data_50158 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C, 15N and IVL methyl group chemical shift assignments ; _BMRB_accession_number 50158 _BMRB_flat_file_name bmr50158.str _Entry_type original _Submission_date 2020-01-15 _Accession_date 2020-01-15 _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 Makraki Eleni . . 2 Carneiro Marta G. . 3 Heyam Alex . . 4 AB Eiso . . 5 Siegal Gregg . . 6 Hubbard Roderick . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 351 "13C chemical shifts" 994 "15N chemical shifts" 265 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-06-29 original BMRB . stop_ _Original_release_date 2020-01-15 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; 1 H, 13 C, 15 N Backbone and IVL Methyl Group Resonance Assignment of the Fungal beta-glucosidase From Trichoderma Reesei ; _Citation_status p;ublished _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 32562251 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Makraki Eleni . . 2 Carneiro Marta G. . 3 Heyam Alex . . 4 AB Eiso . . 5 Siegal Gregg . . 6 Hubbard Roderick . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year 2020 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name 'TrBgl2 monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'TrBgl2 monomer' $entity_1_TrBgl2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1_TrBgl2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1_TrBgl2 _Molecular_mass . _Mol_thiol_state unknown _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 488 _Mol_residue_sequence ; MGSSHHHHHHSSGLEVLFQG PAMLPKDFQWGFATAAYQIE GAVDQDGRGPSIWDTFCAQP GKIADGSSGVTACDSYNRTA EDIALLKSLGAKSYRFSISW SRIIPEGGRGDAVNQAGIDH YVKFVDDLLDAGITPFITLF HWDLPEGLHQRYGGLLNRTE FPLDFENYARVMFRALPKVR NWITFNEPLCSAIPGYGSGT FAPGRQSTSEPWTVGHNILV AHGRAVKAYRDDFKPASGDG QIGIVLNGDFTYPWDAADPA DKEAAERRLEFFTAWFADPI YLGDYPASMRKQLGDRLPTF TPEERALVHGSNDFYGMNHY TSNYIRHRSSPASADDTVGN VDVLFTNKQGNCIGPETQSP WLRPCAAGFRDFLVWISKRY GYPPIYVTENGTSIKGESDL PKEKILEDDFRVKYYNEYIR AMVTAVELDGVNVKGYFAWS LMDNFEWADGYVTRFGVTYV DYENGQKRFPKKSAKSLKPL FDELIAAA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -21 MET 2 -20 GLY 3 -19 SER 4 -18 SER 5 -17 HIS 6 -16 HIS 7 -15 HIS 8 -14 HIS 9 -13 HIS 10 -12 HIS 11 -11 SER 12 -10 SER 13 -9 GLY 14 -8 LEU 15 -7 GLU 16 -6 VAL 17 -5 LEU 18 -4 PHE 19 -3 GLN 20 -2 GLY 21 -1 PRO 22 0 ALA 23 1 MET 24 2 LEU 25 3 PRO 26 4 LYS 27 5 ASP 28 6 PHE 29 7 GLN 30 8 TRP 31 9 GLY 32 10 PHE 33 11 ALA 34 12 THR 35 13 ALA 36 14 ALA 37 15 TYR 38 16 GLN 39 17 ILE 40 18 GLU 41 19 GLY 42 20 ALA 43 21 VAL 44 22 ASP 45 23 GLN 46 24 ASP 47 25 GLY 48 26 ARG 49 27 GLY 50 28 PRO 51 29 SER 52 30 ILE 53 31 TRP 54 32 ASP 55 33 THR 56 34 PHE 57 35 CYS 58 36 ALA 59 37 GLN 60 38 PRO 61 39 GLY 62 40 LYS 63 41 ILE 64 42 ALA 65 43 ASP 66 44 GLY 67 45 SER 68 46 SER 69 47 GLY 70 48 VAL 71 49 THR 72 50 ALA 73 51 CYS 74 52 ASP 75 53 SER 76 54 TYR 77 55 ASN 78 56 ARG 79 57 THR 80 58 ALA 81 59 GLU 82 60 ASP 83 61 ILE 84 62 ALA 85 63 LEU 86 64 LEU 87 65 LYS 88 66 SER 89 67 LEU 90 68 GLY 91 69 ALA 92 70 LYS 93 71 SER 94 72 TYR 95 73 ARG 96 74 PHE 97 75 SER 98 76 ILE 99 77 SER 100 78 TRP 101 79 SER 102 80 ARG 103 81 ILE 104 82 ILE 105 83 PRO 106 84 GLU 107 85 GLY 108 86 GLY 109 87 ARG 110 88 GLY 111 89 ASP 112 90 ALA 113 91 VAL 114 92 ASN 115 93 GLN 116 94 ALA 117 95 GLY 118 96 ILE 119 97 ASP 120 98 HIS 121 99 TYR 122 100 VAL 123 101 LYS 124 102 PHE 125 103 VAL 126 104 ASP 127 105 ASP 128 106 LEU 129 107 LEU 130 108 ASP 131 109 ALA 132 110 GLY 133 111 ILE 134 112 THR 135 113 PRO 136 114 PHE 137 115 ILE 138 116 THR 139 117 LEU 140 118 PHE 141 119 HIS 142 120 TRP 143 121 ASP 144 122 LEU 145 123 PRO 146 124 GLU 147 125 GLY 148 126 LEU 149 127 HIS 150 128 GLN 151 129 ARG 152 130 TYR 153 131 GLY 154 132 GLY 155 133 LEU 156 134 LEU 157 135 ASN 158 136 ARG 159 137 THR 160 138 GLU 161 139 PHE 162 140 PRO 163 141 LEU 164 142 ASP 165 143 PHE 166 144 GLU 167 145 ASN 168 146 TYR 169 147 ALA 170 148 ARG 171 149 VAL 172 150 MET 173 151 PHE 174 152 ARG 175 153 ALA 176 154 LEU 177 155 PRO 178 156 LYS 179 157 VAL 180 158 ARG 181 159 ASN 182 160 TRP 183 161 ILE 184 162 THR 185 163 PHE 186 164 ASN 187 165 GLU 188 166 PRO 189 167 LEU 190 168 CYS 191 169 SER 192 170 ALA 193 171 ILE 194 172 PRO 195 173 GLY 196 174 TYR 197 175 GLY 198 176 SER 199 177 GLY 200 178 THR 201 179 PHE 202 180 ALA 203 181 PRO 204 182 GLY 205 183 ARG 206 184 GLN 207 185 SER 208 186 THR 209 187 SER 210 188 GLU 211 189 PRO 212 190 TRP 213 191 THR 214 192 VAL 215 193 GLY 216 194 HIS 217 195 ASN 218 196 ILE 219 197 LEU 220 198 VAL 221 199 ALA 222 200 HIS 223 201 GLY 224 202 ARG 225 203 ALA 226 204 VAL 227 205 LYS 228 206 ALA 229 207 TYR 230 208 ARG 231 209 ASP 232 210 ASP 233 211 PHE 234 212 LYS 235 213 PRO 236 214 ALA 237 215 SER 238 216 GLY 239 217 ASP 240 218 GLY 241 219 GLN 242 220 ILE 243 221 GLY 244 222 ILE 245 223 VAL 246 224 LEU 247 225 ASN 248 226 GLY 249 227 ASP 250 228 PHE 251 229 THR 252 230 TYR 253 231 PRO 254 232 TRP 255 233 ASP 256 234 ALA 257 235 ALA 258 236 ASP 259 237 PRO 260 238 ALA 261 239 ASP 262 240 LYS 263 241 GLU 264 242 ALA 265 243 ALA 266 244 GLU 267 245 ARG 268 246 ARG 269 247 LEU 270 248 GLU 271 249 PHE 272 250 PHE 273 251 THR 274 252 ALA 275 253 TRP 276 254 PHE 277 255 ALA 278 256 ASP 279 257 PRO 280 258 ILE 281 259 TYR 282 260 LEU 283 261 GLY 284 262 ASP 285 263 TYR 286 264 PRO 287 265 ALA 288 266 SER 289 267 MET 290 268 ARG 291 269 LYS 292 270 GLN 293 271 LEU 294 272 GLY 295 273 ASP 296 274 ARG 297 275 LEU 298 276 PRO 299 277 THR 300 278 PHE 301 279 THR 302 280 PRO 303 281 GLU 304 282 GLU 305 283 ARG 306 284 ALA 307 285 LEU 308 286 VAL 309 287 HIS 310 288 GLY 311 289 SER 312 290 ASN 313 291 ASP 314 292 PHE 315 293 TYR 316 294 GLY 317 295 MET 318 296 ASN 319 297 HIS 320 298 TYR 321 299 THR 322 300 SER 323 301 ASN 324 302 TYR 325 303 ILE 326 304 ARG 327 305 HIS 328 306 ARG 329 307 SER 330 308 SER 331 309 PRO 332 310 ALA 333 311 SER 334 312 ALA 335 313 ASP 336 314 ASP 337 315 THR 338 316 VAL 339 317 GLY 340 318 ASN 341 319 VAL 342 320 ASP 343 321 VAL 344 322 LEU 345 323 PHE 346 324 THR 347 325 ASN 348 326 LYS 349 327 GLN 350 328 GLY 351 329 ASN 352 330 CYS 353 331 ILE 354 332 GLY 355 333 PRO 356 334 GLU 357 335 THR 358 336 GLN 359 337 SER 360 338 PRO 361 339 TRP 362 340 LEU 363 341 ARG 364 342 PRO 365 343 CYS 366 344 ALA 367 345 ALA 368 346 GLY 369 347 PHE 370 348 ARG 371 349 ASP 372 350 PHE 373 351 LEU 374 352 VAL 375 353 TRP 376 354 ILE 377 355 SER 378 356 LYS 379 357 ARG 380 358 TYR 381 359 GLY 382 360 TYR 383 361 PRO 384 362 PRO 385 363 ILE 386 364 TYR 387 365 VAL 388 366 THR 389 367 GLU 390 368 ASN 391 369 GLY 392 370 THR 393 371 SER 394 372 ILE 395 373 LYS 396 374 GLY 397 375 GLU 398 376 SER 399 377 ASP 400 378 LEU 401 379 PRO 402 380 LYS 403 381 GLU 404 382 LYS 405 383 ILE 406 384 LEU 407 385 GLU 408 386 ASP 409 387 ASP 410 388 PHE 411 389 ARG 412 390 VAL 413 391 LYS 414 392 TYR 415 393 TYR 416 394 ASN 417 395 GLU 418 396 TYR 419 397 ILE 420 398 ARG 421 399 ALA 422 400 MET 423 401 VAL 424 402 THR 425 403 ALA 426 404 VAL 427 405 GLU 428 406 LEU 429 407 ASP 430 408 GLY 431 409 VAL 432 410 ASN 433 411 VAL 434 412 LYS 435 413 GLY 436 414 TYR 437 415 PHE 438 416 ALA 439 417 TRP 440 418 SER 441 419 LEU 442 420 MET 443 421 ASP 444 422 ASN 445 423 PHE 446 424 GLU 447 425 TRP 448 426 ALA 449 427 ASP 450 428 GLY 451 429 TYR 452 430 VAL 453 431 THR 454 432 ARG 455 433 PHE 456 434 GLY 457 435 VAL 458 436 THR 459 437 TYR 460 438 VAL 461 439 ASP 462 440 TYR 463 441 GLU 464 442 ASN 465 443 GLY 466 444 GLN 467 445 LYS 468 446 ARG 469 447 PHE 470 448 PRO 471 449 LYS 472 450 LYS 473 451 SER 474 452 ALA 475 453 LYS 476 454 SER 477 455 LEU 478 456 LYS 479 457 PRO 480 458 LEU 481 459 PHE 482 460 ASP 483 461 GLU 484 462 LEU 485 463 ILE 486 464 ALA 487 465 ALA 488 466 ALA stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source_1 _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1_TrBgl2 'Trichoderma reesei' 51453 Eukaryota Fungi Trichoderma reesei stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1_TrBgl2 'recombinant technology' . Escherichia coli Bl21[DE3] plasmid pET-YSBLIC3C stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1_2H__13C__15N_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1_TrBgl2 0.25 mM '[U-13C; U-15N; U-2H]' TRIS 50 mM 'natural abundance' 'sodium chloride' 100 mM 'natural abundance' DTT 3 mM 'natural abundance' stop_ save_ save_sample_3_2H__13C__15N_-_IVL__sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1_TrBgl2 0.25 mM '[U-13C; U-15N; U-2H; Ile d1-13CH3; Leu,Val-13CH3]' TRIS 50 mM 'natural abundance' 'sodium chloride' 100 mM 'natural abundance' DTT 3 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 3.2 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_2_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_software_3_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ save_software_4_FLYA _Saveframe_category software _Name FLYA _Version . loop_ _Vendor _Address _Electronic_address 'Schmidt and Guntert' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance Neo' _Field_strength 700 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance III' _Field_strength 850 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HN(CO)CACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HN(CA)CO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HN(CA)CB_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CB' _Sample_label $sample_1_2H__13C__15N_sample save_ save_3D_HMCMC_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HMCMC' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_HMCM(C)CB_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HMCM(C)CB' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_HMCM(CC)CA_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HMCM(CC)CA' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_HMCM(CCC)CO_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HMCM(CCC)CO' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_13Ch-13CH3_SOFAST-HMQC-NOESY-HMQC_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13Ch-13CH3 SOFAST-HMQC-NOESY-HMQC' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_15N-resolved_NOESY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 15N-resolved NOESY' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_(CT)1H-13Cmethyl_HMQC_14 _Saveframe_category NMR_applied_experiment _Experiment_name '(CT)1H-13Cmethyl HMQC' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ save_3D_13C-resolved_NOESY_15 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 13C-resolved NOESY' _Sample_label $sample_3_2H__13C__15N_-_IVL__sample save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 8 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_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 water C 13 protons ppm 4.773 internal indirect . . . 0.251 water H 1 protons ppm 4.773 internal direct . . . 1 water N 15 protons ppm 4.773 internal indirect . . . 0.101 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details 'All geminal atoms (methyl groups) are ambiguous (i.e. value 2).' loop_ _Experiment_label '3D HNCO' '3D HNCA' '3D HNCACB' '3D HN(CO)CACB' '3D HN(CO)CA' '3D HN(CA)CO' '3D HN(CA)CB' '3D HMCMC' '3D HMCM(C)CB' '3D HMCM(CC)CA' '3D HMCM(CCC)CO' '3D 13Ch-13CH3 SOFAST-HMQC-NOESY-HMQC' '3D 15N-resolved NOESY' '(CT)1H-13Cmethyl HMQC' '3D 13C-resolved NOESY' stop_ loop_ _Sample_label $sample_1_2H__13C__15N_sample $sample_3_2H__13C__15N_-_IVL__sample stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name 'TrBgl2 monomer' _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 -9 13 GLY C C 174.024 . . 2 -9 13 GLY CA C 44.904 . . 3 -8 14 LEU H H 7.866 . . 4 -8 14 LEU HD1 H 0.670 . . 5 -8 14 LEU HD2 H 0.730 . . 6 -8 14 LEU C C 177.321 . . 7 -8 14 LEU CA C 54.726 . . 8 -8 14 LEU CB C 41.353 . . 9 -8 14 LEU CG C 26.103 . . 10 -8 14 LEU CD1 C 23.164 . . 11 -8 14 LEU CD2 C 24.597 . . 12 -8 14 LEU N N 121.776 . . 13 -7 15 GLU H H 8.302 . . 14 -7 15 GLU C C 176.265 . . 15 -7 15 GLU CA C 56.327 . . 16 -7 15 GLU CB C 29.146 . . 17 -7 15 GLU N N 121.881 . . 18 -6 16 VAL H H 7.871 . . 19 -6 16 VAL HG1 H 0.741 . . 20 -6 16 VAL HG2 H 0.753 . . 21 -6 16 VAL C C 175.725 . . 22 -6 16 VAL CA C 61.682 . . 23 -6 16 VAL CB C 31.808 . . 24 -6 16 VAL CG1 C 20.050 . . 25 -6 16 VAL CG2 C 20.946 . . 26 -6 16 VAL N N 121.452 . . 27 -5 17 LEU H H 8.048 . . 28 -5 17 LEU HD1 H 0.688 . . 29 -5 17 LEU C C 176.713 . . 30 -5 17 LEU CA C 54.508 . . 31 -5 17 LEU CB C 41.410 . . 32 -5 17 LEU CD1 C 24.568 . . 33 -5 17 LEU N N 125.986 . . 34 -4 18 PHE H H 8.050 . . 35 -4 18 PHE C C 175.199 . . 36 -4 18 PHE CA C 57.203 . . 37 -4 18 PHE CB C 38.776 . . 38 -4 18 PHE N N 121.756 . . 39 -1 21 PRO CA C 62.368 . . 40 -1 21 PRO CB C 31.362 . . 41 0 22 ALA H H 8.006 . . 42 0 22 ALA C C 176.870 . . 43 0 22 ALA CA C 52.094 . . 44 0 22 ALA CB C 17.790 . . 45 0 22 ALA N N 123.732 . . 46 1 23 MET H H 7.954 . . 47 1 23 MET C C 175.863 . . 48 1 23 MET CA C 54.439 . . 49 1 23 MET CB C 34.192 . . 50 1 23 MET N N 119.278 . . 51 2 24 LEU H H 8.406 . . 52 2 24 LEU HD1 H 0.434 . . 53 2 24 LEU HD2 H -0.367 . . 54 2 24 LEU C C 173.909 . . 55 2 24 LEU CA C 51.274 . . 56 2 24 LEU CB C 40.156 . . 57 2 24 LEU CG C 25.317 . . 58 2 24 LEU CD1 C 21.288 . . 59 2 24 LEU CD2 C 23.535 . . 60 2 24 LEU N N 120.026 . . 61 3 25 PRO C C 176.890 . . 62 3 25 PRO CA C 62.086 . . 63 3 25 PRO CB C 31.718 . . 64 4 26 LYS H H 8.416 . . 65 4 26 LYS C C 176.711 . . 66 4 26 LYS CA C 57.781 . . 67 4 26 LYS CB C 31.492 . . 68 4 26 LYS N N 117.953 . . 69 5 27 ASP H H 8.125 . . 70 5 27 ASP C C 176.306 . . 71 5 27 ASP CA C 52.487 . . 72 5 27 ASP CB C 39.115 . . 73 5 27 ASP N N 115.923 . . 74 6 28 PHE H H 8.010 . . 75 6 28 PHE C C 175.273 . . 76 6 28 PHE CA C 59.825 . . 77 6 28 PHE CB C 39.251 . . 78 6 28 PHE N N 123.726 . . 79 7 29 GLN H H 7.008 . . 80 7 29 GLN C C 172.612 . . 81 7 29 GLN CA C 54.399 . . 82 7 29 GLN CB C 30.266 . . 83 7 29 GLN N N 126.705 . . 84 8 30 TRP H H 6.298 . . 85 8 30 TRP C C 173.810 . . 86 8 30 TRP CA C 52.713 . . 87 8 30 TRP CB C 31.111 . . 88 8 30 TRP N N 117.171 . . 89 9 31 GLY C C 171.276 . . 90 9 31 GLY CA C 45.368 . . 91 10 32 PHE H H 6.739 . . 92 10 32 PHE C C 173.505 . . 93 10 32 PHE CA C 55.659 . . 94 10 32 PHE CB C 45.626 . . 95 10 32 PHE N N 116.914 . . 96 11 33 ALA H H 8.509 . . 97 11 33 ALA C C 176.729 . . 98 11 33 ALA CA C 49.822 . . 99 11 33 ALA CB C 24.067 . . 100 11 33 ALA N N 122.831 . . 101 12 34 THR H H 8.837 . . 102 12 34 THR C C 170.065 . . 103 12 34 THR CA C 61.071 . . 104 12 34 THR CB C 72.181 . . 105 12 34 THR N N 113.690 . . 106 13 35 ALA H H 6.208 . . 107 13 35 ALA C C 179.327 . . 108 13 35 ALA CA C 52.217 . . 109 13 35 ALA CB C 18.476 . . 110 13 35 ALA N N 118.169 . . 111 14 36 ALA H H 9.017 . . 112 14 36 ALA C C 179.443 . . 113 14 36 ALA CA C 56.216 . . 114 14 36 ALA CB C 17.504 . . 115 14 36 ALA N N 123.629 . . 116 15 37 TYR H H 8.973 . . 117 15 37 TYR C C 176.213 . . 118 15 37 TYR CA C 60.841 . . 119 15 37 TYR CB C 37.023 . . 120 15 37 TYR N N 117.306 . . 121 16 38 GLN H H 6.186 . . 122 16 38 GLN C C 176.588 . . 123 16 38 GLN CA C 57.984 . . 124 16 38 GLN CB C 28.139 . . 125 16 38 GLN N N 107.600 . . 126 17 39 ILE H H 6.729 . . 127 17 39 ILE HD1 H 0.631 . . 128 17 39 ILE C C 179.591 . . 129 17 39 ILE CA C 61.527 . . 130 17 39 ILE CB C 40.818 . . 131 17 39 ILE CG1 C 24.399 . . 132 17 39 ILE CD1 C 12.977 . . 133 17 39 ILE N N 102.531 . . 134 18 40 GLU H H 9.038 . . 135 18 40 GLU C C 177.464 . . 136 18 40 GLU CA C 60.630 . . 137 18 40 GLU CB C 29.863 . . 138 18 40 GLU N N 122.606 . . 139 19 41 GLY H H 8.464 . . 140 19 41 GLY C C 175.547 . . 141 19 41 GLY CA C 44.672 . . 142 19 41 GLY N N 106.490 . . 143 20 42 ALA H H 9.203 . . 144 20 42 ALA C C 180.984 . . 145 20 42 ALA CA C 52.147 . . 146 20 42 ALA CB C 18.233 . . 147 20 42 ALA N N 129.857 . . 148 21 43 VAL H H 7.307 . . 149 21 43 VAL HG1 H 0.753 . . 150 21 43 VAL HG2 H 0.860 . . 151 21 43 VAL C C 176.386 . . 152 21 43 VAL CA C 64.202 . . 153 21 43 VAL CB C 31.309 . . 154 21 43 VAL CG1 C 18.207 . . 155 21 43 VAL CG2 C 22.395 . . 156 21 43 VAL N N 110.653 . . 157 22 44 ASP H H 8.009 . . 158 22 44 ASP C C 175.702 . . 159 22 44 ASP CA C 51.133 . . 160 22 44 ASP CB C 40.183 . . 161 22 44 ASP N N 118.915 . . 162 23 45 GLN H H 6.556 . . 163 23 45 GLN C C 175.940 . . 164 23 45 GLN CA C 54.952 . . 165 23 45 GLN CB C 30.415 . . 166 23 45 GLN N N 121.614 . . 167 24 46 ASP H H 9.084 . . 168 24 46 ASP C C 176.004 . . 169 24 46 ASP CA C 54.330 . . 170 24 46 ASP CB C 38.602 . . 171 24 46 ASP N N 121.525 . . 172 25 47 GLY H H 8.300 . . 173 25 47 GLY C C 174.084 . . 174 25 47 GLY CA C 45.139 . . 175 25 47 GLY N N 103.671 . . 176 26 48 ARG H H 6.557 . . 177 26 48 ARG C C 176.974 . . 178 26 48 ARG CA C 57.455 . . 179 26 48 ARG CB C 28.112 . . 180 26 48 ARG N N 119.064 . . 181 27 49 GLY H H 7.943 . . 182 27 49 GLY C C 171.717 . . 183 27 49 GLY CA C 42.551 . . 184 27 49 GLY N N 112.738 . . 185 28 50 PRO C C 177.618 . . 186 28 50 PRO CA C 63.195 . . 187 28 50 PRO CB C 30.730 . . 188 29 51 SER H H 9.180 . . 189 29 51 SER C C 175.597 . . 190 29 51 SER CA C 56.551 . . 191 29 51 SER CB C 68.866 . . 192 29 51 SER N N 120.998 . . 193 30 52 ILE H H 8.996 . . 194 30 52 ILE HD1 H 0.414 . . 195 30 52 ILE C C 178.476 . . 196 30 52 ILE CA C 63.382 . . 197 30 52 ILE CB C 36.835 . . 198 30 52 ILE CG1 C 23.619 . . 199 30 52 ILE CD1 C 12.597 . . 200 30 52 ILE N N 112.734 . . 201 31 53 TRP H H 7.549 . . 202 31 53 TRP C C 176.969 . . 203 31 53 TRP CA C 61.900 . . 204 31 53 TRP CB C 27.415 . . 205 31 53 TRP N N 123.048 . . 206 32 54 ASP H H 7.404 . . 207 32 54 ASP C C 179.078 . . 208 32 54 ASP CA C 56.890 . . 209 32 54 ASP CB C 40.371 . . 210 32 54 ASP N N 120.965 . . 211 33 55 THR H H 7.417 . . 212 33 55 THR C C 177.508 . . 213 33 55 THR CA C 63.961 . . 214 33 55 THR CB C 67.414 . . 215 33 55 THR N N 112.212 . . 216 34 56 PHE H H 7.650 . . 217 34 56 PHE C C 176.975 . . 218 34 56 PHE CA C 61.133 . . 219 34 56 PHE CB C 40.031 . . 220 34 56 PHE N N 124.496 . . 221 35 57 CYS H H 7.758 . . 222 35 57 CYS C C 175.170 . . 223 35 57 CYS CA C 61.343 . . 224 35 57 CYS CB C 26.720 . . 225 35 57 CYS N N 110.542 . . 226 36 58 ALA H H 7.020 . . 227 36 58 ALA C C 177.213 . . 228 36 58 ALA CA C 51.767 . . 229 36 58 ALA CB C 17.586 . . 230 36 58 ALA N N 119.474 . . 231 37 59 GLN H H 7.287 . . 232 37 59 GLN C C 173.488 . . 233 37 59 GLN CA C 52.263 . . 234 37 59 GLN CB C 27.448 . . 235 37 59 GLN N N 120.612 . . 236 39 61 GLY C C 174.716 . . 237 39 61 GLY CA C 45.354 . . 238 40 62 LYS H H 6.941 . . 239 40 62 LYS C C 176.262 . . 240 40 62 LYS CA C 55.335 . . 241 40 62 LYS CB C 30.073 . . 242 40 62 LYS N N 118.150 . . 243 41 63 ILE H H 8.300 . . 244 41 63 ILE HD1 H 1.183 . . 245 41 63 ILE C C 180.091 . . 246 41 63 ILE CA C 57.596 . . 247 41 63 ILE CB C 35.627 . . 248 41 63 ILE CG1 C 26.221 . . 249 41 63 ILE CD1 C 9.752 . . 250 41 63 ILE N N 119.416 . . 251 42 64 ALA H H 8.879 . . 252 42 64 ALA C C 178.035 . . 253 42 64 ALA CA C 55.945 . . 254 42 64 ALA CB C 19.105 . . 255 42 64 ALA N N 131.567 . . 256 43 65 ASP H H 7.567 . . 257 43 65 ASP C C 178.227 . . 258 43 65 ASP CA C 51.974 . . 259 43 65 ASP CB C 39.954 . . 260 43 65 ASP N N 113.490 . . 261 44 66 GLY H H 8.139 . . 262 44 66 GLY C C 173.817 . . 263 44 66 GLY CA C 46.035 . . 264 44 66 GLY N N 107.609 . . 265 45 67 SER H H 7.438 . . 266 45 67 SER C C 172.862 . . 267 45 67 SER CA C 58.449 . . 268 45 67 SER CB C 64.370 . . 269 45 67 SER N N 115.934 . . 270 46 68 SER H H 8.263 . . 271 46 68 SER C C 174.464 . . 272 46 68 SER CA C 57.302 . . 273 46 68 SER CB C 66.370 . . 274 46 68 SER N N 109.188 . . 275 47 69 GLY H H 7.294 . . 276 47 69 GLY C C 172.396 . . 277 47 69 GLY CA C 43.864 . . 278 47 69 GLY N N 107.165 . . 279 48 70 VAL H H 7.337 . . 280 48 70 VAL HG1 H 0.757 . . 281 48 70 VAL HG2 H 0.778 . . 282 48 70 VAL CA C 65.132 . . 283 48 70 VAL CB C 30.543 . . 284 48 70 VAL CG1 C 20.071 . . 285 48 70 VAL CG2 C 21.751 . . 286 48 70 VAL N N 118.123 . . 287 50 72 ALA C C 176.063 . . 288 50 72 ALA CA C 52.937 . . 289 50 72 ALA CB C 15.487 . . 290 51 73 CYS H H 6.983 . . 291 51 73 CYS C C 175.497 . . 292 51 73 CYS CA C 56.975 . . 293 51 73 CYS CB C 26.822 . . 294 51 73 CYS N N 117.950 . . 295 52 74 ASP H H 9.132 . . 296 52 74 ASP C C 177.010 . . 297 52 74 ASP CA C 54.673 . . 298 52 74 ASP CB C 39.552 . . 299 52 74 ASP N N 123.032 . . 300 53 75 SER H H 7.957 . . 301 53 75 SER C C 176.733 . . 302 53 75 SER CA C 65.483 . . 303 53 75 SER CB C 61.273 . . 304 53 75 SER N N 114.177 . . 305 54 76 TYR H H 9.006 . . 306 54 76 TYR C C 175.700 . . 307 54 76 TYR CA C 61.620 . . 308 54 76 TYR CB C 39.310 . . 309 54 76 TYR N N 124.110 . . 310 55 77 ASN H H 6.951 . . 311 55 77 ASN C C 175.563 . . 312 55 77 ASN CA C 53.469 . . 313 55 77 ASN CB C 40.290 . . 314 55 77 ASN N N 109.935 . . 315 56 78 ARG H H 7.159 . . 316 56 78 ARG C C 175.618 . . 317 56 78 ARG CA C 54.384 . . 318 56 78 ARG CB C 29.671 . . 319 56 78 ARG N N 121.187 . . 320 57 79 THR H H 7.524 . . 321 57 79 THR C C 177.341 . . 322 57 79 THR CA C 64.309 . . 323 57 79 THR CB C 67.627 . . 324 57 79 THR N N 112.398 . . 325 58 80 ALA H H 7.884 . . 326 58 80 ALA C C 181.130 . . 327 58 80 ALA CA C 54.647 . . 328 58 80 ALA CB C 16.821 . . 329 58 80 ALA N N 122.226 . . 330 59 81 GLU H H 7.813 . . 331 59 81 GLU C C 179.462 . . 332 59 81 GLU CA C 58.702 . . 333 59 81 GLU CB C 28.327 . . 334 59 81 GLU N N 120.884 . . 335 60 82 ASP H H 8.026 . . 336 60 82 ASP C C 178.215 . . 337 60 82 ASP CA C 57.455 . . 338 60 82 ASP CB C 37.313 . . 339 60 82 ASP N N 124.299 . . 340 61 83 ILE H H 8.073 . . 341 61 83 ILE HD1 H 0.326 . . 342 61 83 ILE C C 177.022 . . 343 61 83 ILE CA C 65.928 . . 344 61 83 ILE CB C 36.334 . . 345 61 83 ILE CG1 C 29.460 . . 346 61 83 ILE CD1 C 13.809 . . 347 61 83 ILE N N 120.815 . . 348 62 84 ALA H H 7.790 . . 349 62 84 ALA C C 180.960 . . 350 62 84 ALA CA C 54.497 . . 351 62 84 ALA CB C 16.720 . . 352 62 84 ALA N N 121.640 . . 353 63 85 LEU H H 7.887 . . 354 63 85 LEU HD1 H 0.610 . . 355 63 85 LEU HD2 H 0.537 . . 356 63 85 LEU C C 178.699 . . 357 63 85 LEU CA C 57.276 . . 358 63 85 LEU CB C 40.379 . . 359 63 85 LEU CG C 26.588 . . 360 63 85 LEU CD1 C 21.696 . . 361 63 85 LEU CD2 C 25.740 . . 362 63 85 LEU N N 122.380 . . 363 65 87 LYS C C 180.952 . . 364 65 87 LYS CA C 58.190 . . 365 65 87 LYS CB C 31.161 . . 366 66 88 SER H H 8.304 . . 367 66 88 SER C C 175.925 . . 368 66 88 SER CA C 60.881 . . 369 66 88 SER CB C 62.143 . . 370 66 88 SER N N 117.759 . . 371 67 89 LEU H H 7.568 . . 372 67 89 LEU HG H 0.528 . . 373 67 89 LEU HD1 H 0.529 . . 374 67 89 LEU HD2 H 0.189 . . 375 67 89 LEU C C 177.159 . . 376 67 89 LEU CA C 54.373 . . 377 67 89 LEU CB C 41.081 . . 378 67 89 LEU CG C 25.292 . . 379 67 89 LEU CD1 C 21.533 . . 380 67 89 LEU CD2 C 25.164 . . 381 67 89 LEU N N 119.677 . . 382 68 90 GLY H H 7.627 . . 383 68 90 GLY C C 173.255 . . 384 68 90 GLY CA C 45.129 . . 385 68 90 GLY N N 105.949 . . 386 69 91 ALA H H 6.950 . . 387 69 91 ALA C C 176.394 . . 388 69 91 ALA CA C 52.028 . . 389 69 91 ALA CB C 18.434 . . 390 69 91 ALA N N 118.469 . . 391 70 92 LYS H H 6.366 . . 392 70 92 LYS C C 176.953 . . 393 70 92 LYS CA C 55.955 . . 394 70 92 LYS CB C 32.233 . . 395 70 92 LYS N N 117.880 . . 396 71 93 SER H H 7.358 . . 397 71 93 SER C C 171.826 . . 398 71 93 SER CA C 56.692 . . 399 71 93 SER CB C 65.903 . . 400 71 93 SER N N 113.300 . . 401 72 94 TYR H H 8.322 . . 402 72 94 TYR C C 172.141 . . 403 72 94 TYR N N 121.746 . . 404 74 96 PHE C C 172.697 . . 405 74 96 PHE CA C 53.484 . . 406 74 96 PHE CB C 39.125 . . 407 75 97 SER H H 9.013 . . 408 75 97 SER C C 172.158 . . 409 75 97 SER CA C 55.013 . . 410 75 97 SER CB C 67.909 . . 411 75 97 SER N N 116.339 . . 412 76 98 ILE H H 7.409 . . 413 76 98 ILE HD1 H 0.106 . . 414 76 98 ILE C C 176.358 . . 415 76 98 ILE CA C 57.164 . . 416 76 98 ILE CB C 37.501 . . 417 76 98 ILE CG1 C 26.013 . . 418 76 98 ILE CD1 C 10.877 . . 419 76 98 ILE N N 118.956 . . 420 77 99 SER H H 7.101 . . 421 77 99 SER C C 175.121 . . 422 77 99 SER CA C 56.076 . . 423 77 99 SER CB C 61.952 . . 424 77 99 SER N N 119.056 . . 425 78 100 TRP H H 8.810 . . 426 78 100 TRP C C 180.228 . . 427 78 100 TRP CA C 58.362 . . 428 78 100 TRP CB C 29.954 . . 429 78 100 TRP N N 137.9 . . 430 79 101 SER H H 9.732 . . 431 79 101 SER C C 176.803 . . 432 79 101 SER CA C 59.834 . . 433 79 101 SER CB C 61.555 . . 434 79 101 SER N N 112.312 . . 435 80 102 ARG H H 8.320 . . 436 80 102 ARG C C 175.654 . . 437 80 102 ARG CA C 59.912 . . 438 80 102 ARG CB C 29.620 . . 439 80 102 ARG N N 120.374 . . 440 83 105 PRO C C 177.930 . . 441 83 105 PRO CA C 66.355 . . 442 83 105 PRO CB C 31.655 . . 443 84 106 GLU H H 8.911 . . 444 84 106 GLU C C 177.100 . . 445 84 106 GLU CA C 57.634 . . 446 84 106 GLU CB C 29.994 . . 447 84 106 GLU N N 114.357 . . 448 85 107 GLY H H 6.670 . . 449 85 107 GLY C C 176.479 . . 450 85 107 GLY CA C 45.687 . . 451 85 107 GLY N N 100.181 . . 452 86 108 GLY H H 9.399 . . 453 86 108 GLY C C 174.826 . . 454 86 108 GLY CA C 45.813 . . 455 86 108 GLY N N 112.665 . . 456 87 109 ARG H H 8.583 . . 457 87 109 ARG C C 176.902 . . 458 87 109 ARG CA C 57.330 . . 459 87 109 ARG CB C 27.809 . . 460 87 109 ARG N N 119.330 . . 461 88 110 GLY H H 8.986 . . 462 88 110 GLY C C 174.112 . . 463 88 110 GLY CA C 43.484 . . 464 88 110 GLY N N 110.591 . . 465 89 111 ASP H H 7.205 . . 466 89 111 ASP C C 175.070 . . 467 89 111 ASP CA C 53.430 . . 468 89 111 ASP CB C 41.991 . . 469 89 111 ASP N N 121.682 . . 470 90 112 ALA H H 8.112 . . 471 90 112 ALA C C 177.828 . . 472 90 112 ALA CA C 52.413 . . 473 90 112 ALA CB C 18.314 . . 474 90 112 ALA N N 122.802 . . 475 91 113 VAL H H 8.124 . . 476 91 113 VAL HG1 H 0.892 . . 477 91 113 VAL HG2 H 0.856 . . 478 91 113 VAL C C 176.075 . . 479 91 113 VAL CA C 61.223 . . 480 91 113 VAL CB C 32.246 . . 481 91 113 VAL CG1 C 21.146 . . 482 91 113 VAL CG2 C 21.414 . . 483 91 113 VAL N N 120.297 . . 484 92 114 ASN H H 9.175 . . 485 92 114 ASN C C 174.725 . . 486 92 114 ASN CA C 51.000 . . 487 92 114 ASN CB C 38.260 . . 488 92 114 ASN N N 126.303 . . 489 93 115 GLN C C 176.988 . . 490 93 115 GLN CA C 58.056 . . 491 93 115 GLN CB C 27.362 . . 492 94 116 ALA H H 8.066 . . 493 94 116 ALA C C 181.381 . . 494 94 116 ALA CA C 54.724 . . 495 94 116 ALA CB C 17.508 . . 496 94 116 ALA N N 118.317 . . 497 95 117 GLY H H 7.469 . . 498 95 117 GLY C C 174.954 . . 499 95 117 GLY CA C 46.415 . . 500 95 117 GLY N N 107.196 . . 501 96 118 ILE H H 7.097 . . 502 96 118 ILE HD1 H 0.692 . . 503 96 118 ILE C C 178.052 . . 504 96 118 ILE CA C 66.272 . . 505 96 118 ILE CB C 37.375 . . 506 96 118 ILE CG1 C 29.654 . . 507 96 118 ILE CD1 C 13.197 . . 508 96 118 ILE N N 121.677 . . 509 97 119 ASP H H 8.919 . . 510 97 119 ASP C C 178.963 . . 511 97 119 ASP CA C 56.949 . . 512 97 119 ASP CB C 39.414 . . 513 97 119 ASP N N 118.390 . . 514 98 120 HIS H H 7.577 . . 515 98 120 HIS C C 178.104 . . 516 98 120 HIS CA C 59.825 . . 517 98 120 HIS CB C 28.916 . . 518 98 120 HIS N N 118.290 . . 519 107 129 LEU HD1 H 0.697 . . 520 107 129 LEU HD2 H 0.800 . . 521 107 129 LEU C C 182.960 . . 522 107 129 LEU CA C 57.389 . . 523 107 129 LEU CB C 40.334 . . 524 107 129 LEU CG C 26.803 . . 525 107 129 LEU CD1 C 26.962 . . 526 107 129 LEU CD2 C 22.810 . . 527 108 130 ASP H H 8.379 . . 528 108 130 ASP C C 177.503 . . 529 108 130 ASP CA C 56.700 . . 530 108 130 ASP CB C 40.054 . . 531 108 130 ASP N N 123.071 . . 532 109 131 ALA H H 7.188 . . 533 109 131 ALA C C 176.733 . . 534 109 131 ALA CA C 51.517 . . 535 109 131 ALA CB C 18.264 . . 536 109 131 ALA N N 120.466 . . 537 110 132 GLY H H 7.776 . . 538 110 132 GLY C C 174.202 . . 539 110 132 GLY CA C 45.142 . . 540 110 132 GLY N N 107.600 . . 541 111 133 ILE H H 7.874 . . 542 111 133 ILE HD1 H 0.380 . . 543 111 133 ILE C C 174.020 . . 544 111 133 ILE CA C 59.319 . . 545 111 133 ILE CB C 38.266 . . 546 111 133 ILE CG1 C 25.945 . . 547 111 133 ILE CD1 C 14.606 . . 548 111 133 ILE N N 123.710 . . 549 112 134 THR H H 8.394 . . 550 112 134 THR C C 174.166 . . 551 112 134 THR CA C 61.219 . . 552 112 134 THR CB C 69.499 . . 553 112 134 THR N N 123.625 . . 554 123 145 PRO C C 176.076 . . 555 123 145 PRO CA C 63.851 . . 556 123 145 PRO CB C 30.727 . . 557 124 146 GLU H H 8.881 . . 558 124 146 GLU C C 178.390 . . 559 124 146 GLU CA C 57.802 . . 560 124 146 GLU CB C 28.755 . . 561 124 146 GLU N N 130.312 . . 562 125 147 GLY H H 8.619 . . 563 125 147 GLY C C 176.573 . . 564 125 147 GLY CA C 46.717 . . 565 125 147 GLY N N 104.040 . . 566 126 148 LEU H H 6.519 . . 567 126 148 LEU HD1 H 0.548 . . 568 126 148 LEU HD2 H 0.535 . . 569 126 148 LEU C C 180.214 . . 570 126 148 LEU CA C 56.197 . . 571 126 148 LEU CB C 40.102 . . 572 126 148 LEU CG C 26.076 . . 573 126 148 LEU CD1 C 20.094 . . 574 126 148 LEU CD2 C 24.792 . . 575 126 148 LEU N N 116.994 . . 576 127 149 HIS H H 6.815 . . 577 127 149 HIS C C 177.896 . . 578 127 149 HIS CA C 60.199 . . 579 127 149 HIS CB C 30.896 . . 580 127 149 HIS N N 120.707 . . 581 128 150 GLN H H 8.176 . . 582 128 150 GLN C C 177.641 . . 583 128 150 GLN CA C 57.342 . . 584 128 150 GLN CB C 27.563 . . 585 128 150 GLN N N 116.015 . . 586 129 151 ARG H H 7.593 . . 587 129 151 ARG C C 178.132 . . 588 129 151 ARG CA C 59.209 . . 589 129 151 ARG CB C 30.759 . . 590 129 151 ARG N N 118.613 . . 591 130 152 TYR H H 6.559 . . 592 130 152 TYR C C 176.734 . . 593 130 152 TYR CA C 55.660 . . 594 130 152 TYR CB C 36.523 . . 595 130 152 TYR N N 108.336 . . 596 131 153 GLY H H 7.262 . . 597 131 153 GLY C C 176.763 . . 598 131 153 GLY CA C 45.022 . . 599 131 153 GLY N N 110.897 . . 600 132 154 GLY H H 7.607 . . 601 132 154 GLY C C 173.020 . . 602 132 154 GLY CA C 46.651 . . 603 132 154 GLY N N 113.701 . . 604 133 155 LEU H H 6.812 . . 605 133 155 LEU HD1 H -0.387 . . 606 133 155 LEU HD2 H 0.864 . . 607 133 155 LEU C C 175.326 . . 608 133 155 LEU CA C 56.076 . . 609 133 155 LEU CB C 41.277 . . 610 133 155 LEU CG C 26.454 . . 611 133 155 LEU CD1 C 23.160 . . 612 133 155 LEU CD2 C 24.997 . . 613 133 155 LEU N N 124.417 . . 614 134 156 LEU H H 7.334 . . 615 134 156 LEU HD1 H 0.554 . . 616 134 156 LEU HD2 H 0.851 . . 617 134 156 LEU C C 176.716 . . 618 134 156 LEU CA C 55.481 . . 619 134 156 LEU CB C 41.559 . . 620 134 156 LEU CG C 25.971 . . 621 134 156 LEU CD1 C 22.704 . . 622 134 156 LEU CD2 C 23.869 . . 623 134 156 LEU N N 114.667 . . 624 135 157 ASN H H 7.413 . . 625 135 157 ASN C C 173.396 . . 626 135 157 ASN CA C 53.881 . . 627 135 157 ASN CB C 41.105 . . 628 135 157 ASN N N 119.861 . . 629 136 158 ARG H H 8.409 . . 630 136 158 ARG C C 175.419 . . 631 136 158 ARG CA C 57.467 . . 632 136 158 ARG CB C 32.473 . . 633 136 158 ARG N N 129.215 . . 634 137 159 THR H H 7.648 . . 635 137 159 THR C C 176.234 . . 636 137 159 THR CA C 63.051 . . 637 137 159 THR CB C 68.845 . . 638 137 159 THR N N 109.943 . . 639 138 160 GLU H H 8.029 . . 640 138 160 GLU C C 177.779 . . 641 138 160 GLU CA C 57.467 . . 642 138 160 GLU CB C 28.118 . . 643 138 160 GLU N N 118.561 . . 644 155 177 PRO C C 178.560 . . 645 155 177 PRO CA C 64.154 . . 646 155 177 PRO CB C 31.018 . . 647 156 178 LYS H H 7.993 . . 648 156 178 LYS C C 177.455 . . 649 156 178 LYS CA C 57.468 . . 650 156 178 LYS CB C 32.501 . . 651 156 178 LYS N N 116.030 . . 652 157 179 VAL H H 7.653 . . 653 157 179 VAL HG1 H -0.679 . . 654 157 179 VAL HG2 H 0.620 . . 655 157 179 VAL C C 175.395 . . 656 157 179 VAL CA C 63.117 . . 657 157 179 VAL CB C 30.491 . . 658 157 179 VAL CG1 C 19.238 . . 659 157 179 VAL CG2 C 25.283 . . 660 157 179 VAL N N 121.101 . . 661 166 188 PRO C C 176.873 . . 662 166 188 PRO CA C 64.036 . . 663 167 189 LEU H H 8.203 . . 664 167 189 LEU HD1 H 0.628 . . 665 167 189 LEU HD2 H 1.441 . . 666 167 189 LEU C C 179.011 . . 667 167 189 LEU CA C 60.106 . . 668 167 189 LEU CB C 42.334 . . 669 167 189 LEU CG C 27.093 . . 670 167 189 LEU CD1 C 25.526 . . 671 167 189 LEU CD2 C 28.770 . . 672 167 189 LEU N N 118.628 . . 673 168 190 CYS H H 7.491 . . 674 168 190 CYS C C 175.954 . . 675 168 190 CYS CA C 59.861 . . 676 168 190 CYS CB C 28.215 . . 677 168 190 CYS N N 116.665 . . 678 169 191 SER H H 6.575 . . 679 169 191 SER C C 175.321 . . 680 169 191 SER CA C 61.850 . . 681 169 191 SER CB C 62.492 . . 682 169 191 SER N N 113.078 . . 683 170 192 ALA H H 7.543 . . 684 170 192 ALA C C 178.108 . . 685 170 192 ALA CA C 55.283 . . 686 170 192 ALA CB C 20.151 . . 687 170 192 ALA N N 121.649 . . 688 171 193 ILE H H 8.899 . . 689 171 193 ILE HD1 H 0.824 . . 690 171 193 ILE C C 175.805 . . 691 171 193 ILE CA C 66.861 . . 692 171 193 ILE CB C 34.526 . . 693 171 193 ILE CG1 C 29.047 . . 694 171 193 ILE CD1 C 14.068 . . 695 171 193 ILE N N 116.462 . . 696 172 194 PRO C C 179.048 . . 697 173 195 GLY H H 5.826 . . 698 173 195 GLY C C 172.822 . . 699 173 195 GLY CA C 46.581 . . 700 173 195 GLY N N 98.228 . . 701 174 196 TYR H H 6.776 . . 702 174 196 TYR C C 173.737 . . 703 174 196 TYR CA C 58.558 . . 704 174 196 TYR CB C 37.230 . . 705 174 196 TYR N N 113.666 . . 706 175 197 GLY H H 8.384 . . 707 175 197 GLY C C 174.602 . . 708 175 197 GLY CA C 45.506 . . 709 175 197 GLY N N 109.140 . . 710 176 198 SER H H 7.932 . . 711 176 198 SER C C 176.174 . . 712 176 198 SER CA C 57.321 . . 713 176 198 SER CB C 63.571 . . 714 176 198 SER N N 113.996 . . 715 177 199 GLY H H 6.983 . . 716 177 199 GLY C C 174.030 . . 717 177 199 GLY CA C 47.074 . . 718 177 199 GLY N N 113.537 . . 719 178 200 THR H H 7.717 . . 720 178 200 THR C C 174.667 . . 721 178 200 THR CA C 62.604 . . 722 178 200 THR CB C 68.553 . . 723 178 200 THR N N 111.567 . . 724 179 201 PHE H H 7.013 . . 725 179 201 PHE C C 173.897 . . 726 179 201 PHE CA C 50.379 . . 727 179 201 PHE CB C 40.707 . . 728 179 201 PHE N N 118.596 . . 729 181 203 PRO C C 175.414 . . 730 181 203 PRO CA C 63.020 . . 731 181 203 PRO CB C 32.257 . . 732 182 204 GLY H H 8.629 . . 733 182 204 GLY C C 174.831 . . 734 182 204 GLY CA C 46.931 . . 735 182 204 GLY N N 117.371 . . 736 183 205 ARG H H 7.652 . . 737 183 205 ARG C C 172.518 . . 738 183 205 ARG CA C 55.661 . . 739 183 205 ARG CB C 31.876 . . 740 183 205 ARG N N 123.197 . . 741 184 206 GLN H H 7.497 . . 742 184 206 GLN C C 175.956 . . 743 184 206 GLN CA C 53.625 . . 744 184 206 GLN CB C 30.763 . . 745 184 206 GLN N N 114.531 . . 746 185 207 SER H H 8.428 . . 747 185 207 SER C C 174.723 . . 748 185 207 SER CA C 56.031 . . 749 185 207 SER CB C 63.026 . . 750 185 207 SER N N 119.011 . . 751 189 211 PRO C C 176.444 . . 752 189 211 PRO CA C 66.284 . . 753 189 211 PRO CB C 29.656 . . 754 190 212 TRP H H 6.040 . . 755 190 212 TRP C C 180.122 . . 756 190 212 TRP CA C 55.628 . . 757 190 212 TRP CB C 28.761 . . 758 190 212 TRP N N 114.968 . . 759 191 213 THR H H 7.424 . . 760 191 213 THR C C 175.483 . . 761 191 213 THR CA C 66.340 . . 762 191 213 THR CB C 68.487 . . 763 191 213 THR N N 118.295 . . 764 192 214 VAL H H 8.119 . . 765 192 214 VAL HG1 H -0.418 . . 766 192 214 VAL HG2 H 0.263 . . 767 192 214 VAL C C 177.849 . . 768 192 214 VAL CA C 66.410 . . 769 192 214 VAL CB C 30.420 . . 770 192 214 VAL CG1 C 20.964 . . 771 192 214 VAL CG2 C 20.302 . . 772 192 214 VAL N N 122.063 . . 773 216 238 GLY C C 174.113 . . 774 216 238 GLY CA C 45.732 . . 775 217 239 ASP H H 8.244 . . 776 217 239 ASP C C 175.732 . . 777 217 239 ASP CA C 52.998 . . 778 217 239 ASP CB C 39.780 . . 779 217 239 ASP N N 120.533 . . 780 218 240 GLY H H 8.083 . . 781 218 240 GLY C C 173.339 . . 782 218 240 GLY CA C 45.236 . . 783 218 240 GLY N N 108.873 . . 784 223 245 VAL HG1 H 0.467 . . 785 223 245 VAL HG2 H 0.819 . . 786 223 245 VAL C C 174.400 . . 787 223 245 VAL CA C 60.439 . . 788 223 245 VAL CB C 32.464 . . 789 223 245 VAL CG1 C 22.229 . . 790 223 245 VAL CG2 C 24.408 . . 791 224 246 LEU H H 8.274 . . 792 224 246 LEU HD1 H 0.818 . . 793 224 246 LEU HD2 H 0.487 . . 794 224 246 LEU C C 178.508 . . 795 224 246 LEU CA C 52.422 . . 796 224 246 LEU CB C 42.097 . . 797 224 246 LEU CG C 26.364 . . 798 224 246 LEU CD1 C 22.825 . . 799 224 246 LEU CD2 C 22.962 . . 800 224 246 LEU N N 127.150 . . 801 225 247 ASN H H 8.500 . . 802 225 247 ASN C C 174.585 . . 803 225 247 ASN CA C 50.862 . . 804 225 247 ASN CB C 35.778 . . 805 225 247 ASN N N 119.682 . . 806 226 248 GLY H H 7.810 . . 807 226 248 GLY C C 170.503 . . 808 226 248 GLY CA C 47.567 . . 809 226 248 GLY N N 108.356 . . 810 227 249 ASP H H 5.786 . . 811 227 249 ASP C C 175.965 . . 812 227 249 ASP CA C 53.956 . . 813 227 249 ASP CB C 43.031 . . 814 227 249 ASP N N 133.402 . . 815 228 250 PHE H H 8.482 . . 816 228 250 PHE C C 173.797 . . 817 228 250 PHE CA C 59.915 . . 818 228 250 PHE CB C 39.323 . . 819 228 250 PHE N N 121.245 . . 820 231 253 PRO C C 176.276 . . 821 231 253 PRO CA C 62.346 . . 822 231 253 PRO CB C 31.515 . . 823 232 254 TRP H H 8.893 . . 824 232 254 TRP C C 175.601 . . 825 232 254 TRP CA C 63.586 . . 826 232 254 TRP CB C 27.968 . . 827 232 254 TRP N N 126.602 . . 828 233 255 ASP H H 9.394 . . 829 233 255 ASP C C 177.373 . . 830 233 255 ASP CA C 51.678 . . 831 233 255 ASP CB C 40.574 . . 832 233 255 ASP N N 118.458 . . 833 234 256 ALA H H 8.437 . . 834 234 256 ALA C C 177.476 . . 835 234 256 ALA CA C 53.717 . . 836 234 256 ALA CB C 17.343 . . 837 234 256 ALA N N 125.496 . . 838 235 257 ALA H H 8.017 . . 839 235 257 ALA C C 177.153 . . 840 235 257 ALA CA C 51.201 . . 841 235 257 ALA CB C 18.505 . . 842 235 257 ALA N N 118.241 . . 843 236 258 ASP H H 7.768 . . 844 236 258 ASP C C 176.145 . . 845 236 258 ASP CA C 50.383 . . 846 236 258 ASP CB C 41.838 . . 847 236 258 ASP N N 121.995 . . 848 237 259 PRO C C 179.081 . . 849 237 259 PRO CA C 64.472 . . 850 237 259 PRO CB C 31.293 . . 851 238 260 ALA H H 8.399 . . 852 238 260 ALA C C 181.804 . . 853 238 260 ALA CA C 54.218 . . 854 238 260 ALA CB C 14.999 . . 855 238 260 ALA N N 120.595 . . 856 239 261 ASP H H 7.709 . . 857 239 261 ASP C C 178.839 . . 858 239 261 ASP CA C 57.007 . . 859 239 261 ASP CB C 39.764 . . 860 239 261 ASP N N 121.739 . . 861 240 262 LYS H H 7.386 . . 862 240 262 LYS C C 179.228 . . 863 240 262 LYS CA C 59.868 . . 864 240 262 LYS CB C 30.771 . . 865 240 262 LYS N N 123.354 . . 866 241 263 GLU H H 7.832 . . 867 241 263 GLU C C 178.720 . . 868 241 263 GLU CA C 58.594 . . 869 241 263 GLU CB C 28.441 . . 870 241 263 GLU N N 119.627 . . 871 242 264 ALA C C 178.226 . . 872 242 264 ALA CA C 54.566 . . 873 242 264 ALA CB C 17.728 . . 874 243 265 ALA H H 8.299 . . 875 243 265 ALA C C 180.457 . . 876 243 265 ALA CA C 55.334 . . 877 243 265 ALA CB C 15.446 . . 878 243 265 ALA N N 121.117 . . 879 244 266 GLU H H 7.326 . . 880 244 266 GLU C C 178.321 . . 881 244 266 GLU CA C 58.703 . . 882 244 266 GLU CB C 28.403 . . 883 244 266 GLU N N 121.392 . . 884 260 282 LEU HD1 H 0.937 . . 885 260 282 LEU HD2 H 0.918 . . 886 260 282 LEU C C 178.486 . . 887 260 282 LEU CA C 54.869 . . 888 260 282 LEU CB C 41.976 . . 889 260 282 LEU CG C 27.271 . . 890 260 282 LEU CD1 C 22.223 . . 891 260 282 LEU CD2 C 25.579 . . 892 261 283 GLY H H 7.398 . . 893 261 283 GLY C C 171.780 . . 894 261 283 GLY CA C 44.505 . . 895 261 283 GLY N N 108.189 . . 896 262 284 ASP H H 6.876 . . 897 262 284 ASP C C 174.491 . . 898 262 284 ASP CA C 51.533 . . 899 262 284 ASP CB C 43.393 . . 900 262 284 ASP N N 116.928 . . 901 263 285 TYR H H 8.986 . . 902 263 285 TYR C C 173.489 . . 903 263 285 TYR CA C 57.600 . . 904 263 285 TYR CB C 37.624 . . 905 263 285 TYR N N 118.388 . . 906 266 288 SER C C 177.867 . . 907 267 289 MET H H 6.577 . . 908 267 289 MET C C 177.115 . . 909 267 289 MET CA C 58.463 . . 910 267 289 MET CB C 32.462 . . 911 267 289 MET N N 122.319 . . 912 268 290 ARG H H 6.969 . . 913 268 290 ARG C C 179.111 . . 914 268 290 ARG CA C 58.626 . . 915 268 290 ARG CB C 27.056 . . 916 268 290 ARG N N 119.738 . . 917 269 291 LYS H H 8.116 . . 918 269 291 LYS C C 177.623 . . 919 269 291 LYS CA C 58.638 . . 920 269 291 LYS CB C 31.488 . . 921 269 291 LYS N N 118.507 . . 922 270 292 GLN H H 6.876 . . 923 270 292 GLN C C 177.321 . . 924 270 292 GLN CA C 58.385 . . 925 270 292 GLN CB C 29.934 . . 926 270 292 GLN N N 115.729 . . 927 271 293 LEU H H 8.108 . . 928 271 293 LEU HD1 H -1.243 . . 929 271 293 LEU HD2 H -0.003 . . 930 271 293 LEU C C 178.581 . . 931 271 293 LEU CA C 55.124 . . 932 271 293 LEU CB C 41.928 . . 933 271 293 LEU CG C 25.896 . . 934 271 293 LEU CD1 C 23.844 . . 935 271 293 LEU CD2 C 20.280 . . 936 271 293 LEU N N 115.213 . . 937 272 294 GLY H H 7.659 . . 938 272 294 GLY C C 175.704 . . 939 272 294 GLY CA C 46.339 . . 940 272 294 GLY N N 108.979 . . 941 273 295 ASP C C 176.841 . . 942 273 295 ASP CA C 54.959 . . 943 273 295 ASP CB C 39.335 . . 944 274 296 ARG H H 7.539 . . 945 274 296 ARG C C 175.967 . . 946 274 296 ARG CA C 57.503 . . 947 274 296 ARG CB C 30.332 . . 948 274 296 ARG N N 117.811 . . 949 275 297 LEU H H 7.132 . . 950 275 297 LEU HD1 H -0.110 . . 951 275 297 LEU HD2 H -0.155 . . 952 275 297 LEU C C 174.011 . . 953 275 297 LEU CA C 50.315 . . 954 275 297 LEU CB C 42.263 . . 955 275 297 LEU CG C 24.962 . . 956 275 297 LEU CD1 C 25.638 . . 957 275 297 LEU CD2 C 23.159 . . 958 275 297 LEU N N 121.944 . . 959 276 298 PRO C C 174.305 . . 960 276 298 PRO CA C 62.469 . . 961 276 298 PRO CB C 29.907 . . 962 277 299 THR H H 8.017 . . 963 277 299 THR C C 175.480 . . 964 277 299 THR CA C 60.257 . . 965 277 299 THR CB C 70.201 . . 966 277 299 THR N N 115.088 . . 967 278 300 PHE H H 8.735 . . 968 278 300 PHE C C 177.811 . . 969 278 300 PHE CA C 59.692 . . 970 278 300 PHE CB C 38.407 . . 971 278 300 PHE N N 124.106 . . 972 279 301 THR H H 8.281 . . 973 279 301 THR C C 173.496 . . 974 279 301 THR CA C 59.874 . . 975 279 301 THR CB C 67.166 . . 976 279 301 THR N N 116.285 . . 977 280 302 PRO C C 179.940 . . 978 280 302 PRO CA C 65.828 . . 979 280 302 PRO CB C 30.669 . . 980 281 303 GLU H H 8.554 . . 981 281 303 GLU C C 179.361 . . 982 281 303 GLU CA C 59.293 . . 983 281 303 GLU CB C 28.363 . . 984 281 303 GLU N N 117.804 . . 985 282 304 GLU H H 7.724 . . 986 282 304 GLU C C 179.045 . . 987 282 304 GLU CA C 58.713 . . 988 282 304 GLU CB C 30.524 . . 989 282 304 GLU N N 118.938 . . 990 283 305 ARG H H 8.905 . . 991 283 305 ARG C C 177.174 . . 992 283 305 ARG CA C 59.297 . . 993 283 305 ARG CB C 28.790 . . 994 283 305 ARG N N 120.364 . . 995 284 306 ALA H H 7.484 . . 996 284 306 ALA C C 179.904 . . 997 284 306 ALA CA C 53.561 . . 998 284 306 ALA CB C 17.088 . . 999 284 306 ALA N N 117.451 . . 1000 285 307 LEU H H 7.031 . . 1001 285 307 LEU HD1 H 0.595 . . 1002 285 307 LEU HD2 H 0.725 . . 1003 285 307 LEU C C 177.469 . . 1004 285 307 LEU CA C 55.621 . . 1005 285 307 LEU CB C 42.921 . . 1006 285 307 LEU CG C 25.531 . . 1007 285 307 LEU CD1 C 23.235 . . 1008 285 307 LEU CD2 C 24.635 . . 1009 285 307 LEU N N 115.575 . . 1010 286 308 VAL C C 177.743 . . 1011 286 308 VAL CA C 64.902 . . 1012 286 308 VAL CB C 32.278 . . 1013 287 309 HIS H H 8.686 . . 1014 287 309 HIS C C 177.016 . . 1015 287 309 HIS CA C 55.769 . . 1016 287 309 HIS CB C 30.403 . . 1017 287 309 HIS N N 124.397 . . 1018 288 310 GLY H H 10.242 . . 1019 288 310 GLY C C 178.078 . . 1020 288 310 GLY CA C 45.038 . . 1021 288 310 GLY N N 119.080 . . 1022 289 311 SER H H 7.327 . . 1023 289 311 SER C C 170.842 . . 1024 289 311 SER CA C 59.953 . . 1025 289 311 SER CB C 62.155 . . 1026 289 311 SER N N 115.169 . . 1027 290 312 ASN H H 7.649 . . 1028 290 312 ASN C C 178.664 . . 1029 290 312 ASN CA C 49.547 . . 1030 290 312 ASN CB C 40.163 . . 1031 290 312 ASN N N 119.617 . . 1032 291 313 ASP H H 9.071 . . 1033 291 313 ASP C C 175.880 . . 1034 291 313 ASP CA C 56.341 . . 1035 291 313 ASP CB C 40.352 . . 1036 291 313 ASP N N 125.772 . . 1037 293 315 TYR C C 174.539 . . 1038 293 315 TYR CA C 61.526 . . 1039 293 315 TYR CB C 37.931 . . 1040 294 316 GLY H H 7.045 . . 1041 294 316 GLY C C 170.253 . . 1042 294 316 GLY CA C 44.991 . . 1043 294 316 GLY N N 102.877 . . 1044 295 317 MET H H 9.462 . . 1045 295 317 MET C C 173.569 . . 1046 295 317 MET CA C 54.266 . . 1047 295 317 MET CB C 37.364 . . 1048 295 317 MET N N 130.779 . . 1049 296 318 ASN H H 8.363 . . 1050 296 318 ASN C C 175.050 . . 1051 296 318 ASN CA C 49.914 . . 1052 296 318 ASN CB C 37.729 . . 1053 296 318 ASN N N 127.783 . . 1054 297 319 HIS H H 7.818 . . 1055 297 319 HIS C C 172.041 . . 1056 297 319 HIS CA C 56.908 . . 1057 297 319 HIS CB C 32.318 . . 1058 297 319 HIS N N 120.592 . . 1059 298 320 TYR C C 175.799 . . 1060 298 320 TYR CA C 59.893 . . 1061 298 320 TYR CB C 44.025 . . 1062 299 321 THR H H 8.383 . . 1063 299 321 THR C C 172.533 . . 1064 299 321 THR CA C 60.716 . . 1065 299 321 THR CB C 69.082 . . 1066 299 321 THR N N 119.506 . . 1067 300 322 SER H H 8.892 . . 1068 300 322 SER C C 170.779 . . 1069 300 322 SER CA C 57.709 . . 1070 300 322 SER CB C 69.343 . . 1071 300 322 SER N N 114.832 . . 1072 301 323 ASN H H 8.297 . . 1073 301 323 ASN C C 174.253 . . 1074 301 323 ASN CA C 53.107 . . 1075 301 323 ASN CB C 43.865 . . 1076 301 323 ASN N N 113.358 . . 1077 302 324 TYR H H 8.097 . . 1078 302 324 TYR C C 174.875 . . 1079 302 324 TYR CA C 57.385 . . 1080 302 324 TYR CB C 39.923 . . 1081 302 324 TYR N N 116.987 . . 1082 303 325 ILE H H 8.996 . . 1083 303 325 ILE HG12 H 0.709 . . 1084 303 325 ILE HG13 H 0.709 . . 1085 303 325 ILE HD1 H 0.710 . . 1086 303 325 ILE C C 174.033 . . 1087 303 325 ILE CA C 56.434 . . 1088 303 325 ILE CB C 36.759 . . 1089 303 325 ILE CG1 C 27.772 . . 1090 303 325 ILE CD1 C 11.566 . . 1091 303 325 ILE N N 120.860 . . 1092 304 326 ARG H H 8.384 . . 1093 304 326 ARG C C 175.065 . . 1094 304 326 ARG CA C 52.821 . . 1095 304 326 ARG CB C 34.489 . . 1096 304 326 ARG N N 130.710 . . 1097 305 327 HIS H H 9.304 . . 1098 305 327 HIS C C 173.074 . . 1099 305 327 HIS CA C 56.386 . . 1100 305 327 HIS CB C 28.086 . . 1101 305 327 HIS N N 125.449 . . 1102 312 334 ALA C C 177.416 . . 1103 312 334 ALA CA C 54.656 . . 1104 312 334 ALA CB C 17.236 . . 1105 313 335 ASP H H 7.975 . . 1106 313 335 ASP C C 175.556 . . 1107 313 335 ASP CA C 52.755 . . 1108 313 335 ASP CB C 39.482 . . 1109 313 335 ASP N N 112.169 . . 1110 314 336 ASP H H 7.117 . . 1111 314 336 ASP C C 177.898 . . 1112 314 336 ASP CA C 55.834 . . 1113 314 336 ASP CB C 42.614 . . 1114 314 336 ASP N N 121.295 . . 1115 315 337 THR C C 173.990 . . 1116 315 337 THR CA C 60.639 . . 1117 316 338 VAL H H 7.266 . . 1118 316 338 VAL HG2 H 0.725 . . 1119 316 338 VAL C C 173.675 . . 1120 316 338 VAL CA C 60.682 . . 1121 316 338 VAL CB C 33.231 . . 1122 316 338 VAL CG2 C 19.296 . . 1123 316 338 VAL N N 112.393 . . 1124 317 339 GLY H H 7.926 . . 1125 317 339 GLY C C 176.161 . . 1126 317 339 GLY CA C 43.243 . . 1127 317 339 GLY N N 109.551 . . 1128 318 340 ASN H H 9.392 . . 1129 318 340 ASN C C 173.464 . . 1130 318 340 ASN CA C 52.612 . . 1131 318 340 ASN CB C 36.039 . . 1132 318 340 ASN N N 122.322 . . 1133 319 341 VAL H H 6.092 . . 1134 319 341 VAL HG1 H 0.166 . . 1135 319 341 VAL C C 173.469 . . 1136 319 341 VAL CA C 57.457 . . 1137 319 341 VAL CB C 34.280 . . 1138 319 341 VAL CG1 C 18.074 . . 1139 319 341 VAL N N 107.342 . . 1140 320 342 ASP H H 8.670 . . 1141 320 342 ASP C C 174.407 . . 1142 320 342 ASP CA C 53.293 . . 1143 320 342 ASP CB C 41.381 . . 1144 320 342 ASP N N 119.853 . . 1145 321 343 VAL H H 8.131 . . 1146 321 343 VAL HG1 H 0.532 . . 1147 321 343 VAL HG2 H 0.527 . . 1148 321 343 VAL C C 175.485 . . 1149 321 343 VAL CA C 62.109 . . 1150 321 343 VAL CB C 31.043 . . 1151 321 343 VAL CG1 C 19.379 . . 1152 321 343 VAL CG2 C 20.834 . . 1153 321 343 VAL N N 124.328 . . 1154 322 344 LEU H H 9.077 . . 1155 322 344 LEU HD1 H 0.692 . . 1156 322 344 LEU HD2 H 0.396 . . 1157 322 344 LEU C C 177.341 . . 1158 322 344 LEU CA C 53.910 . . 1159 322 344 LEU CB C 45.946 . . 1160 322 344 LEU CG C 26.679 . . 1161 322 344 LEU CD1 C 23.712 . . 1162 322 344 LEU CD2 C 26.178 . . 1163 322 344 LEU N N 128.350 . . 1164 323 345 PHE C C 174.669 . . 1165 323 345 PHE CA C 57.404 . . 1166 323 345 PHE CB C 39.645 . . 1167 324 346 THR H H 7.439 . . 1168 324 346 THR C C 173.206 . . 1169 324 346 THR CA C 58.872 . . 1170 324 346 THR CB C 71.540 . . 1171 324 346 THR N N 113.487 . . 1172 325 347 ASN H H 7.344 . . 1173 325 347 ASN C C 177.854 . . 1174 325 347 ASN CA C 49.514 . . 1175 325 347 ASN CB C 36.375 . . 1176 325 347 ASN N N 119.268 . . 1177 326 348 LYS H H 6.535 . . 1178 326 348 LYS C C 176.693 . . 1179 326 348 LYS CA C 59.119 . . 1180 326 348 LYS CB C 30.848 . . 1181 326 348 LYS N N 119.842 . . 1182 327 349 GLN H H 6.614 . . 1183 327 349 GLN C C 175.832 . . 1184 327 349 GLN CA C 56.566 . . 1185 327 349 GLN CB C 26.837 . . 1186 327 349 GLN N N 114.092 . . 1187 328 350 GLY H H 7.723 . . 1188 328 350 GLY C C 174.382 . . 1189 328 350 GLY CA C 44.554 . . 1190 328 350 GLY N N 107.805 . . 1191 329 351 ASN H H 8.021 . . 1192 329 351 ASN C C 173.615 . . 1193 329 351 ASN CA C 53.270 . . 1194 329 351 ASN CB C 38.733 . . 1195 329 351 ASN N N 121.102 . . 1196 333 355 PRO C C 174.659 . . 1197 333 355 PRO CA C 61.988 . . 1198 333 355 PRO CB C 31.973 . . 1199 334 356 GLU H H 7.867 . . 1200 334 356 GLU C C 177.512 . . 1201 334 356 GLU CA C 56.610 . . 1202 334 356 GLU CB C 31.112 . . 1203 334 356 GLU N N 115.101 . . 1204 335 357 THR H H 8.691 . . 1205 335 357 THR C C 173.584 . . 1206 335 357 THR CA C 60.945 . . 1207 335 357 THR CB C 69.568 . . 1208 335 357 THR N N 113.127 . . 1209 336 358 GLN H H 6.194 . . 1210 336 358 GLN C C 174.880 . . 1211 336 358 GLN CA C 54.322 . . 1212 336 358 GLN CB C 27.478 . . 1213 336 358 GLN N N 118.143 . . 1214 338 360 PRO C C 175.067 . . 1215 338 360 PRO CA C 64.514 . . 1216 338 360 PRO CB C 30.863 . . 1217 339 361 TRP H H 6.343 . . 1218 339 361 TRP C C 174.957 . . 1219 339 361 TRP CA C 53.076 . . 1220 339 361 TRP CB C 28.849 . . 1221 339 361 TRP N N 109.423 . . 1222 340 362 LEU H H 6.990 . . 1223 340 362 LEU HD1 H 0.728 . . 1224 340 362 LEU HD2 H 0.798 . . 1225 340 362 LEU C C 174.848 . . 1226 340 362 LEU CA C 56.066 . . 1227 340 362 LEU CB C 42.734 . . 1228 340 362 LEU CG C 29.520 . . 1229 340 362 LEU CD1 C 22.125 . . 1230 340 362 LEU CD2 C 27.519 . . 1231 340 362 LEU N N 127.133 . . 1232 344 366 ALA C C 178.581 . . 1233 344 366 ALA CA C 55.076 . . 1234 345 367 ALA H H 8.274 . . 1235 345 367 ALA C C 179.967 . . 1236 345 367 ALA CA C 54.604 . . 1237 345 367 ALA CB C 17.362 . . 1238 345 367 ALA N N 118.154 . . 1239 346 368 GLY H H 7.496 . . 1240 346 368 GLY C C 175.151 . . 1241 346 368 GLY CA C 46.139 . . 1242 346 368 GLY N N 105.198 . . 1243 347 369 PHE H H 7.233 . . 1244 347 369 PHE C C 177.685 . . 1245 347 369 PHE CA C 55.759 . . 1246 347 369 PHE CB C 38.306 . . 1247 347 369 PHE N N 122.486 . . 1248 371 393 SER C C 173.621 . . 1249 371 393 SER CA C 55.388 . . 1250 371 393 SER CB C 65.042 . . 1251 372 394 ILE H H 7.798 . . 1252 372 394 ILE HD1 H 0.836 . . 1253 372 394 ILE C C 175.907 . . 1254 372 394 ILE CA C 60.275 . . 1255 372 394 ILE CB C 40.555 . . 1256 372 394 ILE CG1 C 27.369 . . 1257 372 394 ILE CD1 C 16.338 . . 1258 372 394 ILE N N 116.468 . . 1259 373 395 LYS H H 8.873 . . 1260 373 395 LYS C C 177.455 . . 1261 373 395 LYS CA C 57.680 . . 1262 373 395 LYS CB C 30.891 . . 1263 373 395 LYS N N 131.382 . . 1264 374 396 GLY H H 8.841 . . 1265 374 396 GLY C C 176.074 . . 1266 374 396 GLY CA C 45.596 . . 1267 374 396 GLY N N 116.313 . . 1268 375 397 GLU H H 7.717 . . 1269 375 397 GLU C C 177.857 . . 1270 375 397 GLU CA C 59.540 . . 1271 375 397 GLU CB C 30.345 . . 1272 375 397 GLU N N 125.310 . . 1273 376 398 SER H H 8.858 . . 1274 376 398 SER C C 174.188 . . 1275 376 398 SER CA C 60.970 . . 1276 376 398 SER CB C 62.718 . . 1277 376 398 SER N N 108.642 . . 1278 377 399 ASP H H 7.625 . . 1279 377 399 ASP C C 176.203 . . 1280 377 399 ASP CA C 53.735 . . 1281 377 399 ASP CB C 41.152 . . 1282 377 399 ASP N N 119.058 . . 1283 378 400 LEU H H 7.245 . . 1284 378 400 LEU HD1 H 0.678 . . 1285 378 400 LEU HD2 H 0.667 . . 1286 378 400 LEU C C 174.257 . . 1287 378 400 LEU CA C 52.774 . . 1288 378 400 LEU CB C 41.169 . . 1289 378 400 LEU CG C 25.119 . . 1290 378 400 LEU CD1 C 22.109 . . 1291 378 400 LEU CD2 C 25.855 . . 1292 378 400 LEU N N 122.805 . . 1293 380 402 LYS C C 176.964 . . 1294 380 402 LYS CA C 59.543 . . 1295 380 402 LYS CB C 31.023 . . 1296 381 403 GLU H H 8.970 . . 1297 381 403 GLU C C 178.734 . . 1298 381 403 GLU CA C 59.113 . . 1299 381 403 GLU CB C 27.596 . . 1300 381 403 GLU N N 114.167 . . 1301 382 404 LYS H H 7.217 . . 1302 382 404 LYS C C 179.036 . . 1303 382 404 LYS CA C 56.479 . . 1304 382 404 LYS CB C 32.601 . . 1305 382 404 LYS N N 116.476 . . 1306 383 405 ILE H H 7.640 . . 1307 383 405 ILE HD1 H 0.376 . . 1308 383 405 ILE C C 177.626 . . 1309 383 405 ILE CA C 63.962 . . 1310 383 405 ILE CB C 36.439 . . 1311 383 405 ILE CG1 C 29.429 . . 1312 383 405 ILE CD1 C 13.813 . . 1313 383 405 ILE N N 123.437 . . 1314 384 406 LEU H H 7.213 . . 1315 384 406 LEU HD1 H 0.513 . . 1316 384 406 LEU HD2 H 0.622 . . 1317 384 406 LEU C C 177.759 . . 1318 384 406 LEU CA C 55.972 . . 1319 384 406 LEU CB C 39.310 . . 1320 384 406 LEU CG C 25.525 . . 1321 384 406 LEU CD1 C 22.726 . . 1322 384 406 LEU CD2 C 24.969 . . 1323 384 406 LEU N N 112.260 . . 1324 385 407 GLU H H 6.951 . . 1325 385 407 GLU C C 175.553 . . 1326 385 407 GLU CA C 53.253 . . 1327 385 407 GLU CB C 27.165 . . 1328 385 407 GLU N N 122.137 . . 1329 386 408 ASP H H 8.506 . . 1330 386 408 ASP C C 178.119 . . 1331 386 408 ASP CA C 52.190 . . 1332 386 408 ASP CB C 38.161 . . 1333 386 408 ASP N N 124.029 . . 1334 387 409 ASP H H 8.086 . . 1335 387 409 ASP C C 177.494 . . 1336 387 409 ASP CA C 58.169 . . 1337 387 409 ASP CB C 40.501 . . 1338 387 409 ASP N N 124.044 . . 1339 401 423 VAL HG1 H 0.751 . . 1340 401 423 VAL C C 177.688 . . 1341 401 423 VAL CA C 66.144 . . 1342 401 423 VAL CB C 30.023 . . 1343 401 423 VAL CG1 C 23.216 . . 1344 402 424 THR H H 7.900 . . 1345 402 424 THR C C 175.332 . . 1346 402 424 THR CA C 66.673 . . 1347 402 424 THR CB C 67.662 . . 1348 402 424 THR N N 118.201 . . 1349 403 425 ALA H H 7.574 . . 1350 403 425 ALA C C 180.550 . . 1351 403 425 ALA CA C 53.480 . . 1352 403 425 ALA CB C 17.348 . . 1353 403 425 ALA N N 123.945 . . 1354 404 426 VAL H H 7.696 . . 1355 404 426 VAL HG1 H 0.912 . . 1356 404 426 VAL C C 178.304 . . 1357 404 426 VAL CA C 65.426 . . 1358 404 426 VAL CB C 31.432 . . 1359 404 426 VAL CG1 C 22.009 . . 1360 404 426 VAL N N 120.204 . . 1361 405 427 GLU H H 8.470 . . 1362 405 427 GLU C C 178.372 . . 1363 405 427 GLU CA C 58.870 . . 1364 405 427 GLU CB C 29.992 . . 1365 405 427 GLU N N 119.982 . . 1366 406 428 LEU H H 8.931 . . 1367 406 428 LEU HD1 H 0.622 . . 1368 406 428 LEU HD2 H 0.665 . . 1369 406 428 LEU C C 178.887 . . 1370 406 428 LEU CA C 55.730 . . 1371 406 428 LEU CB C 40.770 . . 1372 406 428 LEU CG C 26.228 . . 1373 406 428 LEU CD1 C 22.213 . . 1374 406 428 LEU CD2 C 25.062 . . 1375 406 428 LEU N N 115.780 . . 1376 407 429 ASP H H 7.055 . . 1377 407 429 ASP C C 176.995 . . 1378 407 429 ASP CA C 53.985 . . 1379 407 429 ASP CB C 43.230 . . 1380 407 429 ASP N N 115.207 . . 1381 408 430 GLY H H 7.233 . . 1382 408 430 GLY C C 174.392 . . 1383 408 430 GLY CA C 46.364 . . 1384 408 430 GLY N N 108.978 . . 1385 409 431 VAL H H 7.327 . . 1386 409 431 VAL HG1 H 0.616 . . 1387 409 431 VAL HG2 H 0.662 . . 1388 409 431 VAL C C 175.542 . . 1389 409 431 VAL CA C 63.236 . . 1390 409 431 VAL CB C 30.653 . . 1391 409 431 VAL CG1 C 21.690 . . 1392 409 431 VAL CG2 C 22.602 . . 1393 409 431 VAL N N 117.798 . . 1394 410 432 ASN H H 9.055 . . 1395 410 432 ASN C C 174.323 . . 1396 410 432 ASN CA C 51.348 . . 1397 410 432 ASN CB C 37.040 . . 1398 410 432 ASN N N 128.014 . . 1399 411 433 VAL H H 7.075 . . 1400 411 433 VAL C C 176.205 . . 1401 411 433 VAL CA C 61.710 . . 1402 411 433 VAL CB C 31.418 . . 1403 411 433 VAL N N 120.634 . . 1404 415 437 PHE C C 178.789 . . 1405 416 438 ALA H H 7.330 . . 1406 416 438 ALA C C 179.162 . . 1407 416 438 ALA CA C 55.626 . . 1408 416 438 ALA CB C 17.958 . . 1409 416 438 ALA N N 126.229 . . 1410 417 439 TRP H H 7.005 . . 1411 417 439 TRP C C 176.746 . . 1412 417 439 TRP CA C 56.114 . . 1413 417 439 TRP CB C 31.282 . . 1414 417 439 TRP N N 112.899 . . 1415 418 440 SER H H 7.817 . . 1416 418 440 SER C C 175.720 . . 1417 418 440 SER CA C 59.704 . . 1418 418 440 SER CB C 63.646 . . 1419 418 440 SER N N 114.319 . . 1420 419 441 LEU H H 6.589 . . 1421 419 441 LEU HD1 H 0.373 . . 1422 419 441 LEU HD2 H 0.586 . . 1423 419 441 LEU C C 176.489 . . 1424 419 441 LEU CA C 58.246 . . 1425 419 441 LEU CB C 41.114 . . 1426 419 441 LEU CG C 27.072 . . 1427 419 441 LEU CD1 C 22.871 . . 1428 419 441 LEU CD2 C 25.822 . . 1429 419 441 LEU N N 122.871 . . 1430 420 442 MET H H 8.786 . . 1431 420 442 MET C C 174.644 . . 1432 420 442 MET CA C 61.148 . . 1433 420 442 MET CB C 28.709 . . 1434 420 442 MET N N 120.650 . . 1435 421 443 ASP C C 171.596 . . 1436 421 443 ASP CA C 55.551 . . 1437 421 443 ASP CB C 40.558 . . 1438 422 444 ASN H H 8.086 . . 1439 422 444 ASN C C 173.403 . . 1440 422 444 ASN CA C 53.107 . . 1441 422 444 ASN CB C 39.352 . . 1442 422 444 ASN N N 115.025 . . 1443 423 445 PHE H H 7.665 . . 1444 423 445 PHE C C 172.434 . . 1445 423 445 PHE CA C 57.586 . . 1446 423 445 PHE CB C 36.582 . . 1447 423 445 PHE N N 116.624 . . 1448 424 446 GLU H H 7.410 . . 1449 424 446 GLU C C 174.851 . . 1450 424 446 GLU CA C 51.096 . . 1451 424 446 GLU CB C 26.983 . . 1452 424 446 GLU N N 137.9 . . 1453 425 447 TRP H H 5.515 . . 1454 425 447 TRP C C 175.143 . . 1455 425 447 TRP CA C 55.491 . . 1456 425 447 TRP CB C 26.865 . . 1457 425 447 TRP N N 116.796 . . 1458 426 448 ALA H H 7.007 . . 1459 426 448 ALA C C 177.562 . . 1460 426 448 ALA CA C 54.598 . . 1461 426 448 ALA CB C 17.536 . . 1462 426 448 ALA N N 119.421 . . 1463 427 449 ASP H H 8.505 . . 1464 427 449 ASP C C 177.096 . . 1465 427 449 ASP CA C 54.562 . . 1466 427 449 ASP CB C 39.370 . . 1467 427 449 ASP N N 120.188 . . 1468 428 450 GLY H H 7.346 . . 1469 428 450 GLY C C 174.149 . . 1470 428 450 GLY CA C 44.739 . . 1471 428 450 GLY N N 109.779 . . 1472 429 451 TYR H H 9.009 . . 1473 429 451 TYR C C 177.734 . . 1474 429 451 TYR CA C 58.876 . . 1475 429 451 TYR CB C 37.806 . . 1476 429 451 TYR N N 120.939 . . 1477 430 452 VAL H H 7.111 . . 1478 430 452 VAL HG1 H 0.883 . . 1479 430 452 VAL HG2 H 1.097 . . 1480 430 452 VAL C C 178.219 . . 1481 430 452 VAL CA C 65.055 . . 1482 430 452 VAL CB C 32.215 . . 1483 430 452 VAL CG1 C 21.793 . . 1484 430 452 VAL CG2 C 22.096 . . 1485 430 452 VAL N N 117.820 . . 1486 431 453 THR H H 6.187 . . 1487 431 453 THR C C 171.169 . . 1488 431 453 THR CA C 62.740 . . 1489 431 453 THR CB C 67.434 . . 1490 431 453 THR N N 116.100 . . 1491 432 454 ARG H H 8.034 . . 1492 432 454 ARG C C 174.413 . . 1493 432 454 ARG CA C 55.029 . . 1494 432 454 ARG CB C 30.029 . . 1495 432 454 ARG N N 127.910 . . 1496 433 455 PHE H H 8.807 . . 1497 433 455 PHE C C 177.601 . . 1498 433 455 PHE CA C 56.873 . . 1499 433 455 PHE CB C 41.457 . . 1500 433 455 PHE N N 119.698 . . 1501 434 456 GLY H H 8.478 . . 1502 434 456 GLY C C 175.533 . . 1503 434 456 GLY CA C 45.536 . . 1504 434 456 GLY N N 108.937 . . 1505 435 457 VAL H H 7.783 . . 1506 435 457 VAL HG1 H 0.736 . . 1507 435 457 VAL HG2 H 1.076 . . 1508 435 457 VAL C C 174.083 . . 1509 435 457 VAL CA C 60.997 . . 1510 435 457 VAL CB C 28.925 . . 1511 435 457 VAL CG1 C 19.154 . . 1512 435 457 VAL CG2 C 20.256 . . 1513 435 457 VAL N N 109.639 . . 1514 436 458 THR H H 6.504 . . 1515 436 458 THR C C 173.300 . . 1516 436 458 THR CA C 62.117 . . 1517 436 458 THR CB C 68.685 . . 1518 436 458 THR N N 115.534 . . 1519 437 459 TYR H H 8.834 . . 1520 437 459 TYR C C 173.992 . . 1521 437 459 TYR CA C 55.266 . . 1522 437 459 TYR CB C 38.454 . . 1523 437 459 TYR N N 130.821 . . 1524 438 460 VAL H H 6.138 . . 1525 438 460 VAL HG1 H -0.077 . . 1526 438 460 VAL HG2 H 0.633 . . 1527 438 460 VAL C C 172.869 . . 1528 438 460 VAL CA C 59.689 . . 1529 438 460 VAL CB C 31.635 . . 1530 438 460 VAL CG1 C 21.387 . . 1531 438 460 VAL CG2 C 21.963 . . 1532 438 460 VAL N N 127.332 . . 1533 439 461 ASP H H 8.146 . . 1534 439 461 ASP C C 177.444 . . 1535 439 461 ASP CA C 50.470 . . 1536 439 461 ASP CB C 39.332 . . 1537 439 461 ASP N N 124.676 . . 1538 440 462 TYR H H 7.519 . . 1539 440 462 TYR C C 177.450 . . 1540 440 462 TYR CA C 61.597 . . 1541 440 462 TYR CB C 37.203 . . 1542 440 462 TYR N N 124.762 . . 1543 441 463 GLU H H 7.929 . . 1544 441 463 GLU C C 176.290 . . 1545 441 463 GLU CA C 57.155 . . 1546 441 463 GLU CB C 29.047 . . 1547 441 463 GLU N N 114.668 . . 1548 442 464 ASN H H 7.040 . . 1549 442 464 ASN C C 175.924 . . 1550 442 464 ASN CA C 50.529 . . 1551 442 464 ASN CB C 37.850 . . 1552 442 464 ASN N N 119.193 . . 1553 443 465 GLY C C 175.029 . . 1554 443 465 GLY CA C 46.459 . . 1555 444 466 GLN H H 7.456 . . 1556 444 466 GLN C C 173.803 . . 1557 444 466 GLN CA C 56.906 . . 1558 444 466 GLN CB C 23.567 . . 1559 444 466 GLN N N 112.906 . . 1560 445 467 LYS H H 6.368 . . 1561 445 467 LYS C C 174.931 . . 1562 445 467 LYS CA C 57.349 . . 1563 445 467 LYS CB C 32.935 . . 1564 445 467 LYS N N 118.845 . . 1565 446 468 ARG H H 7.938 . . 1566 446 468 ARG C C 176.951 . . 1567 446 468 ARG CA C 55.822 . . 1568 446 468 ARG CB C 32.558 . . 1569 446 468 ARG N N 120.415 . . 1570 460 482 ASP C C 178.781 . . 1571 460 482 ASP CA C 56.541 . . 1572 460 482 ASP CB C 39.246 . . 1573 461 483 GLU H H 7.019 . . 1574 461 483 GLU C C 177.464 . . 1575 461 483 GLU CA C 57.231 . . 1576 461 483 GLU CB C 29.151 . . 1577 461 483 GLU N N 117.827 . . 1578 462 484 LEU H H 7.240 . . 1579 462 484 LEU HD1 H 0.514 . . 1580 462 484 LEU HD2 H 0.013 . . 1581 462 484 LEU C C 176.493 . . 1582 462 484 LEU CA C 55.744 . . 1583 462 484 LEU CB C 43.790 . . 1584 462 484 LEU CG C 25.111 . . 1585 462 484 LEU CD1 C 22.235 . . 1586 462 484 LEU CD2 C 25.456 . . 1587 462 484 LEU N N 117.469 . . 1588 463 485 ILE H H 7.807 . . 1589 463 485 ILE HD1 H 1.015 . . 1590 463 485 ILE C C 176.193 . . 1591 463 485 ILE CA C 61.883 . . 1592 463 485 ILE CB C 37.714 . . 1593 463 485 ILE CG1 C 28.526 . . 1594 463 485 ILE CD1 C 14.772 . . 1595 463 485 ILE N N 119.646 . . 1596 464 486 ALA H H 8.212 . . 1597 464 486 ALA C C 176.179 . . 1598 464 486 ALA CA C 52.640 . . 1599 464 486 ALA CB C 18.512 . . 1600 464 486 ALA N N 131.885 . . 1601 465 487 ALA H H 8.089 . . 1602 465 487 ALA C C 176.851 . . 1603 465 487 ALA CA C 51.753 . . 1604 465 487 ALA CB C 18.827 . . 1605 465 487 ALA N N 122.361 . . 1606 466 488 ALA H H 7.656 . . 1607 466 488 ALA C C 182.028 . . 1608 466 488 ALA CA C 53.102 . . 1609 466 488 ALA CB C 19.770 . . 1610 466 488 ALA N N 127.018 . . stop_ save_