ASP N N 124.19 0.06 1 982 233 233 VAL H H 7.70 0.02 1 983 233 233 VAL C C 178.09 0.05 1 984 233 233 VAL CA C 66.43 0.02 1 985 233 233 VAL CB C 30.33 0.17 1 986 233 233 VAL N N 116.83 0.04 1 987 234 234 ASN H H 8.57 0.02 1 988 234 234 ASN C C 178.99 0.02 1 989 234 234 ASN CA C 55.93 0.02 1 990 234 234 ASN CB C 36.80 0.17 1 991 234 234 ASN N N 121.92 0.14 1 992 235 235 ARG H H 8.70 0.02 1 993 235 235 ARG C C 178.61 0.04 1 994 235 235 ARG CA C 58.25 0.08 1 995 235 235 ARG CB C 28.14 0.28 1 996 235 235 ARG N N 123.18 0.07 1 997 236 236 TYR H H 8.57 0.03 1 998 236 236 TYR C C 180.73 0.02 1 999 236 236 TYR CA C 60.56 0.06 1 1000 236 236 TYR CB C 37.31 0.02 1 1001 236 236 TYR N N 126.29 0.15 1 1002 237 237 ARG H H 9.35 0.03 1 1003 237 237 ARG C C 178.22 0.02 1 1004 237 237 ARG CA C 59.02 0.02 1 1005 237 237 ARG CB C 28.13 0.07 1 1006 237 237 ARG N N 126.46 0.14 1 1007 238 238 SER H H 7.89 0.02 1 1008 238 238 SER C C 174.59 0.02 1 1009 238 238 SER CA C 58.80 0.05 1 1010 238 238 SER CB C 62.63 0.02 1 1011 238 238 SER N N 114.89 0.15 1 1012 239 239 GLY H H 7.62 0.02 1 1013 239 239 GLY C C 173.80 0.03 1 1014 239 239 GLY CA C 44.80 0.13 1 1015 239 239 GLY N N 110.58 0.07 1 1016 240 240 GLU H H 7.96 0.02 1 1017 240 240 GLU C C 175.16 0.02 1 1018 240 240 GLU CA C 56.85 0.06 1 1019 240 240 GLU CB C 29.90 0.14 1 1020 240 240 GLU N N 122.16 0.09 1 1021 241 241 ILE H H 6.76 0.02 1 1022 241 241 ILE C C 173.50 0.02 1 1023 241 241 ILE CA C 60.48 0.02 1 1024 241 241 ILE CB C 40.77 0.02 1 1025 241 241 ILE N N 118.73 0.17 1 1026 242 242 ASP C C 175.89 0.02 1 1027 242 242 ASP CA C 55.11 0.02 1 1028 243 243 MET H H 7.27 0.02 1 1029 243 243 MET C C 175.14 0.02 1 1030 243 243 MET CA C 53.78 0.03 1 1031 243 243 MET CB C 36.59 0.23 1 1032 243 243 MET N N 118.50 0.15 1 1033 244 244 THR H H 8.57 0.02 1 1034 244 244 THR C C 175.56 0.02 1 1035 244 244 THR CA C 61.01 0.02 1 1036 244 244 THR CB C 70.70 0.02 1 1037 244 244 THR N N 117.81 0.09 1 1038 245 245 TYR C C 175.14 0.03 1 1039 245 245 TYR CA C 57.36 0.02 1 1040 245 245 TYR CB C 37.82 0.02 1 1041 246 246 ASN H H 6.88 0.03 1 1042 246 246 ASN C C 173.76 0.02 1 1043 246 246 ASN CA C 51.89 0.02 1 1044 246 246 ASN CB C 35.21 0.12 1 1045 246 246 ASN N N 124.39 0.09 1 1046 249 249 PRO C C 177.80 0.06 1 1047 249 249 PRO CA C 61.70 0.02 1 1048 249 249 PRO CB C 31.47 0.02 1 1049 250 250 ILE H H 8.62 0.02 1 1050 250 250 ILE C C 176.64 0.03 1 1051 250 250 ILE CA C 64.19 0.02 1 1052 250 250 ILE CB C 36.88 0.15 1 1053 250 250 ILE N N 125.99 0.09 1 1054 251 251 GLU H H 9.18 0.02 1 1055 251 251 GLU C C 179.09 0.02 1 1056 251 251 GLU CA C 59.03 0.07 1 1057 251 251 GLU CB C 27.27 0.05 1 1058 251 251 GLU N N 121.60 0.09 1 1059 252 252 LEU H H 6.92 0.02 1 1060 252 252 LEU C C 177.06 0.02 1 1061 252 252 LEU CA C 55.75 0.02 1 1062 252 252 LEU CB C 41.25 0.02 1 1063 252 252 LEU N N 120.70 0.22 1 1064 253 253 PHE H H 8.08 0.02 1 1065 253 253 PHE C C 176.01 0.02 1 1066 253 253 PHE CA C 61.34 0.09 1 1067 253 253 PHE CB C 38.39 0.02 1 1068 253 253 PHE N N 122.44 0.12 1 1069 254 254 GLN H H 8.27 0.02 1 1070 254 254 GLN C C 178.63 0.02 1 1071 254 254 GLN CA C 57.79 0.02 1 1072 254 254 GLN CB C 26.65 0.06 1 1073 254 254 GLN N N 116.57 0.10 1 1074 255 255 LYS H H 7.16 0.02 1 1075 255 255 LYS C C 178.76 0.03 1 1076 255 255 LYS CA C 58.38 0.02 1 1077 255 255 LYS CB C 31.77 0.02 1 1078 255 255 LYS N N 120.95 0.10 1 1079 256 256 LEU H H 8.32 0.02 1 1080 256 256 LEU C C 178.38 0.03 1 1081 256 256 LEU CA C 56.92 0.05 1 1082 256 256 LEU CB C 39.51 0.22 1 1083 256 256 LEU N N 122.05 0.21 1 1084 257 257 LYS H H 7.94 0.02 1 1085 257 257 LYS C C 177.03 0.03 1 1086 257 257 LYS CA C 58.00 0.03 1 1087 257 257 LYS CB C 29.99 0.02 1 1088 257 257 LYS N N 119.67 0.10 1 1089 258 258 LYS H H 6.72 0.02 1 1090 258 258 LYS C C 177.51 0.07 1 1091 258 258 LYS CA C 56.86 0.02 1 1092 258 258 LYS CB C 31.69 0.10 1 1093 258 258 LYS N N 116.85 0.14 1 1094 259 259 GLU H H 7.55 0.02 1 1095 259 259 GLU C C 176.97 0.02 1 1096 259 259 GLU CA C 58.42 0.02 1 1097 259 259 GLU CB C 31.24 0.08 1 1098 259 259 GLU N N 120.72 0.04 1 1099 260 260 ILE H H 8.47 0.02 1 1100 260 260 ILE C C 173.78 0.02 1 1101 260 260 ILE CA C 58.27 0.02 1 1102 260 260 ILE CB C 37.76 0.02 1 1103 260 260 ILE N N 115.47 0.18 1 1104 261 261 PRO C C 179.21 0.05 1 1105 261 261 PRO CA C 64.79 0.06 1 1106 261 261 PRO CB C 29.86 0.02 1 1107 262 262 ASN H H 8.63 0.02 1 1108 262 262 ASN C C 176.16 0.02 1 1109 262 262 ASN CA C 54.15 0.07 1 1110 262 262 ASN CB C 37.00 0.16 1 1111 262 262 ASN N N 114.69 0.14 1 1112 263 263 GLU H H 7.83 0.02 1 1113 263 263 GLU C C 174.31 0.02 1 1114 263 263 GLU CA C 55.83 0.03 1 1115 263 263 GLU CB C 29.38 0.11 1 1116 263 263 GLU N N 120.54 0.24 1 1117 264 264 VAL H H 6.66 0.02 1 1118 264 264 VAL C C 174.62 0.02 1 1119 264 264 VAL CA C 61.51 0.02 1 1120 264 264 VAL CB C 29.56 0.08 1 1121 264 264 VAL N N 120.72 0.11 1 1122 265 265 ARG H H 9.00 0.02 1 1123 265 265 ARG C C 174.27 0.02 1 1124 265 265 ARG CA C 51.97 0.03 1 1125 265 265 ARG CB C 26.92 0.10 1 1126 265 265 ARG N N 131.37 0.07 1 1127 266 266 VAL H H 8.09 0.02 1 1128 266 266 VAL C C 174.91 0.02 1 1129 266 266 VAL CA C 60.68 0.04 1 1130 266 266 VAL CB C 30.84 0.02 1 1131 266 266 VAL N N 126.91 0.15 1 1132 267 267 ASP H H 8.38 0.02 1 1133 267 267 ASP C C 173.32 0.02 1 1134 267 267 ASP CA C 50.80 0.02 1 1135 267 267 ASP CB C 42.41 0.02 1 1136 267 267 ASP N N 129.21 0.07 1 1137 268 268 PRO C C 174.71 0.03 1 1138 268 268 PRO CA C 63.13 0.02 1 1139 268 268 PRO CB C 29.86 0.06 1 1140 269 269 TYR H H 9.15 0.02 1 1141 269 269 TYR C C 177.69 0.02 1 1142 269 269 TYR CA C 54.79 0.03 1 1143 269 269 TYR CB C 42.72 0.15 1 1144 269 269 TYR N N 126.06 0.12 1 1145 270 270 LEU H H 7.25 0.02 1 1146 270 270 LEU C C 174.55 0.02 1 1147 270 270 LEU CA C 53.60 0.11 1 1148 270 270 LEU CB C 39.04 0.02 1 1149 270 270 LEU N N 133.08 0.18 1 1150 271 271 CYS H H 8.93 0.02 1 1151 271 271 CYS C C 172.43 0.07 1 1152 271 271 CYS CA C 55.94 0.08 1 1153 271 271 CYS CB C 48.47 0.02 1 1154 271 271 CYS N N 123.02 0.14 1 1155 272 272 THR H H 8.65 0.02 1 1156 272 272 THR C C 173.19 0.02 1 1157 272 272 THR CA C 61.18 0.04 1 1158 272 272 THR CB C 71.22 0.02 1 1159 272 272 THR N N 120.48 0.21 1 1160 273 273 TYR H H 10.02 0.02 1 1161 273 273 TYR CA C 57.10 0.02 1 1162 273 273 TYR CB C 37.91 0.02 1 1163 273 273 TYR N N 131.58 0.12 1 1164 274 274 TYR C C 170.61 0.02 1 1165 274 274 TYR CA C 54.67 0.05 1 1166 274 274 TYR CB C 40.81 0.05 1 1167 275 275 TYR H H 8.48 0.02 1 1168 275 275 TYR C C 174.60 0.04 1 1169 275 275 TYR CA C 57.60 0.04 1 1170 275 275 TYR CB C 38.31 0.25 1 1171 275 275 TYR N N 117.43 0.18 1 1172 276 276 GLU H H 9.65 0.02 1 1173 276 276 GLU C C 173.50 0.05 1 1174 276 276 GLU CA C 54.05 0.06 1 1175 276 276 GLU CB C 32.03 0.33 1 1176 276 276 GLU N N 129.19 0.18 1 1177 277 277 ILE H H 6.95 0.02 1 1178 277 277 ILE C C 174.66 0.08 1 1179 277 277 ILE CA C 59.19 0.06 1 1180 277 277 ILE CB C 38.39 0.10 1 1181 277 277 ILE N N 128.00 0.16 1 1182 278 278 ASN H H 7.95 0.02 1 1183 278 278 ASN C C 175.04 0.02 1 1184 278 278 ASN CA C 51.51 0.06 1 1185 278 278 ASN CB C 34.55 0.20 1 1186 278 278 ASN N N 125.02 0.16 1 1187 279 279 ASN H H 8.63 0.02 1 1188 279 279 ASN C C 174.78 0.03 1 1189 279 279 ASN CA C 55.56 0.09 1 1190 279 279 ASN CB C 38.78 0.06 1 1191 279 279 ASN N N 123.96 0.02 1 1192 280 280 GLN H H 7.35 0.02 1 1193 280 280 GLN C C 174.54 0.02 1 1194 280 280 GLN CA C 53.61 0.02 1 1195 280 280 GLN CB C 28.28 0.02 1 1196 280 280 GLN N N 114.33 0.13 1 1197 281 281 LYS H H 6.80 0.02 1 1198 281 281 LYS C C 174.45 0.06 1 1199 281 281 LYS CA C 53.62 0.04 1 1200 281 281 LYS CB C 34.24 0.23 1 1201 281 281 LYS N N 125.75 0.08 1 1202 282 282 ALA H H 8.66 0.02 1 1203 282 282 ALA C C 176.12 0.02 1 1204 282 282 ALA CA C 51.22 0.02 1 1205 282 282 ALA CB C 16.18 0.02 1 1206 282 282 ALA N N 132.24 0.05 1 1207 283 283 PRO C C 174.27 0.02 1 1208 283 283 PRO CA C 63.74 0.02 1 1209 283 283 PRO CB C 32.01 0.02 1 1210 284 284 PHE H H 8.64 0.02 1 1211 284 284 PHE C C 173.23 0.02 1 1212 284 284 PHE CA C 59.59 0.02 1 1213 284 284 PHE CB C 36.16 0.04 1 1214 284 284 PHE N N 127.15 0.06 1 1215 285 285 ASN H H 7.77 0.02 1 1216 285 285 ASN C C 173.46 0.10 1 1217 285 285 ASN CA C 52.52 0.04 1 1218 285 285 ASN CB C 35.38 0.20 1 1219 285 285 ASN N N 116.59 0.02 1 1220 286 286 ASP H H 7.50 0.02 1 1221 286 286 ASP C C 176.84 0.05 1 1222 286 286 ASP CA C 51.83 0.06 1 1223 286 286 ASP CB C 41.34 0.30 1 1224 286 286 ASP N N 124.94 0.16 1 1225 287 287 VAL H H 8.97 0.02 1 1226 287 287 VAL C C 176.75 0.06 1 1227 287 287 VAL CA C 64.27 0.02 1 1228 287 287 VAL CB C 30.67 0.04 1 1229 287 287 VAL N N 131.40 0.02 1 1230 288 288 ARG H H 8.92 0.02 1 1231 288 288 ARG C C 178.02 0.02 1 1232 288 288 ARG CA C 59.25 0.10 1 1233 288 288 ARG CB C 28.86 0.29 1 1234 288 288 ARG N N 126.80 0.10 1 1235 289 289 VAL H H 6.76 0.02 1 1236 289 289 VAL C C 177.25 0.03 1 1237 289 289 VAL CA C 64.85 0.11 1 1238 289 289 VAL CB C 30.64 0.08 1 1239 289 289 VAL N N 119.49 0.12 1 1240 290 290 ARG H H 7.02 0.02 1 1241 290 290 ARG C C 178.07 0.04 1 1242 290 290 ARG CA C 60.42 0.02 1 1243 290 290 ARG CB C 29.19 0.02 1 1244 290 290 ARG N N 116.73 0.21 1 1245 291 291 THR H H 8.44 0.02 1 1246 291 291 THR C C 175.22 0.02 1 1247 291 291 THR CA C 65.36 0.12 1 1248 291 291 THR CB C 68.16 0.25 1 1249 291 291 THR N N 115.59 0.04 1 1250 292 292 ALA H H 7.75 0.02 1 1251 292 292 ALA C C 178.69 0.04 1 1252 292 292 ALA CA C 55.17 0.13 1 1253 292 292 ALA CB C 17.65 0.16 1 1254 292 292 ALA N N 125.92 0.15 1 1255 293 293 LEU H H 7.16 0.02 1 1256 293 293 LEU C C 179.01 0.04 1 1257 293 293 LEU CA C 57.10 0.02 1 1258 293 293 LEU CB C 39.67 0.11 1 1259 293 293 LEU N N 117.12 0.12 1 1260 294 294 LYS H H 7.65 0.02 1 1261 294 294 LYS C C 178.11 0.06 1 1262 294 294 LYS CA C 59.39 0.03 1 1263 294 294 LYS CB C 30.62 0.15 1 1264 294 294 LYS N N 120.04 0.14 1 1265 295 295 LEU H H 8.17 0.02 1 1266 295 295 LEU C C 176.95 0.02 1 1267 295 295 LEU CA C 56.83 0.02 1 1268 295 295 LEU CB C 41.84 0.09 1 1269 295 295 LEU N N 119.83 0.25 1 1270 296 296 ALA H H 7.85 0.02 1 1271 296 296 ALA C C 176.67 0.02 1 1272 296 296 ALA CA C 52.17 0.03 1 1273 296 296 ALA CB C 19.77 0.02 1 1274 296 296 ALA N N 116.77 0.13 1 1275 297 297 LEU H H 6.85 0.02 1 1276 297 297 LEU C C 173.45 0.09 1 1277 297 297 LEU CA C 55.17 0.02 1 1278 297 297 LEU CB C 40.30 0.08 1 1279 297 297 LEU N N 118.93 0.16 1 1280 298 298 ASP H H 5.59 0.02 1 1281 298 298 ASP C C 175.46 0.02 1 1282 298 298 ASP CA C 51.79 0.02 1 1283 298 298 ASP CB C 40.20 0.07 1 1284 298 298 ASP N N 126.14 0.11 1 1285 299 299 ARG H H 8.94 0.02 1 1286 299 299 ARG C C 177.31 0.03 1 1287 299 299 ARG CA C 58.80 0.12 1 1288 299 299 ARG CB C 28.49 0.73 1 1289 299 299 ARG N N 126.67 0.18 1 1290 300 300 ASP H H 8.10 0.02 1 1291 300 300 ASP C C 178.56 0.06 1 1292 300 300 ASP CA C 57.26 0.13 1 1293 300 300 ASP CB C 40.39 0.07 1 1294 300 300 ASP N N 121.07 0.19 1 1295 301 301 ILE H H 7.32 0.02 1 1296 301 301 ILE C C 178.82 0.09 1 1297 301 301 ILE CA C 64.16 0.04 1 1298 301 301 ILE CB C 36.69 0.07 1 1299 301 301 ILE N N 120.88 0.15 1 1300 302 302 ILE H H 7.15 0.02 1 1301 302 302 ILE C C 176.70 0.02 1 1302 302 302 ILE CA C 62.13 0.07 1 1303 302 302 ILE CB C 34.43 0.06 1 1304 302 302 ILE N N 119.16 0.09 1 1305 303 303 VAL H H 8.34 0.02 1 1306 303 303 VAL C C 177.77 0.03 1 1307 303 303 VAL CA C 64.97 0.08 1 1308 303 303 VAL CB C 30.43 0.16 1 1309 303 303 VAL N N 113.74 0.22 1 1310 304 304 ASN H H 8.08 0.02 1 1311 304 304 ASN C C 174.98 0.05 1 1312 304 304 ASN CA C 54.12 0.09 1 1313 304 304 ASN CB C 38.71 0.49 1 1314 304 304 ASN N N 118.02 0.14 1 1315 305 305 LYS H H 7.53 0.02 1 1316 305 305 LYS C C 176.92 0.02 1 1317 305 305 LYS CA C 56.38 0.02 1 1318 305 305 LYS CB C 31.87 0.30 1 1319 305 305 LYS N N 119.09 0.21 1 1320 306 306 VAL H H 7.73 0.02 1 1321 306 306 VAL C C 176.02 0.02 1 1322 306 306 VAL CA C 64.58 0.06 1 1323 306 306 VAL CB C 30.23 0.02 1 1324 306 306 VAL N N 122.02 0.18 1 1325 307 307 LYS H H 7.78 0.02 1 1326 307 307 LYS C C 174.79 0.03 1 1327 307 307 LYS CA C 56.57 0.02 1 1328 307 307 LYS CB C 32.44 0.11 1 1329 307 307 LYS N N 120.81 0.13 1 1330 308 308 ASN H H 7.22 0.02 1 1331 308 308 ASN C C 173.53 0.02 1 1332 308 308 ASN CA C 52.56 0.13 1 1333 308 308 ASN CB C 36.54 0.13 1 1334 308 308 ASN N N 116.17 0.09 1 1335 309 309 GLN H H 8.78 0.06 1 1336 309 309 GLN C C 174.33 0.11 1 1337 309 309 GLN CA C 53.58 0.04 1 1338 309 309 GLN CB C 30.53 0.33 1 1339 309 309 GLN N N 120.08 0.12 1 1340 310 310 GLY H H 8.22 0.02 1 1341 310 310 GLY C C 173.91 0.05 1 1342 310 310 GLY CA C 44.75 0.09 1 1343 310 310 GLY N N 109.39 0.13 1 1344 311 311 ASP H H 7.77 0.02 1 1345 311 311 ASP C C 174.16 0.02 1 1346 311 311 ASP CA C 54.51 0.03 1 1347 311 311 ASP CB C 41.40 0.23 1 1348 311 311 ASP N N 118.38 0.12 1 1349 312 312 LEU H H 7.73 0.02 1 1350 312 312 LEU C C 174.41 0.02 1 1351 312 312 LEU CA C 51.51 0.02 1 1352 312 312 LEU CB C 42.83 0.02 1 1353 312 312 LEU N N 121.35 0.13 1 1354 313 313 PRO C C 174.16 0.02 1 1355 313 313 PRO CA C 63.05 0.02 1 1356 313 313 PRO CB C 31.69 0.13 1 1357 314 314 ALA H H 7.47 0.02 1 1358 314 314 ALA C C 174.78 0.02 1 1359 314 314 ALA CA C 51.33 0.05 1 1360 314 314 ALA CB C 20.24 0.09 1 1361 314 314 ALA N N 124.76 0.12 1 1362 315 315 TYR H H 6.61 0.02 1 1363 315 315 TYR CA C 53.36 0.02 1 1364 315 315 TYR N N 113.85 0.15 1 1365 321 321 TYR C C 174.68 0.02 1 1366 321 321 TYR CA C 53.35 0.02 1 1367 321 321 TYR CB C 34.76 0.02 1 1368 322 322 THR H H 6.67 0.02 1 1369 322 322 THR C C 174.43 0.09 1 1370 322 322 THR CA C 63.78 0.04 1 1371 322 322 THR CB C 67.20 0.11 1 1372 322 322 THR N N 123.45 0.15 1 1373 323 323 ASP H H 9.23 0.02 1 1374 323 323 ASP C C 176.20 0.04 1 1375 323 323 ASP CA C 56.06 0.04 1 1376 323 323 ASP CB C 40.00 0.11 1 1377 323 323 ASP N N 134.15 0.21 1 1378 324 324 GLY H H 8.46 0.02 1 1379 324 324 GLY C C 174.75 0.06 1 1380 324 324 GLY CA C 44.18 0.10 1 1381 324 324 GLY N N 115.39 0.06 1 1382 325 325 ALA H H 7.96 0.02 1 1383 325 325 ALA C C 175.31 0.03 1 1384 325 325 ALA CA C 50.78 0.06 1 1385 325 325 ALA CB C 18.58 0.08 1 1386 325 325 ALA N N 125.39 0.22 1 1387 326 326 LYS H H 8.43 0.02 1 1388 326 326 LYS C C 174.67 0.02 1 1389 326 326 LYS CA C 54.18 0.03 1 1390 326 326 LYS CB C 31.21 0.04 1 1391 326 326 LYS N N 129.00 0.11 1 1392 327 327 LEU H H 8.71 0.02 1 1393 327 327 LEU C C 177.55 0.02 1 1394 327 327 LEU CA C 53.45 0.02 1 1395 327 327 LEU CB C 40.73 0.03 1 1396 327 327 LEU N N 122.87 0.11 1 1397 328 328 VAL H H 8.41 0.02 1 1398 328 328 VAL C C 175.84 0.03 1 1399 328 328 VAL CA C 60.16 0.06 1 1400 328 328 VAL CB C 32.07 0.09 1 1401 328 328 VAL N N 124.01 0.05 1 1402 329 329 GLU H H 8.53 0.02 1 1403 329 329 GLU C C 173.53 0.02 1 1404 329 329 GLU CA C 53.39 0.02 1 1405 329 329 GLU CB C 27.97 0.02 1 1406 329 329 GLU N N 131.66 0.07 1 1407 330 330 PRO C C 177.15 0.02 1 1408 330 330 PRO CA C 61.08 0.02 1 1409 330 330 PRO CB C 32.12 0.02 1 1410 331 331 GLU H H 8.42 0.02 1 1411 331 331 GLU C C 177.82 0.02 1 1412 331 331 GLU CA C 58.74 0.05 1 1413 331 331 GLU CB C 27.69 0.10 1 1414 331 331 GLU N N 123.23 0.13 1 1415 332 332 TRP H H 6.90 0.02 1 1416 332 332 TRP C C 177.47 0.02 1 1417 332 332 TRP CA C 55.96 0.09 1 1418 332 332 TRP CB C 27.25 0.52 1 1419 332 332 TRP N N 113.78 0.12 1 1420 333 333 PHE H H 6.27 0.02 1 1421 333 333 PHE C C 174.69 0.04 1 1422 333 333 PHE CA C 59.34 0.03 1 1423 333 333 PHE CB C 38.52 0.02 1 1424 333 333 PHE N N 124.86 0.14 1 1425 334 334 LYS H H 7.09 0.02 1 1426 334 334 LYS C C 177.77 0.02 1 1427 334 334 LYS CA C 55.62 0.02 1 1428 334 334 LYS CB C 31.20 0.09 1 1429 334 334 LYS N N 118.81 0.11 1 1430 335 335 TRP H H 6.56 0.02 1 1431 335 335 TRP C C 175.69 0.03 1 1432 335 335 TRP CA C 53.70 0.04 1 1433 335 335 TRP CB C 30.84 0.23 1 1434 335 335 TRP N N 120.58 0.12 1 1435 336 336 SER H H 8.38 0.02 1 1436 336 336 SER C C 175.64 0.04 1 1437 336 336 SER CA C 56.91 0.02 1 1438 336 336 SER CB C 63.96 0.12 1 1439 336 336 SER N N 117.26 0.13 1 1440 337 337 GLN H H 9.23 0.02 1 1441 337 337 GLN C C 177.51 0.04 1 1442 337 337 GLN CA C 57.46 0.10 1 1443 337 337 GLN CB C 26.03 0.03 1 1444 337 337 GLN N N 125.20 0.10 1 1445 338 338 GLN H H 8.40 0.02 1 1446 338 338 GLN C C 177.90 0.04 1 1447 338 338 GLN CA C 59.04 0.05 1 1448 338 338 GLN CB C 26.76 0.25 1 1449 338 338 GLN N N 120.42 0.21 1 1450 339 339 LYS H H 7.77 0.02 1 1451 339 339 LYS C C 179.05 0.05 1 1452 339 339 LYS CA C 58.60 0.02 1 1453 339 339 LYS CB C 30.83 0.06 1 1454 339 339 LYS N N 123.71 0.14 1 1455 340 340 ARG H H 8.13 0.02 1 1456 340 340 ARG C C 178.12 0.07 1 1457 340 340 ARG CA C 61.68 0.02 1 1458 340 340 ARG CB C 29.97 0.16 1 1459 340 340 ARG N N 120.91 0.10 1 1460 341 341 ASN H H 8.88 0.02 1 1461 341 341 ASN C C 177.73 0.10 1 1462 341 341 ASN CA C 55.29 0.04 1 1463 341 341 ASN CB C 36.35 0.02 1 1464 341 341 ASN N N 119.99 0.11 1 1465 342 342 GLU H H 8.11 0.02 1 1466 342 342 GLU C C 179.97 0.03 1 1467 342 342 GLU CA C 58.78 0.02 1 1468 342 342 GLU CB C 28.50 0.09 1 1469 342 342 GLU N N 123.10 0.19 1 1470 343 343 GLU H H 8.34 0.02 1 1471 343 343 GLU C C 178.58 0.02 1 1472 343 343 GLU CA C 57.82 0.07 1 1473 343 343 GLU CB C 27.72 0.10 1 1474 343 343 GLU N N 122.62 0.12 1 1475 344 344 ALA H H 8.83 0.02 1 1476 344 344 ALA C C 178.67 0.02 1 1477 344 344 ALA CA C 54.85 0.11 1 1478 344 344 ALA CB C 19.79 0.18 1 1479 344 344 ALA N N 124.55 0.08 1 1480 345 345 LYS H H 8.37 0.02 1 1481 345 345 LYS C C 179.74 0.06 1 1482 345 345 LYS CA C 59.78 0.13 1 1483 345 345 LYS CB C 31.45 0.05 1 1484 345 345 LYS N N 119.17 0.10 1 1485 346 346 LYS H H 7.54 0.02 1 1486 346 346 LYS C C 179.02 0.02 1 1487 346 346 LYS CA C 59.08 0.02 1 1488 346 346 LYS CB C 31.23 0.02 1 1489 346 346 LYS N N 123.21 0.08 1 1490 347 347 LEU H H 7.96 0.02 1 1491 347 347 LEU C C 178.85 0.03 1 1492 347 347 LEU CA C 57.25 0.09 1 1493 347 347 LEU CB C 41.19 0.21 1 1494 347 347 LEU N N 123.39 0.05 1 1495 348 348 LEU H H 8.01 0.02 1 1496 348 348 LEU C C 178.99 0.02 1 1497 348 348 LEU CA C 57.08 0.14 1 1498 348 348 LEU CB C 40.22 0.17 1 1499 348 348 LEU N N 119.10 0.15 1 1500 349 349 ALA H H 7.86 0.02 1 1501 349 349 ALA C C 177.36 0.02 1 1502 349 349 ALA CA C 54.15 0.02 1 1503 349 349 ALA CB C 16.61 0.17 1 1504 349 349 ALA N N 122.69 0.17 1 1505 350 350 GLU H H 8.24 0.02 1 1506 350 350 GLU C C 177.92 0.02 1 1507 350 350 GLU CA C 58.54 0.12 1 1508 350 350 GLU CB C 28.17 0.04 1 1509 350 350 GLU N N 124.02 0.11 1 1510 351 351 ALA H H 7.50 0.02 1 1511 351 351 ALA C C 176.09 0.07 1 1512 351 351 ALA CA C 51.68 0.02 1 1513 351 351 ALA CB C 17.98 0.02 1 1514 351 351 ALA N N 120.99 0.04 1 1515 352 352 GLY H H 7.50 0.02 1 1516 352 352 GLY C C 173.70 0.05 1 1517 352 352 GLY CA C 44.11 0.03 1 1518 352 352 GLY N N 106.77 0.14 1 1519 353 353 PHE H H 7.94 0.02 1 1520 353 353 PHE C C 175.40 0.02 1 1521 353 353 PHE CA C 57.61 0.02 1 1522 353 353 PHE CB C 38.39 0.11 1 1523 353 353 PHE N N 123.85 0.19 1 1524 354 354 THR H H 7.69 0.02 1 1525 354 354 THR C C 175.04 0.02 1 1526 354 354 THR CA C 59.23 0.02 1 1527 354 354 THR CB C 71.79 0.04 1 1528 354 354 THR N N 115.74 0.11 1 1529 355 355 ALA H H 8.60 0.02 1 1530 355 355 ALA C C 178.80 0.03 1 1531 355 355 ALA CA C 54.36 0.02 1 1532 355 355 ALA CB C 17.08 0.10 1 1533 355 355 ALA N N 123.37 0.09 1 1534 356 356 ASP H H 7.86 0.02 1 1535 356 356 ASP C C 175.47 0.02 1 1536 356 356 ASP CA C 54.20 0.02 1 1537 356 356 ASP CB C 40.41 0.17 1 1538 356 356 ASP N N 114.73 0.14 1 1539 357 357 LYS H H 7.27 0.02 1 1540 357 357 LYS C C 171.93 0.02 1 1541 357 357 LYS CA C 54.28 0.02 1 1542 357 357 LYS CB C 31.27 0.02 1 1543 357 357 LYS N N 124.32 0.14 1 1544 358 358 PRO C C 178.34 0.02 1 1545 358 358 PRO CA C 62.31 0.02 1 1546 358 358 PRO CB C 31.81 0.09 1 1547 359 359 LEU H H 8.29 0.02 1 1548 359 359 LEU C C 174.36 0.02 1 1549 359 359 LEU CA C 54.86 0.04 1 1550 359 359 LEU CB C 39.64 0.11 1 1551 359 359 LEU N N 126.53 0.17 1 1552 360 360 THR H H 8.21 0.02 1 1553 360 360 THR C C 173.12 0.02 1 1554 360 360 THR CA C 60.10 0.03 1 1555 360 360 THR CB C 70.57 0.04 1 1556 360 360 THR N N 126.96 0.09 1 1557 361 361 PHE H H 8.23 0.03 1 1558 361 361 PHE C C 171.52 0.02 1 1559 361 361 PHE CA C 55.68 0.04 1 1560 361 361 PHE CB C 40.40 0.04 1 1561 361 361 PHE N N 123.17 0.21 1 1562 362 362 ASP H H 9.60 0.03 1 1563 362 362 ASP C C 174.81 0.06 1 1564 362 362 ASP CA C 52.47 0.02 1 1565 362 362 ASP CB C 41.95 0.07 1 1566 362 362 ASP N N 122.49 0.15 1 1567 363 363 LEU H H 9.12 0.02 1 1568 363 363 LEU C C 173.49 0.10 1 1569 363 363 LEU CA C 53.25 0.17 1 1570 363 363 LEU CB C 43.89 0.02 1 1571 363 363 LEU N N 129.36 0.06 1 1572 364 364 LEU H H 9.03 0.02 1 1573 364 364 LEU C C 175.27 0.06 1 1574 364 364 LEU CA C 53.13 0.02 1 1575 364 364 LEU CB C 43.50 0.12 1 1576 364 364 LEU N N 131.61 0.04 1 1577 365 365 TYR H H 8.83 0.02 1 1578 365 365 TYR C C 170.64 0.02 1 1579 365 365 TYR CA C 55.56 0.06 1 1580 365 365 TYR CB C 40.59 0.23 1 1581 365 365 TYR N N 124.45 0.04 1 1582 366 366 ASN H H 7.16 0.02 1 1583 366 366 ASN C C 174.02 0.06 1 1584 366 366 ASN CA C 50.18 0.10 1 1585 366 366 ASN CB C 36.28 0.17 1 1586 366 366 ASN N N 117.17 0.15 1 1587 367 367 THR H H 7.67 0.02 1 1588 367 367 THR C C 174.92 0.02 1 1589 367 367 THR CA C 64.27 0.02 1 1590 367 367 THR CB C 69.07 0.32 1 1591 367 367 THR N N 118.88 0.18 1 1592 368 368 SER H H 7.63 0.02 1 1593 368 368 SER C C 174.27 0.02 1 1594 368 368 SER CA C 57.51 0.02 1 1595 368 368 SER CB C 62.95 0.02 1 1596 368 368 SER N N 125.91 0.17 1 1597 372 372 LYS C C 176.12 0.02 1 1598 372 372 LYS CA C 59.23 0.02 1 1599 372 372 LYS CB C 31.76 0.02 1 1600 373 373 LYS H H 7.38 0.02 1 1601 373 373 LYS C C 180.05 0.02 1 1602 373 373 LYS CA C 59.07 0.06 1 1603 373 373 LYS CB C 31.04 0.07 1 1604 373 373 LYS N N 120.86 0.15 1 1605 374 374 LEU H H 7.79 0.02 1 1606 374 374 LEU C C 176.45 0.03 1 1607 374 374 LEU CA C 57.72 0.34 1 1608 374 374 LEU CB C 39.62 0.02 1 1609 374 374 LEU N N 120.06 0.19 1 1610 375 375 ALA H H 7.80 0.03 1 1611 375 375 ALA C C 178.96 0.04 1 1612 375 375 ALA CA C 54.65 0.08 1 1613 375 375 ALA CB C 16.93 0.02 1 1614 375 375 ALA N N 123.60 0.06 1 1615 376 376 ILE H H 8.39 0.02 1 1616 376 376 ILE C C 179.18 0.02 1 1617 376 376 ILE CA C 64.60 0.10 1 1618 376 376 ILE CB C 37.18 0.23 1 1619 376 376 ILE N N 119.82 0.08 1 1620 377 377 ALA H H 7.25 0.02 1 1621 377 377 ALA C C 179.91 0.03 1 1622 377 377 ALA CA C 54.33 0.05 1 1623 377 377 ALA CB C 18.03 0.05 1 1624 377 377 ALA N N 124.43 0.18 1 1625 378 378 VAL H H 8.76 0.02 1 1626 378 378 VAL C C 176.83 0.03 1 1627 378 378 VAL CA C 66.03 0.04 1 1628 378 378 VAL CB C 29.59 0.08 1 1629 378 378 VAL N N 122.18 0.07 1 1630 379 379 ALA H H 8.47 0.02 1 1631 379 379 ALA C C 179.91 0.04 1 1632 379 379 ALA CA C 55.20 0.12 1 1633 379 379 ALA CB C 16.96 0.15 1 1634 379 379 ALA N N 123.65 0.11 1 1635 380 380 SER H H 7.73 0.02 1 1636 380 380 SER C C 176.83 0.04 1 1637 380 380 SER CA C 60.89 0.02 1 1638 380 380 SER CB C 62.16 0.40 1 1639 380 380 SER N N 115.31 0.16 1 1640 381 381 ILE H H 8.22 0.02 1 1641 381 381 ILE C C 177.98 0.04 1 1642 381 381 ILE CA C 64.15 0.13 1 1643 381 381 ILE CB C 37.27 0.05 1 1644 381 381 ILE N N 127.05 0.13 1 1645 382 382 TRP H H 8.78 0.02 1 1646 382 382 TRP C C 179.27 0.02 1 1647 382 382 TRP CA C 59.01 0.06 1 1648 382 382 TRP CB C 26.62 0.16 1 1649 382 382 TRP N N 122.87 0.02 1 1650 383 383 LYS H H 8.36 0.02 1 1651 383 383 LYS C C 179.40 0.02 1 1652 383 383 LYS CA C 59.68 0.10 1 1653 383 383 LYS CB C 31.01 0.09 1 1654 383 383 LYS N N 124.22 0.02 1 1655 384 384 LYS H H 8.13 0.02 1 1656 384 384 LYS C C 178.32 0.02 1 1657 384 384 LYS CA C 58.55 0.02 1 1658 384 384 LYS CB C 31.48 0.02 1 1659 384 384 LYS N N 122.34 0.12 1 1660 385 385 ASN H H 8.89 0.02 1 1661 385 385 ASN C C 176.13 0.03 1 1662 385 385 ASN CA C 54.15 0.07 1 1663 385 385 ASN CB C 37.29 0.10 1 1664 385 385 ASN N N 117.84 0.19 1 1665 386 386 LEU H H 7.98 0.02 1 1666 386 386 LEU C C 176.36 0.04 1 1667 386 386 LEU CA C 52.90 0.02 1 1668 386 386 LEU CB C 45.40 0.07 1 1669 386 386 LEU N N 117.91 0.23 1 1670 387 387 GLY H H 7.88 0.02 1 1671 387 387 GLY C C 175.13 0.02 1 1672 387 387 GLY CA C 45.71 0.05 1 1673 387 387 GLY N N 110.85 0.17 1 1674 388 388 VAL H H 6.44 0.03 1 1675 388 388 VAL C C 173.68 0.04 1 1676 388 388 VAL CA C 59.00 0.07 1 1677 388 388 VAL CB C 31.09 0.08 1 1678 388 388 VAL N N 113.72 0.16 1 1679 389 389 ASN H H 8.50 0.02 1 1680 389 389 ASN C C 172.50 0.02 1 1681 389 389 ASN CA C 51.64 0.04 1 1682 389 389 ASN CB C 38.95 0.02 1 1683 389 389 ASN N N 121.89 0.19 1 1684 390 390 VAL H H 7.71 0.02 1 1685 390 390 VAL C C 174.91 0.02 1 1686 390 390 VAL CA C 59.39 0.04 1 1687 390 390 VAL CB C 32.36 0.07 1 1688 390 390 VAL N N 124.22 0.10 1 1689 391 391 ASN H H 8.73 0.02 1 1690 391 391 ASN C C 173.70 0.07 1 1691 391 391 ASN CA C 51.09 0.06 1 1692 391 391 ASN CB C 38.85 0.17 1 1693 391 391 ASN N N 128.81 0.09 1 1694 392 392 LEU H H 8.62 0.02 1 1695 392 392 LEU C C 177.07 0.02 1 1696 392 392 LEU CA C 54.77 0.02 1 1697 392 392 LEU CB C 42.35 0.05 1 1698 392 392 LEU N N 127.51 0.13 1 1699 393 393 GLU H H 8.87 0.02 1 1700 393 393 GLU C C 172.26 0.03 1 1701 393 393 GLU CA C 54.32 0.03 1 1702 393 393 GLU CB C 31.33 0.10 1 1703 393 393 GLU N N 125.88 0.17 1 1704 394 394 ASN H H 8.08 0.02 1 1705 394 394 ASN C C 174.10 0.02 1 1706 394 394 ASN CA C 50.64 0.03 1 1707 394 394 ASN CB C 39.81 0.12 1 1708 394 394 ASN N N 121.12 0.14 1 1709 395 395 GLN H H 7.76 0.02 1 1710 395 395 GLN C C 175.14 0.02 1 1711 395 395 GLN CA C 53.07 0.02 1 1712 395 395 GLN CB C 32.67 0.07 1 1713 395 395 GLN N N 121.43 0.13 1 1714 396 396 GLU H H 8.48 0.02 1 1715 396 396 GLU C C 176.47 0.04 1 1716 396 396 GLU CA C 55.79 0.02 1 1717 396 396 GLU CB C 28.48 0.13 1 1718 396 396 GLU N N 123.57 0.12 1 1719 397 397 TRP H H 8.75 0.02 1 1720 397 397 TRP C C 175.38 0.03 1 1721 397 397 TRP CA C 61.28 0.03 1 1722 397 397 TRP CB C 29.60 0.04 1 1723 397 397 TRP N N 123.86 0.10 1 1724 398 398 LYS H H 8.82 0.02 1 1725 398 398 LYS C C 179.16 0.02 1 1726 398 398 LYS CA C 59.85 0.04 1 1727 398 398 LYS CB C 30.82 0.35 1 1728 398 398 LYS N N 118.21 0.11 1 1729 399 399 THR H H 7.32 0.02 1 1730 399 399 THR C C 174.14 0.04 1 1731 399 399 THR CA C 65.62 0.06 1 1732 399 399 THR CB C 68.31 0.10 1 1733 399 399 THR N N 119.83 0.16 1 1734 400 400 PHE H H 8.76 0.02 1 1735 400 400 PHE C C 176.27 0.10 1 1736 400 400 PHE CA C 59.09 0.02 1 1737 400 400 PHE CB C 37.81 0.16 1 1738 400 400 PHE N N 126.23 0.12 1 1739 401 401 LEU H H 7.83 0.02 1 1740 401 401 LEU C C 179.48 0.02 1 1741 401 401 LEU CA C 56.79 0.06 1 1742 401 401 LEU CB C 40.12 0.07 1 1743 401 401 LEU N N 120.34 0.19 1 1744 402 402 ASP H H 7.55 0.02 1 1745 402 402 ASP C C 178.27 0.06 1 1746 402 402 ASP CA C 57.20 0.07 1 1747 402 402 ASP CB C 39.82 0.06 1 1748 402 402 ASP N N 123.42 0.07 1 1749 403 403 THR H H 9.08 0.02 1 1750 403 403 THR C C 176.77 0.04 1 1751 403 403 THR CA C 65.35 0.09 1 1752 403 403 THR CB C 67.24 0.10 1 1753 403 403 THR N N 122.00 0.12 1 1754 404 404 ARG H H 7.30 0.02 1 1755 404 404 ARG C C 179.38 0.02 1 1756 404 404 ARG CA C 57.63 0.04 1 1757 404 404 ARG CB C 28.75 0.07 1 1758 404 404 ARG N N 121.89 0.11 1 1759 405 405 HIS H H 8.25 0.02 1 1760 405 405 HIS C C 176.82 0.03 1 1761 405 405 HIS CA C 59.15 0.10 1 1762 405 405 HIS CB C 27.11 0.11 1 1763 405 405 HIS N N 120.73 0.19 1 1764 406 406 GLN H H 8.72 0.02 1 1765 406 406 GLN C C 177.58 0.02 1 1766 406 406 GLN CA C 56.74 0.02 1 1767 406 406 GLN CB C 27.91 0.25 1 1768 406 406 GLN N N 119.14 0.14 1 1769 407 407 GLY H H 8.08 0.02 1 1770 407 407 GLY C C 174.62 0.02 1 1771 407 407 GLY CA C 44.94 0.02 1 1772 407 407 GLY N N 106.84 0.15 1 1773 408 408 THR H H 7.84 0.02 1 1774 408 408 THR C C 173.04 0.04 1 1775 408 408 THR CA C 58.84 0.05 1 1776 408 408 THR CB C 65.73 0.02 1 1777 408 408 THR N N 115.08 0.04 1 1778 409 409 PHE H H 6.93 0.02 1 1779 409 409 PHE C C 170.95 0.02 1 1780 409 409 PHE CA C 54.53 0.02 1 1781 409 409 PHE CB C 39.72 0.13 1 1782 409 409 PHE N N 118.39 0.09 1 1783 410 410 ASP H H 9.19 0.04 1 1784 410 410 ASP C C 171.66 0.02 1 1785 410 410 ASP CA C 54.91 0.10 1 1786 410 410 ASP CB C 41.10 0.02 1 1787 410 410 ASP N N 122.51 0.14 1 1788 411 411 VAL H H 7.02 0.02 1 1789 411 411 VAL C C 173.92 0.02 1 1790 411 411 VAL CA C 59.28 0.02 1 1791 411 411 VAL CB C 34.55 0.09 1 1792 411 411 VAL N N 118.92 0.14 1 1793 412 412 ALA H H 9.43 0.02 1 1794 412 412 ALA C C 177.00 0.05 1 1795 412 412 ALA CA C 49.22 0.02 1 1796 412 412 ALA CB C 21.05 0.20 1 1797 412 412 ALA N N 129.66 0.12 1 1798 413 413 ARG H H 9.11 0.04 1 1799 413 413 ARG C C 172.67 0.02 1 1800 413 413 ARG CA C 57.49 0.02 1 1801 413 413 ARG CB C 28.87 0.02 1 1802 413 413 ARG N N 125.68 0.17 1 1803 419 419 ASN H H 7.60 0.02 1 1804 419 419 ASN CA C 52.21 0.02 1 1805 419 419 ASN N N 116.40 0.02 1 1806 420 420 TYR H H 6.99 0.02 1 1807 420 420 TYR C C 172.92 0.02 1 1808 420 420 TYR CA C 55.11 0.04 1 1809 420 420 TYR CB C 38.57 0.17 1 1810 420 420 TYR N N 114.35 0.23 1 1811 421 421 ASN H H 9.01 0.02 1 1812 421 421 ASN C C 172.74 0.03 1 1813 421 421 ASN CA C 50.54 0.03 1 1814 421 421 ASN CB C 35.29 0.13 1 1815 421 421 ASN N N 120.94 0.11 1 1816 422 422 GLU H H 7.32 0.02 1 1817 422 422 GLU C C 175.74 0.02 1 1818 422 422 GLU CA C 56.14 0.02 1 1819 422 422 GLU CB C 29.93 0.02 1 1820 422 422 GLU N N 125.79 0.17 1 1821 423 423 PRO C C 177.46 0.02 1 1822 423 423 PRO CA C 65.59 0.02 1 1823 423 423 PRO CB C 31.06 0.02 1 1824 424 424 THR H H 8.91 0.02 1 1825 424 424 THR C C 176.00 0.02 1 1826 424 424 THR CA C 65.95 0.06 1 1827 424 424 THR CB C 69.07 0.12 1 1828 424 424 THR N N 112.19 0.14 1 1829 425 425 SER H H 7.50 0.02 1 1830 425 425 SER CA C 60.84 0.02 1 1831 425 425 SER CB C 62.49 0.02 1 1832 425 425 SER N N 118.13 0.14 1 1833 428 428 ASN H H 9.43 0.02 1 1834 428 428 ASN CA C 54.41 0.02 1 1835 428 428 ASN CB C 36.48 0.02 1 1836 428 428 ASN N N 133.62 0.11 1 1837 429 429 THR H H 7.47 0.02 1 1838 429 429 THR C C 173.20 0.02 1 1839 429 429 THR CA C 63.12 0.15 1 1840 429 429 THR CB C 68.57 0.13 1 1841 429 429 THR N N 111.54 0.16 1 1842 430 430 MET H H 6.86 0.02 1 1843 430 430 MET C C 175.28 0.02 1 1844 430 430 MET CA C 52.43 0.07 1 1845 430 430 MET CB C 31.63 0.21 1 1846 430 430 MET N N 117.46 0.14 1 1847 431 431 LEU H H 6.78 0.02 1 1848 431 431 LEU C C 182.20 0.02 1 1849 431 431 LEU CA C 54.41 0.02 1 1850 431 431 LEU CB C 41.51 0.02 1 1851 431 431 LEU N N 120.36 0.09 1 1852 433 433 ASP CA C 52.25 0.02 1 1853 433 433 ASP CB C 39.54 0.02 1 1854 434 434 SER H H 7.59 0.02 1 1855 434 434 SER C C 178.67 0.09 1 1856 434 434 SER CA C 58.05 0.02 1 1857 434 434 SER CB C 63.09 0.06 1 1858 434 434 SER N N 116.35 0.10 1 1859 435 435 SER H H 9.23 0.02 1 1860 435 435 SER C C 174.57 0.02 1 1861 435 435 SER CA C 60.25 0.05 1 1862 435 435 SER CB C 62.46 0.35 1 1863 435 435 SER N N 129.07 0.13 1 1864 436 436 ASN H H 8.18 0.02 1 1865 436 436 ASN C C 173.36 0.02 1 1866 436 436 ASN CA C 52.34 0.02 1 1867 436 436 ASN CB C 39.02 0.47 1 1868 436 436 ASN N N 119.07 0.17 1 1869 437 437 ASN H H 7.17 0.02 1 1870 437 437 ASN C C 176.51 0.06 1 1871 437 437 ASN CA C 51.14 0.10 1 1872 437 437 ASN CB C 36.02 0.09 1 1873 437 437 ASN N N 122.09 0.13 1 1874 438 438 THR H H 7.93 0.02 1 1875 438 438 THR C C 174.24 0.04 1 1876 438 438 THR CA C 61.80 0.02 1 1877 438 438 THR CB C 65.23 0.06 1 1878 438 438 THR N N 118.69 0.14 1 1879 439 439 ALA H H 7.07 0.02 1 1880 439 439 ALA C C 176.91 0.02 1 1881 439 439 ALA CA C 52.07 0.02 1 1882 439 439 ALA CB C 16.29 0.02 1 1883 439 439 ALA N N 122.75 0.15 1 1884 440 440 HIS H H 7.47 0.02 1 1885 440 440 HIS C C 172.97 0.10 1 1886 440 440 HIS CA C 55.54 0.02 1 1887 440 440 HIS CB C 24.49 0.21 1 1888 440 440 HIS N N 114.69 0.12 1 1889 441 441 TYR H H 8.11 0.02 1 1890 441 441 TYR C C 174.15 0.03 1 1891 441 441 TYR CA C 56.94 0.03 1 1892 441 441 TYR CB C 39.20 0.02 1 1893 441 441 TYR N N 122.66 0.15 1 1894 442 442 LYS H H 8.09 0.02 1 1895 442 442 LYS C C 174.40 0.02 1 1896 442 442 LYS CA C 53.46 0.14 1 1897 442 442 LYS CB C 32.44 0.07 1 1898 442 442 LYS N N 130.43 0.12 1 1899 443 443 SER H H 9.17 0.02 1 1900 443 443 SER C C 175.22 0.02 1 1901 443 443 SER CA C 52.67 0.02 1 1902 443 443 SER CB C 63.83 0.02 1 1903 443 443 SER N N 123.39 0.22 1 1904 444 444 PRO C C 179.13 0.02 1 1905 444 444 PRO CA C 63.86 0.03 1 1906 444 444 PRO CB C 30.91 0.09 1 1907 445 445 ALA H H 7.65 0.02 1 1908 445 445 ALA C C 179.97 0.03 1 1909 445 445 ALA CA C 54.12 0.13 1 1910 445 445 ALA CB C 17.30 0.11 1 1911 445 445 ALA N N 121.59 0.04 1 1912 446 446 PHE H H 8.17 0.02 1 1913 446 446 PHE C C 176.21 0.07 1 1914 446 446 PHE CA C 62.16 0.11 1 1915 446 446 PHE CB C 39.22 0.08 1 1916 446 446 PHE N N 123.96 0.11 1 1917 447 447 ASP H H 8.50 0.02 1 1918 447 447 ASP C C 179.32 0.07 1 1919 447 447 ASP CA C 56.41 0.09 1 1920 447 447 ASP CB C 38.70 0.08 1 1921 447 447 ASP N N 119.76 0.14 1 1922 448 448 LYS H H 7.88 0.02 1 1923 448 448 LYS C C 177.37 0.07 1 1924 448 448 LYS CA C 58.23 0.02 1 1925 448 448 LYS CB C 31.38 0.35 1 1926 448 448 LYS N N 122.49 0.16 1 1927 449 449 LEU H H 7.32 0.02 1 1928 449 449 LEU C C 178.58 0.02 1 1929 449 449 LEU CA C 57.53 0.11 1 1930 449 449 LEU CB C 41.12 0.10 1 1931 449 449 LEU N N 122.02 0.10 1 1932 450 450 ILE H H 7.25 0.02 1 1933 450 450 ILE C C 180.47 0.08 1 1934 450 450 ILE CA C 60.42 0.13 1 1935 450 450 ILE CB C 32.78 0.29 1 1936 450 450 ILE N N 115.62 0.13 1 1937 451 451 ALA H H 8.39 0.02 1 1938 451 451 ALA C C 181.59 0.02 1 1939 451 451 ALA CA C 55.17 0.02 1 1940 451 451 ALA CB C 16.60 0.14 1 1941 451 451 ALA N N 128.24 0.20 1 1942 452 452 ASP H H 8.58 0.02 1 1943 452 452 ASP C C 179.79 0.03 1 1944 452 452 ASP CA C 56.65 0.02 1 1945 452 452 ASP CB C 38.99 0.03 1 1946 452 452 ASP N N 121.46 0.14 1 1947 453 453 THR H H 7.81 0.02 1 1948 453 453 THR C C 175.50 0.06 1 1949 453 453 THR CA C 64.94 0.03 1 1950 453 453 THR CB C 68.65 0.38 1 1951 453 453 THR N N 114.83 0.02 1 1952 454 454 LEU H H 7.23 0.02 1 1953 454 454 LEU C C 176.31 0.04 1 1954 454 454 LEU CA C 55.37 0.08 1 1955 454 454 LEU CB C 40.04 0.12 1 1956 454 454 LEU N N 120.79 0.22 1 1957 455 455 LYS H H 7.15 0.02 1 1958 455 455 LYS C C 177.10 0.02 1 1959 455 455 LYS CA C 54.93 0.11 1 1960 455 455 LYS CB C 33.12 0.30 1 1961 455 455 LYS N N 114.82 0.05 1 1962 456 456 VAL H H 6.93 0.02 1 1963 456 456 VAL C C 175.62 0.02 1 1964 456 456 VAL CA C 60.69 0.04 1 1965 456 456 VAL CB C 31.76 0.06 1 1966 456 456 VAL N N 116.93 0.16 1 1967 457 457 ALA H H 8.54 0.02 1 1968 457 457 ALA C C 177.85 0.07 1 1969 457 457 ALA CA C 53.43 0.04 1 1970 457 457 ALA CB C 18.82 0.07 1 1971 457 457 ALA N N 127.76 0.11 1 1972 458 458 ASP H H 7.60 0.02 1 1973 458 458 ASP C C 176.05 0.04 1 1974 458 458 ASP CA C 52.89 0.03 1 1975 458 458 ASP CB C 43.18 0.04 1 1976 458 458 ASP N N 118.47 0.14 1 1977 459 459 ASP H H 9.01 0.02 1 1978 459 459 ASP C C 178.41 0.02 1 1979 459 459 ASP CA C 56.95 0.07 1 1980 459 459 ASP CB C 40.11 0.02 1 1981 459 459 ASP N N 126.45 0.13 1 1982 460 460 THR H H 8.44 0.03 1 1983 460 460 THR C C 177.17 0.02 1 1984 460 460 THR CA C 65.91 0.02 1 1985 460 460 THR CB C 67.48 0.13 1 1986 460 460 THR N N 121.06 0.14 1 1987 461 461 GLN H H 8.21 0.03 1 1988 461 461 GLN C C 179.06 0.02 1 1989 461 461 GLN CA C 58.04 0.02 1 1990 461 461 GLN CB C 29.48 0.02 1 1991 461 461 GLN N N 124.88 0.18 1 1992 462 462 ARG H H 7.98 0.02 1 1993 462 462 ARG C C 176.71 0.02 1 1994 462 462 ARG CA C 60.17 0.09 1 1995 462 462 ARG CB C 28.47 0.15 1 1996 462 462 ARG N N 123.51 0.13 1 1997 463 463 SER H H 8.20 0.02 1 1998 463 463 SER C C 177.20 0.05 1 1999 463 463 SER CA C 62.17 0.07 1 2000 463 463 SER CB C 66.04 0.02 1 2001 463 463 SER N N 115.37 0.09 1 2002 464 464 GLU H H 7.64 0.02 1 2003 464 464 GLU C C 179.02 0.02 1 2004 464 464 GLU CA C 58.54 0.03 1 2005 464 464 GLU CB C 27.94 0.10 1 2006 464 464 GLU N N 125.39 0.12 1 2007 465 465 LEU H H 7.44 0.02 1 2008 465 465 LEU C C 179.84 0.03 1 2009 465 465 LEU CA C 57.65 0.02 1 2010 465 465 LEU CB C 40.87 0.09 1 2011 465 465 LEU N N 123.64 0.15 1 2012 466 466 TYR H H 8.24 0.02 1 2013 466 466 TYR C C 178.61 0.02 1 2014 466 466 TYR CA C 57.66 0.03 1 2015 466 466 TYR CB C 35.67 0.07 1 2016 466 466 TYR N N 120.31 0.18 1 2017 467 467 ALA H H 7.95 0.02 1 2018 467 467 ALA C C 181.61 0.04 1 2019 467 467 ALA CA C 54.59 0.02 1 2020 467 467 ALA CB C 16.90 0.13 1 2021 467 467 ALA N N 123.08 0.10 1 2022 468 468 LYS H H 8.17 0.02 1 2023 468 468 LYS C C 179.47 0.02 1 2024 468 468 LYS CA C 58.72 0.04 1 2025 468 468 LYS CB C 31.59 0.02 1 2026 468 468 LYS N N 122.75 0.19 1 2027 469 469 ALA H H 8.74 0.02 1 2028 469 469 ALA C C 179.61 0.02 1 2029 469 469 ALA CA C 55.03 0.02 1 2030 469 469 ALA CB C 16.31 0.08 1 2031 469 469 ALA N N 128.99 0.07 1 2032 470 470 GLU H H 8.16 0.02 1 2033 470 470 GLU C C 180.33 0.02 1 2034 470 470 GLU CA C 59.44 0.04 1 2035 470 470 GLU CB C 27.82 0.07 1 2036 470 470 GLU N N 121.02 0.15 1 2037 471 471 GLN H H 8.39 0.02 1 2038 471 471 GLN C C 178.07 0.02 1 2039 471 471 GLN CA C 58.84 0.08 1 2040 471 471 GLN CB C 27.77 0.02 1 2041 471 471 GLN N N 122.95 0.15 1 2042 472 472 GLN H H 8.25 0.02 1 2043 472 472 GLN C C 176.42 0.03 1 2044 472 472 GLN CA C 57.89 0.02 1 2045 472 472 GLN CB C 27.34 0.22 1 2046 472 472 GLN N N 124.97 0.08 1 2047 473 473 LEU H H 7.99 0.02 1 2048 473 473 LEU C C 178.56 0.02 1 2049 473 473 LEU CA C 57.57 0.08 1 2050 473 473 LEU CB C 41.59 0.02 1 2051 473 473 LEU N N 121.22 0.09 1 2052 474 474 ASP H H 7.82 0.02 1 2053 474 474 ASP C C 179.32 0.02 1 2054 474 474 ASP CA C 56.89 0.04 1 2055 474 474 ASP CB C 42.09 0.25 1 2056 474 474 ASP N N 116.96 0.06 1 2057 475 475 LYS H H 8.74 0.02 1 2058 475 475 LYS C C 179.45 0.03 1 2059 475 475 LYS CA C 58.79 0.02 1 2060 475 475 LYS CB C 30.59 0.02 1 2061 475 475 LYS N N 123.92 0.14 1 2062 476 476 ASP H H 7.83 0.02 1 2063 476 476 ASP C C 174.70 0.05 1 2064 476 476 ASP CA C 54.36 0.05 1 2065 476 476 ASP CB C 40.69 0.05 1 2066 476 476 ASP N N 119.15 0.21 1 2067 477 477 SER H H 8.16 0.02 1 2068 477 477 SER C C 173.03 0.07 1 2069 477 477 SER CA C 57.13 0.05 1 2070 477 477 SER CB C 62.07 0.12 1 2071 477 477 SER N N 122.04 0.31 1 2072 478 478 ALA H H 7.08 0.02 1 2073 478 478 ALA C C 177.86 0.02 1 2074 478 478 ALA CA C 53.83 0.11 1 2075 478 478 ALA CB C 19.20 0.04 1 2076 478 478 ALA N N 121.36 0.08 1 2077 479 479 ILE H H 7.46 0.02 1 2078 479 479 ILE C C 173.87 0.06 1 2079 479 479 ILE CA C 57.61 0.04 1 2080 479 479 ILE CB C 42.69 0.13 1 2081 479 479 ILE N N 102.62 0.11 1 2082 480 480 VAL H H 8.83 0.02 1 2083 480 480 VAL C C 173.43 0.02 1 2084 480 480 VAL CA C 58.60 0.02 1 2085 480 480 VAL CB C 31.60 0.02 1 2086 480 480 VAL N N 119.02 0.11 1 2087 481 481 PRO C C 177.31 0.02 1 2088 481 481 PRO CA C 63.16 0.02 1 2089 481 481 PRO CB C 30.68 0.02 1 2090 482 482 VAL H H 8.60 0.02 1 2091 482 482 VAL C C 174.14 0.06 1 2092 482 482 VAL CA C 64.21 0.02 1 2093 482 482 VAL CB C 31.68 0.31 1 2094 482 482 VAL N N 123.18 0.07 1 2095 483 483 TYR H H 7.68 0.02 1 2096 483 483 TYR C C 172.41 0.04 1 2097 483 483 TYR CA C 55.88 0.06 1 2098 483 483 TYR CB C 39.90 0.17 1 2099 483 483 TYR N N 114.94 0.17 1 2100 484 484 TYR H H 9.82 0.02 1 2101 484 484 TYR C C 176.36 0.04 1 2102 484 484 TYR CA C 55.17 0.02 1 2103 484 484 TYR CB C 37.89 0.18 1 2104 484 484 TYR N N 124.43 0.16 1 2105 485 485 TYR H H 8.69 0.02 1 2106 485 485 TYR C C 175.48 0.07 1 2107 485 485 TYR CA C 57.64 0.05 1 2108 485 485 TYR CB C 39.50 0.02 1 2109 485 485 TYR N N 126.36 0.14 1 2110 486 486 VAL H H 7.47 0.02 1 2111 486 486 VAL C C 175.15 0.04 1 2112 486 486 VAL CA C 58.59 0.02 1 2113 486 486 VAL CB C 33.69 0.11 1 2114 486 486 VAL N N 110.76 0.21 1 2115 487 487 ASN CA C 51.30 0.02 1 2116 488 488 ALA H H 8.18 0.02 1 2117 488 488 ALA C C 174.94 0.05 1 2118 488 488 ALA CA C 49.42 0.07 1 2119 488 488 ALA CB C 21.50 0.06 1 2120 488 488 ALA N N 126.86 0.14 1 2121 489 489 ARG H H 8.07 0.02 1 2122 489 489 ARG C C 172.54 0.02 1 2123 489 489 ARG CA C 53.50 0.09 1 2124 489 489 ARG CB C 32.71 0.10 1 2125 489 489 ARG N N 116.70 0.12 1 2126 490 490 LEU H H 8.24 0.03 1 2127 490 490 LEU C C 176.34 0.07 1 2128 490 490 LEU CA C 52.45 0.04 1 2129 490 490 LEU CB C 39.38 0.02 1 2130 490 490 LEU N N 121.25 0.13 1 2131 491 491 VAL H H 7.97 0.02 1 2132 491 491 VAL C C 174.48 0.02 1 2133 491 491 VAL CA C 60.74 0.02 1 2134 491 491 VAL CB C 34.43 0.02 1 2135 491 491 VAL N N 123.07 0.15 1 2136 494 494 TRP C C 174.88 0.02 1 2137 494 494 TRP CA C 55.22 0.02 1 2138 495 495 VAL H H 7.29 0.02 1 2139 495 495 VAL C C 174.62 0.02 1 2140 495 495 VAL CA C 62.19 0.02 1 2141 495 495 VAL CB C 28.70 0.02 1 2142 495 495 VAL N N 125.94 0.12 1 2143 496 496 GLY H H 9.16 0.02 1 2144 496 496 GLY C C 172.72 0.09 1 2145 496 496 GLY CA C 42.36 0.02 1 2146 496 496 GLY N N 120.66 0.15 1 2147 497 497 GLY H H 7.89 0.02 1 2148 497 497 GLY C C 173.57 0.02 1 2149 497 497 GLY CA C 44.46 0.10 1 2150 497 497 GLY N N 108.71 0.13 1 2151 498 498 TYR H H 7.74 0.02 1 2152 498 498 TYR C C 175.26 0.03 1 2153 498 498 TYR CA C 57.08 0.10 1 2154 498 498 TYR CB C 37.58 0.05 1 2155 498 498 TYR N N 123.74 0.07 1 2156 499 499 THR H H 7.71 0.02 1 2157 499 499 THR C C 175.49 0.04 1 2158 499 499 THR CA C 60.83 0.06 1 2159 499 499 THR CB C 69.37 0.18 1 2160 499 499 THR N N 119.62 0.13 1 2161 500 500 GLY H H 7.54 0.03 1 2162 500 500 GLY C C 174.85 0.10 1 2163 500 500 GLY CA C 45.21 0.02 1 2164 500 500 GLY N N 114.46 0.14 1 2165 501 501 LYS H H 7.45 0.02 1 2166 501 501 LYS C C 174.64 0.03 1 2167 501 501 LYS CA C 55.05 0.02 1 2168 501 501 LYS CB C 32.17 0.31 1 2169 501 501 LYS N N 118.50 0.13 1 2170 502 502 ASP H H 7.64 0.02 1 2171 502 502 ASP C C 176.30 0.02 1 2172 502 502 ASP CA C 49.69 0.02 1 2173 502 502 ASP CB C 41.92 0.02 1 2174 502 502 ASP N N 120.86 0.12 1 2175 503 503 PRO C C 174.15 0.02 1 2176 503 503 PRO CA C 63.61 0.02 1 2177 503 503 PRO CB C 29.83 0.02 1 2178 504 504 LEU H H 8.06 0.02 1 2179 504 504 LEU C C 176.52 0.07 1 2180 504 504 LEU CA C 53.80 0.02 1 2181 504 504 LEU CB C 40.87 0.21 1 2182 504 504 LEU N N 122.05 0.09 1 2183 505 505 ASP H H 8.19 0.02 1 2184 505 505 ASP CA C 55.36 0.02 1 2185 505 505 ASP N N 121.56 0.13 1 2186 506 506 ASN CA C 51.60 0.07 1 2187 507 507 ILE H H 7.11 0.02 1 2188 507 507 ILE C C 174.62 0.02 1 2189 507 507 ILE CA C 58.75 0.06 1 2190 507 507 ILE CB C 36.15 0.11 1 2191 507 507 ILE N N 124.64 0.13 1 2192 508 508 TYR H H 8.68 0.03 1 2193 508 508 TYR C C 177.26 0.02 1 2194 508 508 TYR CA C 55.68 0.02 1 2195 508 508 TYR CB C 37.80 0.02 1 2196 508 508 TYR N N 129.57 0.11 1 2197 509 509 VAL H H 10.13 0.02 1 2198 509 509 VAL C C 178.52 0.02 1 2199 509 509 VAL CA C 66.51 0.12 1 2200 509 509 VAL CB C 28.80 0.02 1 2201 509 509 VAL N N 132.10 0.04 1 2202 510 510 LYS H H 9.13 0.02 1 2203 510 510 LYS C C 175.30 0.07 1 2204 510 510 LYS CA C 57.82 0.02 1 2205 510 510 LYS N N 120.98 0.03 1 2206 511 511 ASN H H 8.11 0.02 1 2207 511 511 ASN C C 174.45 0.02 1 2208 511 511 ASN CA C 52.44 0.02 1 2209 511 511 ASN CB C 37.91 0.02 1 2210 511 511 ASN N N 121.23 0.13 1 2211 512 512 LEU H H 7.56 0.02 1 2212 512 512 LEU C C 175.72 0.09 1 2213 512 512 LEU CA C 52.74 0.05 1 2214 512 512 LEU CB C 42.22 0.03 1 2215 512 512 LEU N N 122.26 0.17 1 2216 513 513 TYR H H 7.59 0.02 1 2217 513 513 TYR C C 172.28 0.02 1 2218 513 513 TYR CA C 56.05 0.03 1 2219 513 513 TYR CB C 38.10 0.02 1 2220 513 513 TYR N N 114.83 0.14 1 2221 514 514 ILE H H 9.78 0.02 1 2222 514 514 ILE C C 177.41 0.02 1 2223 514 514 ILE CA C 57.60 0.04 1 2224 514 514 ILE CB C 34.35 0.02 1 2225 514 514 ILE N N 123.02 0.11 1 2226 515 515 ILE H H 9.83 0.02 1 2227 515 515 ILE C C 175.14 0.04 1 2228 515 515 ILE CA C 61.73 0.03 1 2229 515 515 ILE CB C 38.75 0.02 1 2230 515 515 ILE N N 135.44 0.13 1 2231 516 516 LYS H H 8.79 0.02 1 2232 516 516 LYS C C 174.62 0.08 1 2233 516 516 LYS CA C 58.44 0.04 1 2234 516 516 LYS CB C 31.44 0.11 1 2235 516 516 LYS N N 132.03 0.15 1 2236 517 517 HIS H H 8.01 0.02 1 2237 517 517 HIS C C 177.22 0.02 1 2238 517 517 HIS CA C 55.85 0.02 1 2239 517 517 HIS CB C 28.92 0.02 1 2240 517 517 HIS N N 130.33 0.13 1 stop_ save_