data_15164 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone chemical shifts assignment of the soluble N-terminal region of the ATP7A ; _BMRB_accession_number 15164 _BMRB_flat_file_name bmr15164.str _Entry_type original _Submission_date 2007-03-07 _Accession_date 2007-03-07 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details ; Backbone assignment of the apo and copper-bound forms of the first 629 amino acids of ATP7A, comprising the six copper(I)-binding domains. ; loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Banci Lucia . . 2 Bertini Ivano . . 3 Cantini Francesca . . 4 'Della Malva' Nunzia . . 5 Migliardi Manuele . . 6 Rosato Antonio . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 368 "13C chemical shifts" 833 "15N chemical shifts" 376 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2007-10-24 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 7375 'ATP7A (complex with Cu)' stop_ _Original_release_date 2007-10-24 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'The different intermolecular interactions of the soluble copper-binding domains of the menkes protein, ATP7A.THE DIFFERENT INTERMOLECULAR INTERACTIONS OF THE SOLUBLE COPPER-BINDING DOMAINS OF THE MENKES PROTEIN, ATP7A' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 17545667 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Banci Lucia . . 2 Bertini Ivano . . 3 Cantini Francesca . . 4 'Della Malva' Nunzia . . 5 Migliardi Manuele . . 6 Rosato Antonio . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 282 _Journal_issue 32 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 23140 _Page_last 23146 _Year 2007 _Details . loop_ _Keyword copper 'Menkes disease' 'metal homeostasis' metallochaperone stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name ATP7A _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label ATP7A $ATP7A 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_ATP7A _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common ATP7A _Molecular_mass 68620.7 _Mol_thiol_state 'all free' loop_ _Biological_function 'Copper pump' 'Menkes disease-associated protein' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 629 _Mol_residue_sequence ; MGVNSVTISVEGMTCNSCVW TIEQQIGKVNGVHHIKVSLE EKNATIIYDPKLQTPKTLQE AIDDMGFDAVIHNPDPLPVL TDTLFLTVTASLTLPWDHIQ STLLKTKGVTDIKIYPQKRT VAVTIIPSIVNANQIKELVP ELSLDTGTLEKKSGACEDHS MAQAGEVVLKMKVEGMTCHS CTSTIEGKIGKLQGVQRIKV SLDNQEATIVYQPHLISVEE MKKQIEAMGFPAFVKKQPKY LKLGAIDVERLKNTPVKSSE GSQQRSPSYTNDSTATFIID GMHCKSCVSNIESTLSALQY VSSIVVSLENRSAIVKYNAS SVTPESLRKAIEAVSPGLYR VSITSEVESTSNSPSSSSLQ KIPLNVVSQPLTQETVINID GMTCNSCVQSIEGVISKKPG VKSIRVSLANSNGTVEYDPL LTSPETLRGAIEDMGFDATL SDTNEPLVVIAQPSSEMPLL TSTNEFYTKGMTPVQDKEEG KNSSKCYIQVTGMTCASCVA NIERNLRREEGIYSILVALM AGKAEVRYNPAVIQPPMIAE FIRELGFGATVIENADEGDG VLELVVRGMTCASCVHKIES SLTKHRGILYCSVALATNKA HIKYDPEIIGPRDIIHTIES LGFEASLVK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 5 MET 2 6 GLY 3 7 VAL 4 8 ASN 5 9 SER 6 10 VAL 7 11 THR 8 12 ILE 9 13 SER 10 14 VAL 11 15 GLU 12 16 GLY 13 17 MET 14 18 THR 15 19 CYS 16 20 ASN 17 21 SER 18 22 CYS 19 23 VAL 20 24 TRP 21 25 THR 22 26 ILE 23 27 GLU 24 28 GLN 25 29 GLN 26 30 ILE 27 31 GLY 28 32 LYS 29 33 VAL 30 34 ASN 31 35 GLY 32 36 VAL 33 37 HIS 34 38 HIS 35 39 ILE 36 40 LYS 37 41 VAL 38 42 SER 39 43 LEU 40 44 GLU 41 45 GLU 42 46 LYS 43 47 ASN 44 48 ALA 45 49 THR 46 50 ILE 47 51 ILE 48 52 TYR 49 53 ASP 50 54 PRO 51 55 LYS 52 56 LEU 53 57 GLN 54 58 THR 55 59 PRO 56 60 LYS 57 61 THR 58 62 LEU 59 63 GLN 60 64 GLU 61 65 ALA 62 66 ILE 63 67 ASP 64 68 ASP 65 69 MET 66 70 GLY 67 71 PHE 68 72 ASP 69 73 ALA 70 74 VAL 71 75 ILE 72 76 HIS 73 77 ASN 74 78 PRO 75 79 ASP 76 80 PRO 77 81 LEU 78 82 PRO 79 83 VAL 80 84 LEU 81 85 THR 82 86 ASP 83 87 THR 84 88 LEU 85 89 PHE 86 90 LEU 87 91 THR 88 92 VAL 89 93 THR 90 94 ALA 91 95 SER 92 96 LEU 93 97 THR 94 98 LEU 95 99 PRO 96 100 TRP 97 101 ASP 98 102 HIS 99 103 ILE 100 104 GLN 101 105 SER 102 106 THR 103 107 LEU 104 108 LEU 105 109 LYS 106 110 THR 107 111 LYS 108 112 GLY 109 113 VAL 110 114 THR 111 115 ASP 112 116 ILE 113 117 LYS 114 118 ILE 115 119 TYR 116 120 PRO 117 121 GLN 118 122 LYS 119 123 ARG 120 124 THR 121 125 VAL 122 126 ALA 123 127 VAL 124 128 THR 125 129 ILE 126 130 ILE 127 131 PRO 128 132 SER 129 133 ILE 130 134 VAL 131 135 ASN 132 136 ALA 133 137 ASN 134 138 GLN 135 139 ILE 136 140 LYS 137 141 GLU 138 142 LEU 139 143 VAL 140 144 PRO 141 145 GLU 142 146 LEU 143 147 SER 144 148 LEU 145 149 ASP 146 150 THR 147 151 GLY 148 152 THR 149 153 LEU 150 154 GLU 151 155 LYS 152 156 LYS 153 157 SER 154 158 GLY 155 159 ALA 156 160 CYS 157 161 GLU 158 162 ASP 159 163 HIS 160 164 SER 161 165 MET 162 166 ALA 163 167 GLN 164 168 ALA 165 169 GLY 166 170 GLU 167 171 VAL 168 172 VAL 169 173 LEU 170 174 LYS 171 175 MET 172 176 LYS 173 177 VAL 174 178 GLU 175 179 GLY 176 180 MET 177 181 THR 178 182 CYS 179 183 HIS 180 184 SER 181 185 CYS 182 186 THR 183 187 SER 184 188 THR 185 189 ILE 186 190 GLU 187 191 GLY 188 192 LYS 189 193 ILE 190 194 GLY 191 195 LYS 192 196 LEU 193 197 GLN 194 198 GLY 195 199 VAL 196 200 GLN 197 201 ARG 198 202 ILE 199 203 LYS 200 204 VAL 201 205 SER 202 206 LEU 203 207 ASP 204 208 ASN 205 209 GLN 206 210 GLU 207 211 ALA 208 212 THR 209 213 ILE 210 214 VAL 211 215 TYR 212 216 GLN 213 217 PRO 214 218 HIS 215 219 LEU 216 220 ILE 217 221 SER 218 222 VAL 219 223 GLU 220 224 GLU 221 225 MET 222 226 LYS 223 227 LYS 224 228 GLN 225 229 ILE 226 230 GLU 227 231 ALA 228 232 MET 229 233 GLY 230 234 PHE 231 235 PRO 232 236 ALA 233 237 PHE 234 238 VAL 235 239 LYS 236 240 LYS 237 241 GLN 238 242 PRO 239 243 LYS 240 244 TYR 241 245 LEU 242 246 LYS 243 247 LEU 244 248 GLY 245 249 ALA 246 250 ILE 247 251 ASP 248 252 VAL 249 253 GLU 250 254 ARG 251 255 LEU 252 256 LYS 253 257 ASN 254 258 THR 255 259 PRO 256 260 VAL 257 261 LYS 258 262 SER 259 263 SER 260 264 GLU 261 265 GLY 262 266 SER 263 267 GLN 264 268 GLN 265 269 ARG 266 270 SER 267 271 PRO 268 272 SER 269 273 TYR 270 274 THR 271 275 ASN 272 276 ASP 273 277 SER 274 278 THR 275 279 ALA 276 280 THR 277 281 PHE 278 282 ILE 279 283 ILE 280 284 ASP 281 285 GLY 282 286 MET 283 287 HIS 284 288 CYS 285 289 LYS 286 290 SER 287 291 CYS 288 292 VAL 289 293 SER 290 294 ASN 291 295 ILE 292 296 GLU 293 297 SER 294 298 THR 295 299 LEU 296 300 SER 297 301 ALA 298 302 LEU 299 303 GLN 300 304 TYR 301 305 VAL 302 306 SER 303 307 SER 304 308 ILE 305 309 VAL 306 310 VAL 307 311 SER 308 312 LEU 309 313 GLU 310 314 ASN 311 315 ARG 312 316 SER 313 317 ALA 314 318 ILE 315 319 VAL 316 320 LYS 317 321 TYR 318 322 ASN 319 323 ALA 320 324 SER 321 325 SER 322 326 VAL 323 327 THR 324 328 PRO 325 329 GLU 326 330 SER 327 331 LEU 328 332 ARG 329 333 LYS 330 334 ALA 331 335 ILE 332 336 GLU 333 337 ALA 334 338 VAL 335 339 SER 336 340 PRO 337 341 GLY 338 342 LEU 339 343 TYR 340 344 ARG 341 345 VAL 342 346 SER 343 347 ILE 344 348 THR 345 349 SER 346 350 GLU 347 351 VAL 348 352 GLU 349 353 SER 350 354 THR 351 355 SER 352 356 ASN 353 357 SER 354 358 PRO 355 359 SER 356 360 SER 357 361 SER 358 362 SER 359 363 LEU 360 364 GLN 361 365 LYS 362 366 ILE 363 367 PRO 364 368 LEU 365 369 ASN 366 370 VAL 367 371 VAL 368 372 SER 369 373 GLN 370 374 PRO 371 375 LEU 372 376 THR 373 377 GLN 374 378 GLU 375 379 THR 376 380 VAL 377 381 ILE 378 382 ASN 379 383 ILE 380 384 ASP 381 385 GLY 382 386 MET 383 387 THR 384 388 CYS 385 389 ASN 386 390 SER 387 391 CYS 388 392 VAL 389 393 GLN 390 394 SER 391 395 ILE 392 396 GLU 393 397 GLY 394 398 VAL 395 399 ILE 396 400 SER 397 401 LYS 398 402 LYS 399 403 PRO 400 404 GLY 401 405 VAL 402 406 LYS 403 407 SER 404 408 ILE 405 409 ARG 406 410 VAL 407 411 SER 408 412 LEU 409 413 ALA 410 414 ASN 411 415 SER 412 416 ASN 413 417 GLY 414 418 THR 415 419 VAL 416 420 GLU 417 421 TYR 418 422 ASP 419 423 PRO 420 424 LEU 421 425 LEU 422 426 THR 423 427 SER 424 428 PRO 425 429 GLU 426 430 THR 427 431 LEU 428 432 ARG 429 433 GLY 430 434 ALA 431 435 ILE 432 436 GLU 433 437 ASP 434 438 MET 435 439 GLY 436 440 PHE 437 441 ASP 438 442 ALA 439 443 THR 440 444 LEU 441 445 SER 442 446 ASP 443 447 THR 444 448 ASN 445 449 GLU 446 450 PRO 447 451 LEU 448 452 VAL 449 453 VAL 450 454 ILE 451 455 ALA 452 456 GLN 453 457 PRO 454 458 SER 455 459 SER 456 460 GLU 457 461 MET 458 462 PRO 459 463 LEU 460 464 LEU 461 465 THR 462 466 SER 463 467 THR 464 468 ASN 465 469 GLU 466 470 PHE 467 471 TYR 468 472 THR 469 473 LYS 470 474 GLY 471 475 MET 472 476 THR 473 477 PRO 474 478 VAL 475 479 GLN 476 480 ASP 477 481 LYS 478 482 GLU 479 483 GLU 480 484 GLY 481 485 LYS 482 486 ASN 483 487 SER 484 488 SER 485 489 LYS 486 490 CYS 487 491 TYR 488 492 ILE 489 493 GLN 490 494 VAL 491 495 THR 492 496 GLY 493 497 MET 494 498 THR 495 499 CYS 496 500 ALA 497 501 SER 498 502 CYS 499 503 VAL 500 504 ALA 501 505 ASN 502 506 ILE 503 507 GLU 504 508 ARG 505 509 ASN 506 510 LEU 507 511 ARG 508 512 ARG 509 513 GLU 510 514 GLU 511 515 GLY 512 516 ILE 513 517 TYR 514 518 SER 515 519 ILE 516 520 LEU 517 521 VAL 518 522 ALA 519 523 LEU 520 524 MET 521 525 ALA 522 526 GLY 523 527 LYS 524 528 ALA 525 529 GLU 526 530 VAL 527 531 ARG 528 532 TYR 529 533 ASN 530 534 PRO 531 535 ALA 532 536 VAL 533 537 ILE 534 538 GLN 535 539 PRO 536 540 PRO 537 541 MET 538 542 ILE 539 543 ALA 540 544 GLU 541 545 PHE 542 546 ILE 543 547 ARG 544 548 GLU 545 549 LEU 546 550 GLY 547 551 PHE 548 552 GLY 549 553 ALA 550 554 THR 551 555 VAL 552 556 ILE 553 557 GLU 554 558 ASN 555 559 ALA 556 560 ASP 557 561 GLU 558 562 GLY 559 563 ASP 560 564 GLY 561 565 VAL 562 566 LEU 563 567 GLU 564 568 LEU 565 569 VAL 566 570 VAL 567 571 ARG 568 572 GLY 569 573 MET 570 574 THR 571 575 CYS 572 576 ALA 573 577 SER 574 578 CYS 575 579 VAL 576 580 HIS 577 581 LYS 578 582 ILE 579 583 GLU 580 584 SER 581 585 SER 582 586 LEU 583 587 THR 584 588 LYS 585 589 HIS 586 590 ARG 587 591 GLY 588 592 ILE 589 593 LEU 590 594 TYR 591 595 CYS 592 596 SER 593 597 VAL 594 598 ALA 595 599 LEU 596 600 ALA 597 601 THR 598 602 ASN 599 603 LYS 600 604 ALA 601 605 HIS 602 606 ILE 603 607 LYS 604 608 TYR 605 609 ASP 606 610 PRO 607 611 GLU 608 612 ILE 609 613 ILE 610 614 GLY 611 615 PRO 612 616 ARG 613 617 ASP 614 618 ILE 615 619 ILE 616 620 HIS 617 621 THR 618 622 ILE 619 623 GLU 620 624 SER 621 625 LEU 622 626 GLY 623 627 PHE 624 628 GLU 625 629 ALA 626 630 SER 627 631 LEU 628 632 VAL 629 633 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-05-12 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 BMRB 7375 ATP7A 100.00 629 100.00 100.00 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 $ATP7A Human 9606 Eukaryota Metazoa Homo sapiens 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 $ATP7A 'recombinant technology' . Escherichia coli 'BL21(DE3) rosetta' pDEST17 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 _Isotopic_labeling $ATP7A 0.7 mM '[U-100% 15N]' DTT 1 mM 'natural abundance' 'potassium phosphate' 50 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $ATP7A 0.3 mM '[U-99% 13C; U-99% 15N]' DTT 1 mM 'natural abundance' 'potassium phosphate' 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CARA _Saveframe_category software _Name CARA _Version 1.5.3 loop_ _Vendor _Address _Electronic_address 'Keller and Wuthrich' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_2 save_ save_3D_HNCA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 save_ save_3D_HN(CO)CA_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_2 save_ save_3D_HN(CA)CO_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_2 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details 'These are the conditions for all the samples' loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_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 dioxane C 13 'methylene carbons' ppm 69.46 external direct . . . 1.0 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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_assigned_chem_shift_list_APOform _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $CARA stop_ loop_ _Experiment_label '3D CBCA(CO)NH' '3D HNCA' '3D HN(CO)CA' stop_ loop_ _Sample_label $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name ATP7A _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 6 6 VAL H H 9.263 0.040 1 2 6 6 VAL CA C 60.078 0.450 1 3 6 6 VAL N N 123.830 0.450 1 4 7 7 THR H H 8.503 0.040 1 5 7 7 THR CA C 61.748 0.450 1 6 7 7 THR N N 122.908 0.450 1 7 8 8 ILE H H 9.304 0.040 1 8 8 8 ILE N N 128.265 0.450 1 9 10 10 VAL H H 8.342 0.040 1 10 10 10 VAL CA C 61.990 0.450 1 11 10 10 VAL N N 125.544 0.450 1 12 11 11 GLU H H 8.883 0.040 1 13 11 11 GLU N N 126.886 0.450 1 14 12 12 GLY H H 8.496 0.040 1 15 12 12 GLY CA C 44.909 0.450 1 16 12 12 GLY N N 107.952 0.450 1 17 18 18 CYS H H 7.721 0.040 1 18 18 18 CYS N N 124.044 0.450 1 19 19 19 VAL H H 6.749 0.040 1 20 19 19 VAL N N 117.416 0.450 1 21 20 20 TRP H H 7.566 0.040 1 22 20 20 TRP CA C 59.822 0.450 1 23 20 20 TRP N N 117.622 0.450 1 24 26 26 ILE H H 8.592 0.040 1 25 26 26 ILE N N 118.644 0.450 1 26 27 27 GLY H H 7.420 0.040 1 27 27 27 GLY CA C 46.274 0.450 1 28 27 27 GLY N N 104.586 0.450 1 29 28 28 LYS H H 6.721 0.040 1 30 28 28 LYS C C 174.210 0.450 1 31 28 28 LYS CA C 56.093 0.450 1 32 28 28 LYS N N 115.473 0.450 1 33 29 29 VAL H H 7.470 0.040 1 34 29 29 VAL CA C 63.489 0.450 1 35 29 29 VAL N N 124.509 0.450 1 36 30 30 ASN H H 8.640 0.040 1 37 30 30 ASN C C 172.308 0.450 1 38 30 30 ASN CA C 54.879 0.450 1 39 30 30 ASN N N 127.091 0.450 1 40 31 31 GLY H H 8.734 0.040 1 41 31 31 GLY CA C 45.949 0.450 1 42 31 31 GLY N N 112.629 0.450 1 43 37 37 VAL H H 10.224 0.040 1 44 37 37 VAL C C 171.249 0.450 1 45 37 37 VAL CA C 61.391 0.450 1 46 37 37 VAL N N 133.145 0.450 1 47 39 39 LEU H H 9.007 0.040 1 48 39 39 LEU N N 130.601 0.450 1 49 40 40 GLU H H 8.725 0.040 1 50 40 40 GLU CA C 60.076 0.450 1 51 40 40 GLU N N 118.394 0.450 1 52 41 41 GLU H H 7.810 0.040 1 53 41 41 GLU C C 170.681 0.450 1 54 41 41 GLU CA C 57.905 0.450 1 55 41 41 GLU N N 114.578 0.450 1 56 42 42 LYS H H 7.449 0.040 1 57 42 42 LYS C C 172.833 0.450 1 58 42 42 LYS N N 117.401 0.450 1 59 43 43 ASN H H 8.045 0.040 1 60 43 43 ASN CA C 51.959 0.450 1 61 43 43 ASN N N 114.251 0.450 1 62 44 44 ALA H H 8.939 0.040 1 63 44 44 ALA CA C 50.592 0.450 1 64 44 44 ALA N N 118.470 0.450 1 65 45 45 THR H H 8.746 0.040 1 66 45 45 THR N N 120.628 0.450 1 67 46 46 ILE H H 9.172 0.040 1 68 46 46 ILE CA C 60.658 0.450 1 69 46 46 ILE N N 128.690 0.450 1 70 51 51 LYS H H 8.657 0.040 1 71 51 51 LYS CA C 57.859 0.450 1 72 51 51 LYS N N 119.307 0.450 1 73 52 52 LEU H H 7.814 0.040 1 74 52 52 LEU CA C 55.257 0.450 1 75 52 52 LEU N N 117.755 0.450 1 76 53 53 GLN H H 8.020 0.040 1 77 53 53 GLN CA C 52.761 0.450 1 78 53 53 GLN N N 116.160 0.450 1 79 56 56 LYS H H 7.390 0.040 1 80 56 56 LYS CA C 58.951 0.450 1 81 56 56 LYS N N 113.868 0.450 1 82 57 57 THR H H 7.970 0.040 1 83 57 57 THR CA C 65.645 0.450 1 84 57 57 THR N N 112.193 0.450 1 85 58 58 LEU H H 7.836 0.040 1 86 58 58 LEU CA C 58.000 0.450 1 87 58 58 LEU N N 125.848 0.450 1 88 59 59 GLN H H 8.185 0.040 1 89 59 59 GLN CA C 59.934 0.450 1 90 59 59 GLN N N 120.039 0.450 1 91 60 60 GLU H H 8.295 0.040 1 92 60 60 GLU CA C 59.316 0.450 1 93 60 60 GLU N N 118.227 0.450 1 94 61 61 ALA H H 7.511 0.040 1 95 61 61 ALA C C 177.440 0.450 1 96 61 61 ALA CA C 54.860 0.450 1 97 61 61 ALA N N 120.957 0.450 1 98 62 62 ILE H H 7.431 0.040 1 99 62 62 ILE CA C 66.017 0.450 1 100 62 62 ILE N N 118.797 0.450 1 101 63 63 ASP H H 8.446 0.040 1 102 63 63 ASP CA C 56.646 0.450 1 103 63 63 ASP N N 123.395 0.450 1 104 64 64 ASP H H 8.291 0.040 1 105 64 64 ASP CA C 56.629 0.450 1 106 64 64 ASP N N 119.192 0.450 1 107 65 65 MET H H 7.567 0.040 1 108 65 65 MET CA C 56.768 0.450 1 109 65 65 MET N N 116.169 0.450 1 110 66 66 GLY H H 8.031 0.040 1 111 66 66 GLY C C 170.973 0.450 1 112 66 66 GLY CA C 44.770 0.450 1 113 66 66 GLY N N 105.501 0.450 1 114 67 67 PHE H H 6.647 0.040 1 115 67 67 PHE CA C 56.961 0.450 1 116 67 67 PHE N N 118.752 0.450 1 117 68 68 ASP H H 7.886 0.040 1 118 68 68 ASP CA C 53.871 0.450 1 119 68 68 ASP N N 118.420 0.450 1 120 69 69 ALA H H 9.140 0.040 1 121 69 69 ALA N N 129.745 0.450 1 122 146 146 THR H H 8.302 0.040 1 123 146 146 THR C C 172.925 0.450 1 124 146 146 THR CA C 62.153 0.450 1 125 146 146 THR N N 115.641 0.450 1 126 147 147 GLY H H 8.497 0.040 1 127 147 147 GLY C C 171.788 0.450 1 128 147 147 GLY CA C 45.648 0.450 1 129 147 147 GLY N N 111.185 0.450 1 130 148 148 THR H H 7.923 0.040 1 131 148 148 THR C C 171.882 0.450 1 132 148 148 THR CA C 62.061 0.450 1 133 148 148 THR N N 113.762 0.450 1 134 149 149 LEU H H 8.106 0.040 1 135 149 149 LEU C C 174.835 0.450 1 136 149 149 LEU CA C 55.396 0.450 1 137 149 149 LEU N N 124.059 0.450 1 138 150 150 GLU H H 8.442 0.040 1 139 150 150 GLU N N 109.991 0.450 1 140 162 162 ALA H H 8.050 0.040 1 141 162 162 ALA CA C 52.527 0.450 1 142 162 162 ALA N N 124.575 0.450 1 143 163 163 GLN H H 8.346 0.040 1 144 163 163 GLN CA C 59.316 0.450 1 145 163 163 GLN N N 118.333 0.450 1 146 164 164 ALA H H 8.809 0.040 1 147 164 164 ALA CA C 52.886 0.450 1 148 164 164 ALA N N 118.724 0.450 1 149 165 165 GLY H H 8.344 0.040 1 150 165 165 GLY CA C 45.381 0.450 1 151 165 165 GLY N N 108.797 0.450 1 152 166 166 GLU H H 8.168 0.040 1 153 166 166 GLU CA C 58.505 0.450 1 154 166 166 GLU N N 115.551 0.450 1 155 171 171 MET H H 8.958 0.040 1 156 171 171 MET CA C 53.692 0.450 1 157 171 171 MET CB C 37.006 0.450 1 158 171 171 MET N N 120.589 0.450 1 159 172 172 LYS H H 9.209 0.040 1 160 172 172 LYS C C 172.686 0.450 1 161 172 172 LYS CA C 55.715 0.450 1 162 172 172 LYS CB C 31.814 0.450 1 163 172 172 LYS N N 126.730 0.450 1 164 173 173 VAL H H 7.880 0.040 1 165 173 173 VAL C C 172.746 0.450 1 166 173 173 VAL CA C 61.437 0.450 1 167 173 173 VAL CB C 34.123 0.450 1 168 173 173 VAL N N 126.318 0.450 1 169 174 174 GLU H H 9.012 0.040 1 170 174 174 GLU C C 172.566 0.450 1 171 174 174 GLU CA C 55.619 0.450 1 172 174 174 GLU CB C 31.860 0.450 1 173 174 174 GLU N N 126.482 0.450 1 174 175 175 GLY H H 8.199 0.040 1 175 175 175 GLY C C 173.165 0.450 1 176 175 175 GLY CA C 45.721 0.450 1 177 175 175 GLY N N 102.936 0.450 1 178 176 176 MET H H 8.920 0.040 1 179 176 176 MET CA C 56.556 0.450 1 180 176 176 MET N N 120.066 0.450 1 181 181 181 CYS H H 7.800 0.040 1 182 181 181 CYS C C 174.511 0.450 1 183 181 181 CYS CA C 63.202 0.450 1 184 181 181 CYS CB C 28.278 0.450 1 185 181 181 CYS N N 122.745 0.450 1 186 182 182 THR H H 7.338 0.040 1 187 182 182 THR CA C 65.530 0.450 1 188 182 182 THR CB C 67.156 0.450 1 189 182 182 THR N N 108.948 0.450 1 190 183 183 SER H H 7.464 0.040 1 191 183 183 SER CA C 61.013 0.450 1 192 183 183 SER CB C 62.545 0.450 1 193 183 183 SER N N 117.636 0.450 1 194 184 184 THR H H 8.064 0.040 1 195 184 184 THR CA C 66.684 0.450 1 196 184 184 THR CB C 68.481 0.450 1 197 184 184 THR N N 121.331 0.450 1 198 185 185 ILE H H 7.657 0.040 1 199 185 185 ILE C C 175.199 0.450 1 200 185 185 ILE CA C 66.365 0.450 1 201 185 185 ILE N N 121.658 0.450 1 202 186 186 GLU H H 8.289 0.040 1 203 186 186 GLU C C 177.862 0.450 1 204 186 186 GLU CA C 59.930 0.450 1 205 186 186 GLU CB C 29.228 0.450 1 206 186 186 GLU N N 117.422 0.450 1 207 187 187 GLY H H 8.309 0.040 1 208 187 187 GLY C C 172.087 0.450 1 209 187 187 GLY CA C 46.749 0.450 1 210 187 187 GLY N N 105.884 0.450 1 211 188 188 LYS H H 7.413 0.040 1 212 188 188 LYS CA C 58.420 0.450 1 213 188 188 LYS N N 119.130 0.450 1 214 189 189 ILE H H 8.360 0.040 1 215 189 189 ILE C C 174.990 0.450 1 216 189 189 ILE CA C 60.373 0.450 1 217 189 189 ILE CB C 34.315 0.450 1 218 189 189 ILE N N 117.092 0.450 1 219 190 190 GLY H H 7.756 0.040 1 220 190 190 GLY C C 171.070 0.450 1 221 190 190 GLY CA C 46.064 0.450 1 222 190 190 GLY N N 103.135 0.450 1 223 191 191 LYS H H 6.582 0.040 1 224 191 191 LYS C C 174.481 0.450 1 225 191 191 LYS CA C 55.695 0.450 1 226 191 191 LYS CB C 33.034 0.450 1 227 191 191 LYS N N 115.078 0.450 1 228 192 192 LEU H H 7.399 0.040 1 229 192 192 LEU C C 174.870 0.450 1 230 192 192 LEU CA C 54.826 0.450 1 231 192 192 LEU CB C 41.016 0.450 1 232 192 192 LEU N N 121.241 0.450 1 233 193 193 GLN H H 8.601 0.040 1 234 193 193 GLN C C 172.746 0.450 1 235 193 193 GLN CA C 57.500 0.450 1 236 193 193 GLN CB C 27.911 0.450 1 237 193 193 GLN N N 124.421 0.450 1 238 194 194 GLY H H 8.573 0.040 1 239 194 194 GLY C C 171.249 0.450 1 240 194 194 GLY CA C 45.979 0.450 1 241 194 194 GLY N N 110.547 0.450 1 242 195 195 VAL H H 7.643 0.040 1 243 195 195 VAL C C 172.985 0.450 1 244 195 195 VAL CA C 63.943 0.450 1 245 195 195 VAL CB C 30.985 0.450 1 246 195 195 VAL N N 120.705 0.450 1 247 196 196 GLN H H 9.118 0.040 1 248 196 196 GLN C C 173.943 0.450 1 249 196 196 GLN CA C 56.415 0.450 1 250 196 196 GLN CB C 28.206 0.450 1 251 196 196 GLN N N 127.673 0.450 1 252 197 197 ARG H H 7.727 0.040 1 253 197 197 ARG C C 170.591 0.450 1 254 197 197 ARG CA C 55.533 0.450 1 255 197 197 ARG CB C 33.320 0.450 1 256 197 197 ARG N N 115.537 0.450 1 257 198 198 ILE H H 8.538 0.040 1 258 198 198 ILE C C 173.000 0.450 1 259 198 198 ILE CA C 58.831 0.450 1 260 198 198 ILE N N 119.633 0.450 1 261 199 199 LYS H H 8.345 0.040 1 262 199 199 LYS C C 172.776 0.450 1 263 199 199 LYS CA C 53.667 0.450 1 264 199 199 LYS CB C 35.343 0.450 1 265 199 199 LYS N N 126.594 0.450 1 266 200 200 VAL H H 10.241 0.040 1 267 200 200 VAL C C 171.339 0.450 1 268 200 200 VAL CA C 61.356 0.450 1 269 200 200 VAL N N 129.436 0.450 1 270 201 201 SER H H 8.741 0.040 1 271 201 201 SER CA C 54.996 0.450 1 272 201 201 SER CB C 63.937 0.450 1 273 201 201 SER N N 120.846 0.450 1 274 202 202 LEU H H 9.050 0.040 1 275 202 202 LEU C C 176.815 0.450 1 276 202 202 LEU CA C 58.016 0.450 1 277 202 202 LEU CB C 41.763 0.450 1 278 202 202 LEU N N 130.511 0.450 1 279 203 203 ASP H H 8.365 0.040 1 280 203 203 ASP C C 174.601 0.450 1 281 203 203 ASP CA C 57.046 0.450 1 282 203 203 ASP CB C 39.964 0.450 1 283 203 203 ASP N N 117.459 0.450 1 284 204 204 ASN H H 7.630 0.040 1 285 204 204 ASN C C 170.911 0.450 1 286 204 204 ASN CA C 52.203 0.450 1 287 204 204 ASN CB C 38.391 0.450 1 288 204 204 ASN N N 112.825 0.450 1 289 205 205 GLN H H 7.578 0.040 1 290 205 205 GLN C C 171.875 0.450 1 291 205 205 GLN CA C 56.978 0.450 1 292 205 205 GLN CB C 26.072 0.450 1 293 205 205 GLN N N 117.550 0.450 1 294 206 206 GLU H H 7.602 0.040 1 295 206 206 GLU C C 171.618 0.450 1 296 206 206 GLU CA C 54.710 0.450 1 297 206 206 GLU CB C 33.396 0.450 1 298 206 206 GLU N N 115.145 0.450 1 299 207 207 ALA H H 9.422 0.040 1 300 207 207 ALA C C 172.679 0.450 1 301 207 207 ALA CA C 49.832 0.450 1 302 207 207 ALA CB C 21.188 0.450 1 303 207 207 ALA N N 127.092 0.450 1 304 208 208 THR H H 8.958 0.040 1 305 208 208 THR CA C 62.725 0.450 1 306 208 208 THR CB C 69.152 0.450 1 307 208 208 THR N N 120.430 0.450 1 308 209 209 ILE C C 171.369 0.450 1 309 209 209 ILE CA C 60.458 0.450 1 310 209 209 ILE CB C 41.784 0.450 1 311 210 210 VAL H H 8.952 0.040 1 312 210 210 VAL C C 173.109 0.450 1 313 210 210 VAL CA C 61.338 0.450 1 314 210 210 VAL CB C 32.397 0.450 1 315 210 210 VAL N N 128.141 0.450 1 316 211 211 TYR H H 9.393 0.040 1 317 211 211 TYR C C 169.426 0.450 1 318 211 211 TYR CA C 54.851 0.450 1 319 211 211 TYR CB C 41.246 0.450 1 320 211 211 TYR N N 126.473 0.450 1 321 212 212 GLN H H 8.704 0.040 1 322 212 212 GLN CA C 51.953 0.450 1 323 212 212 GLN CB C 27.542 0.450 1 324 212 212 GLN N N 119.299 0.450 1 325 213 213 PRO CA C 63.706 0.450 1 326 213 213 PRO CB C 32.052 0.450 1 327 214 214 HIS H H 8.284 0.040 1 328 214 214 HIS C C 172.684 0.450 1 329 214 214 HIS CA C 57.563 0.450 1 330 214 214 HIS CB C 29.098 0.450 1 331 214 214 HIS N N 114.027 0.450 1 332 215 215 LEU H H 7.637 0.040 1 333 215 215 LEU C C 172.759 0.450 1 334 215 215 LEU CA C 54.874 0.450 1 335 215 215 LEU CB C 45.159 0.450 1 336 215 215 LEU N N 119.701 0.450 1 337 216 216 ILE H H 7.817 0.040 1 338 216 216 ILE C C 167.497 0.450 1 339 216 216 ILE CA C 60.569 0.450 1 340 216 216 ILE CB C 39.947 0.450 1 341 216 216 ILE N N 119.929 0.450 1 342 217 217 SER H H 7.428 0.040 1 343 217 217 SER C C 172.659 0.450 1 344 217 217 SER CA C 55.465 0.450 1 345 217 217 SER CB C 69.470 0.450 1 346 217 217 SER N N 117.088 0.450 1 347 218 218 VAL H H 8.401 0.040 1 348 218 218 VAL CA C 66.832 0.450 1 349 218 218 VAL CB C 31.215 0.450 1 350 218 218 VAL N N 120.919 0.450 1 351 219 219 GLU H H 8.501 0.040 1 352 219 219 GLU C C 176.097 0.450 1 353 219 219 GLU CA C 60.358 0.450 1 354 219 219 GLU CB C 28.507 0.450 1 355 219 219 GLU N N 117.673 0.450 1 356 220 220 GLU H H 7.756 0.040 1 357 220 220 GLU CA C 58.821 0.450 1 358 220 220 GLU CB C 29.519 0.450 1 359 220 220 GLU N N 120.186 0.450 1 360 221 221 MET H H 7.459 0.040 1 361 221 221 MET CA C 58.459 0.450 1 362 221 221 MET CB C 32.919 0.450 1 363 221 221 MET N N 117.886 0.450 1 364 222 222 LYS H H 8.371 0.040 1 365 222 222 LYS C C 174.698 0.450 1 366 222 222 LYS CA C 60.528 0.450 1 367 222 222 LYS N N 118.184 0.450 1 368 223 223 LYS H H 7.974 0.040 1 369 223 223 LYS C C 177.251 0.450 1 370 223 223 LYS CA C 59.402 0.450 1 371 223 223 LYS CB C 32.213 0.450 1 372 223 223 LYS N N 117.605 0.450 1 373 224 224 GLN H H 7.897 0.040 1 374 224 224 GLN C C 176.018 0.450 1 375 224 224 GLN CA C 58.870 0.450 1 376 224 224 GLN CB C 26.961 0.450 1 377 224 224 GLN N N 117.533 0.450 1 378 225 225 ILE H H 7.783 0.040 1 379 225 225 ILE C C 175.705 0.450 1 380 225 225 ILE CA C 66.689 0.450 1 381 225 225 ILE N N 121.395 0.450 1 382 226 226 GLU H H 8.408 0.040 1 383 226 226 GLU C C 179.145 0.450 1 384 226 226 GLU CA C 59.250 0.450 1 385 226 226 GLU N N 119.540 0.450 1 386 227 227 ALA H H 8.159 0.040 1 387 227 227 ALA C C 176.539 0.450 1 388 227 227 ALA CA C 54.225 0.450 1 389 227 227 ALA CB C 17.755 0.450 1 390 227 227 ALA N N 122.541 0.450 1 391 228 228 MET H H 7.468 0.040 1 392 228 228 MET C C 172.561 0.450 1 393 228 228 MET CA C 56.599 0.450 1 394 228 228 MET CB C 33.757 0.450 1 395 228 228 MET N N 115.455 0.450 1 396 229 229 GLY H H 7.758 0.040 1 397 229 229 GLY C C 170.004 0.450 1 398 229 229 GLY CA C 44.058 0.450 1 399 229 229 GLY N N 104.400 0.450 1 400 230 230 PHE H H 6.667 0.040 1 401 230 230 PHE CA C 54.394 0.450 1 402 230 230 PHE CB C 37.847 0.450 1 403 230 230 PHE N N 120.820 0.450 1 404 231 231 PRO CA C 63.463 0.450 1 405 232 232 ALA H H 7.995 0.040 1 406 232 232 ALA C C 173.295 0.450 1 407 232 232 ALA CA C 50.245 0.450 1 408 232 232 ALA CB C 22.304 0.450 1 409 232 232 ALA N N 124.320 0.450 1 410 233 233 PHE H H 8.592 0.040 1 411 233 233 PHE C C 172.261 0.450 1 412 233 233 PHE CA C 56.064 0.450 1 413 233 233 PHE CB C 41.939 0.450 1 414 233 233 PHE N N 116.622 0.450 1 415 234 234 VAL H H 8.894 0.040 1 416 234 234 VAL C C 173.212 0.450 1 417 234 234 VAL CA C 64.248 0.450 1 418 234 234 VAL CB C 31.872 0.450 1 419 234 234 VAL N N 124.559 0.450 1 420 235 235 LYS H H 8.498 0.040 1 421 235 235 LYS CA C 56.590 0.450 1 422 235 235 LYS N N 128.571 0.450 1 423 273 273 SER H H 8.511 0.040 1 424 273 273 SER CA C 58.246 0.450 1 425 273 273 SER CB C 63.747 0.450 1 426 273 273 SER N N 117.662 0.450 1 427 274 274 THR H H 8.195 0.040 1 428 274 274 THR C C 171.355 0.450 1 429 274 274 THR CA C 61.883 0.450 1 430 274 274 THR CB C 70.830 0.450 1 431 274 274 THR N N 115.675 0.450 1 432 275 275 ALA H H 9.557 0.040 1 433 275 275 ALA C C 171.534 0.450 1 434 275 275 ALA CA C 50.720 0.450 1 435 275 275 ALA CB C 22.221 0.450 1 436 275 275 ALA N N 130.559 0.450 1 437 276 276 THR H H 8.223 0.040 1 438 276 276 THR C C 170.023 0.450 1 439 276 276 THR CA C 60.792 0.450 1 440 276 276 THR CB C 70.197 0.450 1 441 276 276 THR N N 114.384 0.450 1 442 277 277 PHE H H 8.907 0.040 1 443 277 277 PHE C C 172.895 0.450 1 444 277 277 PHE CA C 55.900 0.450 1 445 277 277 PHE CB C 42.505 0.450 1 446 277 277 PHE N N 121.073 0.450 1 447 278 278 ILE H H 8.929 0.040 1 448 278 278 ILE C C 172.815 0.450 1 449 278 278 ILE CA C 59.133 0.450 1 450 278 278 ILE CB C 38.590 0.450 1 451 278 278 ILE N N 122.848 0.450 1 452 279 279 ILE H H 8.678 0.040 1 453 279 279 ILE C C 172.117 0.450 1 454 279 279 ILE CA C 60.403 0.450 1 455 279 279 ILE CB C 38.932 0.450 1 456 279 279 ILE N N 127.154 0.450 1 457 280 280 ASP H H 8.821 0.040 1 458 280 280 ASP C C 173.763 0.450 1 459 280 280 ASP CA C 54.431 0.450 1 460 280 280 ASP CB C 42.572 0.450 1 461 280 280 ASP N N 127.342 0.450 1 462 281 281 GLY H H 8.390 0.040 1 463 281 281 GLY C C 172.865 0.450 1 464 281 281 GLY CA C 44.944 0.450 1 465 281 281 GLY N N 111.459 0.450 1 466 287 287 CYS H H 7.472 0.040 1 467 287 287 CYS C C 174.900 0.450 1 468 287 287 CYS CA C 65.446 0.450 1 469 287 287 CYS CB C 29.523 0.450 1 470 287 287 CYS N N 124.711 0.450 1 471 288 288 VAL H H 6.518 0.040 1 472 288 288 VAL CA C 66.542 0.450 1 473 288 288 VAL CB C 31.501 0.450 1 474 288 288 VAL N N 116.020 0.450 1 475 289 289 SER H H 7.655 0.040 1 476 289 289 SER C C 175.020 0.450 1 477 289 289 SER CA C 61.177 0.450 1 478 289 289 SER CB C 62.624 0.450 1 479 289 289 SER N N 111.722 0.450 1 480 290 290 ASN H H 8.814 0.040 1 481 290 290 ASN C C 175.858 0.450 1 482 290 290 ASN CA C 55.854 0.450 1 483 290 290 ASN CB C 37.305 0.450 1 484 290 290 ASN N N 121.704 0.450 1 485 290 290 ASN ND2 N 111.386 0.450 1 486 291 291 ILE H H 8.437 0.040 1 487 291 291 ILE C C 174.817 0.450 1 488 291 291 ILE CA C 66.883 0.450 1 489 291 291 ILE CB C 38.207 0.450 1 490 291 291 ILE N N 122.575 0.450 1 491 292 292 GLU H H 8.585 0.040 1 492 292 292 GLU C C 177.294 0.450 1 493 292 292 GLU CA C 60.728 0.450 1 494 292 292 GLU CB C 29.278 0.450 1 495 292 292 GLU N N 117.574 0.450 1 496 293 293 SER H H 8.688 0.040 1 497 293 293 SER CA C 61.943 0.450 1 498 293 293 SER CB C 62.812 0.450 1 499 293 293 SER N N 115.003 0.450 1 500 294 294 THR H H 7.638 0.040 1 501 294 294 THR CA C 66.878 0.450 1 502 294 294 THR N N 118.269 0.450 1 503 295 295 LEU H H 7.894 0.040 1 504 295 295 LEU CA C 57.283 0.450 1 505 295 295 LEU CB C 40.856 0.450 1 506 295 295 LEU N N 122.044 0.450 1 507 296 296 SER H H 8.020 0.040 1 508 296 296 SER CA C 61.440 0.450 1 509 296 296 SER CB C 62.999 0.450 1 510 296 296 SER N N 111.343 0.450 1 511 297 297 ALA H H 6.725 0.040 1 512 297 297 ALA CA C 52.499 0.450 1 513 297 297 ALA N N 120.310 0.450 1 514 298 298 LEU H H 7.200 0.040 1 515 298 298 LEU CA C 51.501 0.450 1 516 298 298 LEU CB C 38.326 0.450 1 517 298 298 LEU N N 119.863 0.450 1 518 301 301 VAL H H 7.203 0.040 1 519 301 301 VAL CA C 59.786 0.450 1 520 301 301 VAL N N 122.703 0.450 1 521 302 302 SER CA C 58.662 0.450 1 522 302 302 SER CB C 63.555 0.450 1 523 303 303 SER H H 7.588 0.040 1 524 303 303 SER C C 169.215 0.450 1 525 303 303 SER CA C 58.084 0.450 1 526 303 303 SER N N 114.022 0.450 1 527 304 304 ILE H H 8.394 0.040 1 528 304 304 ILE CA C 59.137 0.450 1 529 304 304 ILE CB C 40.156 0.450 1 530 304 304 ILE N N 120.939 0.450 1 531 305 305 VAL H H 8.182 0.040 1 532 305 305 VAL C C 173.075 0.450 1 533 305 305 VAL CA C 61.028 0.450 1 534 305 305 VAL CB C 34.716 0.450 1 535 305 305 VAL N N 125.657 0.450 1 536 306 306 VAL H H 9.712 0.040 1 537 306 306 VAL C C 171.279 0.450 1 538 306 306 VAL CA C 60.640 0.450 1 539 306 306 VAL CB C 32.490 0.450 1 540 306 306 VAL N N 131.680 0.450 1 541 307 307 SER H H 8.756 0.040 1 542 307 307 SER C C 172.509 0.450 1 543 307 307 SER CA C 55.048 0.450 1 544 307 307 SER CB C 63.807 0.450 1 545 307 307 SER N N 120.835 0.450 1 546 308 308 LEU H H 8.931 0.040 1 547 308 308 LEU C C 176.755 0.450 1 548 308 308 LEU CA C 57.810 0.450 1 549 308 308 LEU CB C 41.752 0.450 1 550 308 308 LEU N N 130.184 0.450 1 551 309 309 GLU H H 8.840 0.040 1 552 309 309 GLU C C 174.870 0.450 1 553 309 309 GLU CA C 60.014 0.450 1 554 309 309 GLU CB C 28.784 0.450 1 555 309 309 GLU N N 117.966 0.450 1 556 310 310 ASN H H 7.567 0.040 1 557 310 310 ASN C C 170.860 0.450 1 558 310 310 ASN CA C 52.436 0.450 1 559 310 310 ASN CB C 38.497 0.450 1 560 310 310 ASN N N 113.237 0.450 1 561 310 310 ASN ND2 N 112.608 0.450 1 562 311 311 ARG H H 7.635 0.040 1 563 311 311 ARG C C 171.190 0.450 1 564 311 311 ARG CA C 57.182 0.450 1 565 311 311 ARG CB C 26.804 0.450 1 566 311 311 ARG N N 118.135 0.450 1 567 312 312 SER H H 7.925 0.040 1 568 312 312 SER C C 170.741 0.450 1 569 312 312 SER CA C 56.183 0.450 1 570 312 312 SER CB C 68.137 0.450 1 571 312 312 SER N N 108.807 0.450 1 572 313 313 ALA H H 8.664 0.040 1 573 313 313 ALA C C 172.535 0.450 1 574 313 313 ALA CA C 50.573 0.450 1 575 313 313 ALA CB C 22.990 0.450 1 576 313 313 ALA N N 119.263 0.450 1 577 314 314 ILE H H 8.560 0.040 1 578 314 314 ILE C C 173.374 0.450 1 579 314 314 ILE CA C 61.044 0.450 1 580 314 314 ILE CB C 39.858 0.450 1 581 314 314 ILE N N 122.335 0.450 1 582 315 315 VAL H H 9.474 0.040 1 583 315 315 VAL CA C 60.955 0.450 1 584 315 315 VAL N N 129.548 0.450 1 585 317 317 TYR H H 9.354 0.040 1 586 317 317 TYR CA C 55.285 0.450 1 587 317 317 TYR CB C 41.979 0.450 1 588 317 317 TYR N N 125.393 0.450 1 589 318 318 ASN H H 8.206 0.040 1 590 318 318 ASN CA C 52.138 0.450 1 591 318 318 ASN CB C 37.962 0.450 1 592 318 318 ASN N N 117.462 0.450 1 593 318 318 ASN ND2 N 111.703 0.450 1 594 319 319 ALA H H 8.555 0.040 1 595 319 319 ALA C C 175.738 0.450 1 596 319 319 ALA CA C 53.436 0.450 1 597 319 319 ALA CB C 18.711 0.450 1 598 319 319 ALA N N 129.587 0.450 1 599 320 320 SER H H 8.292 0.040 1 600 320 320 SER C C 172.476 0.450 1 601 320 320 SER CA C 60.420 0.450 1 602 320 320 SER CB C 63.119 0.450 1 603 320 320 SER N N 112.558 0.450 1 604 321 321 SER H H 7.635 0.040 1 605 321 321 SER N N 114.828 0.450 1 606 327 327 LEU H H 7.524 0.040 1 607 327 327 LEU C C 174.152 0.450 1 608 327 327 LEU CA C 57.503 0.450 1 609 327 327 LEU N N 122.115 0.450 1 610 328 328 ARG H H 8.398 0.040 1 611 328 328 ARG CA C 59.874 0.450 1 612 328 328 ARG N N 120.749 0.450 1 613 329 329 LYS H H 7.735 0.040 1 614 329 329 LYS C C 176.396 0.450 1 615 329 329 LYS CA C 59.202 0.450 1 616 329 329 LYS CB C 32.223 0.450 1 617 329 329 LYS N N 116.326 0.450 1 618 330 330 ALA H H 7.804 0.040 1 619 330 330 ALA C C 177.234 0.450 1 620 330 330 ALA CA C 54.808 0.450 1 621 330 330 ALA CB C 17.173 0.450 1 622 330 330 ALA N N 123.153 0.450 1 623 331 331 ILE H H 7.687 0.040 1 624 331 331 ILE C C 175.289 0.450 1 625 331 331 ILE CA C 65.655 0.450 1 626 331 331 ILE CB C 37.104 0.450 1 627 331 331 ILE N N 116.719 0.450 1 628 332 332 GLU H H 7.586 0.040 1 629 332 332 GLU CA C 61.093 0.450 1 630 332 332 GLU CB C 29.268 0.450 1 631 332 332 GLU N N 118.462 0.450 1 632 333 333 ALA H H 7.622 0.040 1 633 333 333 ALA C C 175.199 0.450 1 634 333 333 ALA CA C 52.904 0.450 1 635 333 333 ALA CB C 17.934 0.450 1 636 333 333 ALA N N 116.501 0.450 1 637 334 334 VAL H H 7.609 0.040 1 638 334 334 VAL C C 174.332 0.450 1 639 334 334 VAL CA C 65.988 0.450 1 640 334 334 VAL CB C 31.088 0.450 1 641 334 334 VAL N N 120.081 0.450 1 642 335 335 SER H H 6.505 0.040 1 643 335 335 SER CA C 55.321 0.450 1 644 335 335 SER N N 110.034 0.450 1 645 336 336 PRO CA C 64.464 0.450 1 646 336 336 PRO CB C 31.625 0.450 1 647 337 337 GLY H H 8.788 0.040 1 648 337 337 GLY C C 170.920 0.450 1 649 337 337 GLY CA C 45.270 0.450 1 650 337 337 GLY N N 113.800 0.450 1 651 338 338 LEU H H 7.844 0.040 1 652 338 338 LEU C C 174.002 0.450 1 653 338 338 LEU CA C 55.790 0.450 1 654 338 338 LEU CB C 43.209 0.450 1 655 338 338 LEU N N 121.804 0.450 1 656 339 339 TYR H H 7.369 0.040 1 657 339 339 TYR C C 173.703 0.450 1 658 339 339 TYR CA C 53.542 0.450 1 659 339 339 TYR CB C 38.332 0.450 1 660 339 339 TYR N N 115.466 0.450 1 661 340 340 ARG H H 8.680 0.040 1 662 340 340 ARG C C 173.075 0.450 1 663 340 340 ARG CA C 55.196 0.450 1 664 340 340 ARG CB C 31.651 0.450 1 665 340 340 ARG N N 124.083 0.450 1 666 341 341 VAL H H 9.986 0.040 1 667 341 341 VAL C C 172.416 0.450 1 668 341 341 VAL CA C 61.049 0.450 1 669 341 341 VAL CB C 33.536 0.450 1 670 341 341 VAL N N 128.969 0.450 1 671 342 342 SER H H 9.189 0.040 1 672 342 342 SER C C 170.352 0.450 1 673 342 342 SER CA C 56.545 0.450 1 674 342 342 SER CB C 65.508 0.450 1 675 342 342 SER N N 122.726 0.450 1 676 343 343 ILE H H 8.923 0.040 1 677 343 343 ILE C C 174.002 0.450 1 678 343 343 ILE CA C 62.044 0.450 1 679 343 343 ILE CB C 38.895 0.450 1 680 343 343 ILE N N 124.261 0.450 1 681 344 344 THR H H 8.456 0.040 1 682 344 344 THR C C 171.220 0.450 1 683 344 344 THR CA C 61.313 0.450 1 684 344 344 THR CB C 69.548 0.450 1 685 344 344 THR N N 120.637 0.450 1 686 345 345 SER H H 7.918 0.040 1 687 345 345 SER CA C 57.853 0.450 1 688 345 345 SER CB C 63.657 0.450 1 689 345 345 SER N N 116.749 0.450 1 690 346 346 GLU H H 8.361 0.040 1 691 346 346 GLU CA C 56.580 0.450 1 692 346 346 GLU N N 122.076 0.450 1 693 347 347 VAL H H 7.979 0.040 1 694 347 347 VAL CA C 62.532 0.450 1 695 347 347 VAL CB C 32.602 0.450 1 696 347 347 VAL N N 120.518 0.450 1 697 348 348 GLU H H 8.384 0.040 1 698 348 348 GLU CA C 55.826 0.450 1 699 348 348 GLU CB C 27.360 0.450 1 700 348 348 GLU N N 124.257 0.450 1 701 372 372 THR H H 7.670 0.040 1 702 372 372 THR C C 170.696 0.450 1 703 372 372 THR CA C 59.775 0.450 1 704 372 372 THR CB C 71.298 0.450 1 705 372 372 THR N N 111.251 0.450 1 706 373 373 GLN H H 8.375 0.040 1 707 373 373 GLN CA C 53.651 0.450 1 708 373 373 GLN N N 118.880 0.450 1 709 374 374 GLU H H 8.392 0.040 1 710 374 374 GLU C C 173.812 0.450 1 711 374 374 GLU CA C 54.596 0.450 1 712 374 374 GLU N N 118.731 0.450 1 713 375 375 THR H H 8.972 0.040 1 714 375 375 THR CA C 60.620 0.450 1 715 375 375 THR N N 119.930 0.450 1 716 376 376 VAL H H 8.044 0.040 1 717 376 376 VAL C C 172.221 0.450 1 718 376 376 VAL CA C 61.490 0.450 1 719 376 376 VAL CB C 32.875 0.450 1 720 376 376 VAL N N 127.370 0.450 1 721 377 377 ILE H H 9.095 0.040 1 722 377 377 ILE C C 172.941 0.450 1 723 377 377 ILE CA C 59.857 0.450 1 724 377 377 ILE CB C 41.088 0.450 1 725 377 377 ILE N N 128.429 0.450 1 726 378 378 ASN H H 9.207 0.040 1 727 378 378 ASN C C 171.968 0.450 1 728 378 378 ASN CA C 53.944 0.450 1 729 378 378 ASN N N 128.149 0.450 1 730 379 379 ILE H H 8.235 0.040 1 731 379 379 ILE C C 171.300 0.450 1 732 379 379 ILE CA C 61.017 0.450 1 733 379 379 ILE CB C 41.187 0.450 1 734 379 379 ILE N N 124.010 0.450 1 735 380 380 ASP H H 9.059 0.040 1 736 380 380 ASP C C 173.226 0.450 1 737 380 380 ASP CA C 53.248 0.450 1 738 380 380 ASP N N 127.833 0.450 1 739 381 381 GLY H H 8.288 0.040 1 740 381 381 GLY C C 173.293 0.450 1 741 381 381 GLY CA C 44.972 0.450 1 742 381 381 GLY N N 108.304 0.450 1 743 382 382 MET H H 8.997 0.040 1 744 382 382 MET C C 174.523 0.450 1 745 382 382 MET CA C 57.084 0.450 1 746 382 382 MET N N 120.682 0.450 1 747 387 387 CYS H H 7.738 0.040 1 748 387 387 CYS C C 174.183 0.450 1 749 387 387 CYS CA C 63.324 0.450 1 750 387 387 CYS CB C 28.271 0.450 1 751 387 387 CYS N N 124.569 0.450 1 752 388 388 VAL H H 6.750 0.040 1 753 388 388 VAL C C 174.760 0.450 1 754 388 388 VAL CA C 66.442 0.450 1 755 388 388 VAL N N 117.936 0.450 1 756 389 389 GLN H H 7.811 0.040 1 757 389 389 GLN C C 177.257 0.450 1 758 389 389 GLN CA C 58.639 0.450 1 759 389 389 GLN CB C 28.271 0.450 1 760 389 389 GLN N N 115.565 0.450 1 761 390 390 SER H H 8.159 0.040 1 762 390 390 SER C C 173.578 0.450 1 763 390 390 SER CA C 61.614 0.450 1 764 390 390 SER N N 116.759 0.450 1 765 391 391 ILE H H 7.946 0.040 1 766 391 391 ILE C C 175.523 0.450 1 767 391 391 ILE CA C 65.980 0.450 1 768 391 391 ILE N N 121.273 0.450 1 769 392 392 GLU H H 8.385 0.040 1 770 392 392 GLU C C 177.179 0.450 1 771 392 392 GLU CA C 60.428 0.450 1 772 392 392 GLU CB C 28.893 0.450 1 773 392 392 GLU N N 116.757 0.450 1 774 393 393 GLY H H 8.278 0.040 1 775 393 393 GLY C C 172.768 0.450 1 776 393 393 GLY CA C 47.239 0.450 1 777 393 393 GLY N N 106.836 0.450 1 778 394 394 VAL H H 7.663 0.040 1 779 394 394 VAL C C 176.968 0.450 1 780 394 394 VAL CA C 65.971 0.450 1 781 394 394 VAL N N 120.124 0.450 1 782 395 395 ILE H H 8.555 0.040 1 783 395 395 ILE C C 175.365 0.450 1 784 395 395 ILE CA C 61.137 0.450 1 785 395 395 ILE CB C 33.804 0.450 1 786 395 395 ILE N N 118.524 0.450 1 787 396 396 SER H H 7.957 0.040 1 788 396 396 SER C C 171.869 0.450 1 789 396 396 SER CA C 61.667 0.450 1 790 396 396 SER CB C 63.080 0.450 1 791 396 396 SER N N 111.444 0.450 1 792 397 397 LYS H H 6.696 0.040 1 793 397 397 LYS C C 174.708 0.450 1 794 397 397 LYS CA C 55.510 0.450 1 795 397 397 LYS CB C 32.925 0.450 1 796 397 397 LYS N N 117.297 0.450 1 797 398 398 LYS H H 7.640 0.040 1 798 398 398 LYS C C 171.850 0.450 1 799 398 398 LYS CA C 53.723 0.450 1 800 398 398 LYS CB C 29.553 0.450 1 801 398 398 LYS N N 121.701 0.450 1 802 399 399 PRO CA C 63.836 0.450 1 803 399 399 PRO CB C 31.621 0.450 1 804 400 400 GLY H H 8.817 0.040 1 805 400 400 GLY C C 171.023 0.450 1 806 400 400 GLY CA C 46.549 0.450 1 807 400 400 GLY N N 107.659 0.450 1 808 401 401 VAL H H 7.366 0.040 1 809 401 401 VAL C C 172.905 0.450 1 810 401 401 VAL CA C 64.845 0.450 1 811 401 401 VAL CB C 31.465 0.450 1 812 401 401 VAL N N 120.387 0.450 1 813 402 402 LYS H H 9.116 0.040 1 814 402 402 LYS C C 173.889 0.450 1 815 402 402 LYS CA C 56.152 0.450 1 816 402 402 LYS CB C 32.439 0.450 1 817 402 402 LYS N N 129.756 0.450 1 818 403 403 SER H H 7.742 0.040 1 819 403 403 SER C C 169.199 0.450 1 820 403 403 SER CA C 57.731 0.450 1 821 403 403 SER CB C 65.251 0.450 1 822 403 403 SER N N 110.930 0.450 1 823 404 404 ILE H H 8.537 0.040 1 824 404 404 ILE C C 169.104 0.450 1 825 404 404 ILE CA C 58.833 0.450 1 826 404 404 ILE CB C 32.062 0.450 1 827 404 404 ILE N N 119.075 0.450 1 828 405 405 ARG H H 8.175 0.040 1 829 405 405 ARG C C 173.145 0.450 1 830 405 405 ARG CA C 54.005 0.450 1 831 405 405 ARG CB C 32.062 0.450 1 832 405 405 ARG N N 125.538 0.450 1 833 406 406 VAL H H 10.318 0.040 1 834 406 406 VAL C C 171.189 0.450 1 835 406 406 VAL CA C 61.701 0.450 1 836 406 406 VAL CB C 31.869 0.450 1 837 406 406 VAL N N 131.262 0.450 1 838 407 407 SER H H 9.030 0.040 1 839 407 407 SER C C 172.353 0.450 1 840 407 407 SER CA C 54.908 0.450 1 841 407 407 SER CB C 64.228 0.450 1 842 407 407 SER N N 121.144 0.450 1 843 408 408 LEU H H 8.783 0.040 1 844 408 408 LEU C C 177.330 0.450 1 845 408 408 LEU CA C 57.731 0.450 1 846 408 408 LEU CB C 41.939 0.450 1 847 408 408 LEU N N 130.413 0.450 1 848 409 409 ALA H H 8.352 0.040 1 849 409 409 ALA C C 176.668 0.450 1 850 409 409 ALA CA C 54.923 0.450 1 851 409 409 ALA CB C 18.219 0.450 1 852 409 409 ALA N N 120.418 0.450 1 853 410 410 ASN H H 7.777 0.040 1 854 410 410 ASN C C 170.601 0.450 1 855 410 410 ASN CA C 52.160 0.450 1 856 410 410 ASN N N 111.801 0.450 1 857 411 411 SER H H 7.595 0.040 1 858 411 411 SER CA C 58.102 0.450 1 859 411 411 SER N N 115.081 0.450 1 860 412 412 ASN H H 8.073 0.040 1 861 412 412 ASN C C 170.558 0.450 1 862 412 412 ASN CA C 51.907 0.450 1 863 412 412 ASN CB C 39.710 0.450 1 864 412 412 ASN N N 113.984 0.450 1 865 413 413 GLY H H 9.088 0.040 1 866 413 413 GLY C C 168.137 0.450 1 867 413 413 GLY CA C 45.662 0.450 1 868 413 413 GLY N N 103.860 0.450 1 869 414 414 THR H H 8.575 0.040 1 870 414 414 THR C C 171.744 0.450 1 871 414 414 THR CA C 62.397 0.450 1 872 414 414 THR N N 121.125 0.450 1 873 415 415 VAL H H 9.317 0.040 1 874 415 415 VAL C C 171.734 0.450 1 875 415 415 VAL CA C 60.347 0.450 1 876 415 415 VAL CB C 34.608 0.450 1 877 415 415 VAL N N 128.825 0.450 1 878 416 416 GLU H H 8.726 0.040 1 879 416 416 GLU C C 173.289 0.450 1 880 416 416 GLU CA C 54.628 0.450 1 881 416 416 GLU CB C 31.150 0.450 1 882 416 416 GLU N N 127.982 0.450 1 883 417 417 TYR H H 9.437 0.040 1 884 417 417 TYR C C 168.598 0.450 1 885 417 417 TYR CA C 55.005 0.450 1 886 417 417 TYR CB C 41.846 0.450 1 887 417 417 TYR N N 124.356 0.450 1 888 418 418 ASP H H 8.919 0.040 1 889 418 418 ASP C C 173.542 0.450 1 890 418 418 ASP CA C 49.847 0.450 1 891 418 418 ASP N N 120.588 0.450 1 892 420 420 LEU H H 8.685 0.040 1 893 420 420 LEU C C 175.765 0.450 1 894 420 420 LEU CA C 56.148 0.450 1 895 420 420 LEU N N 118.875 0.450 1 896 421 421 LEU H H 7.633 0.040 1 897 421 421 LEU C C 173.368 0.450 1 898 421 421 LEU CA C 54.669 0.450 1 899 421 421 LEU N N 117.412 0.450 1 900 422 422 THR H H 7.948 0.040 1 901 422 422 THR C C 168.729 0.450 1 902 422 422 THR CA C 60.339 0.450 1 903 422 422 THR N N 114.665 0.450 1 904 423 423 SER H H 8.070 0.040 1 905 423 423 SER C C 169.154 0.450 1 906 423 423 SER CA C 55.092 0.450 1 907 423 423 SER N N 112.255 0.450 1 908 425 425 GLU H H 8.460 0.040 1 909 425 425 GLU C C 176.171 0.450 1 910 425 425 GLU CA C 58.796 0.450 1 911 425 425 GLU CB C 28.277 0.450 1 912 425 425 GLU N N 116.195 0.450 1 913 426 426 THR H H 7.660 0.040 1 914 426 426 THR C C 174.526 0.450 1 915 426 426 THR CA C 66.333 0.450 1 916 426 426 THR N N 118.429 0.450 1 917 427 427 LEU H H 7.562 0.040 1 918 427 427 LEU C C 174.451 0.450 1 919 427 427 LEU CA C 57.567 0.450 1 920 427 427 LEU N N 122.521 0.450 1 921 428 428 ARG H H 8.700 0.040 1 922 428 428 ARG C C 176.201 0.450 1 923 428 428 ARG CA C 60.166 0.450 1 924 428 428 ARG N N 120.223 0.450 1 925 429 429 GLY H H 8.324 0.040 1 926 429 429 GLY C C 172.423 0.450 1 927 429 429 GLY CA C 47.156 0.450 1 928 429 429 GLY N N 105.123 0.450 1 929 430 430 ALA H H 7.553 0.040 1 930 430 430 ALA C C 177.279 0.450 1 931 430 430 ALA CA C 54.550 0.450 1 932 430 430 ALA N N 122.920 0.450 1 933 431 431 ILE H H 7.507 0.040 1 934 431 431 ILE C C 175.699 0.450 1 935 431 431 ILE CA C 65.764 0.450 1 936 431 431 ILE CB C 37.918 0.450 1 937 431 431 ILE N N 119.318 0.450 1 938 432 432 GLU H H 8.261 0.040 1 939 432 432 GLU C C 178.732 0.450 1 940 432 432 GLU CA C 58.768 0.450 1 941 432 432 GLU CB C 29.501 0.450 1 942 432 432 GLU N N 123.640 0.450 1 943 433 433 ASP H H 8.436 0.040 1 944 433 433 ASP C C 175.011 0.450 1 945 433 433 ASP CA C 56.676 0.450 1 946 433 433 ASP N N 120.021 0.450 1 947 434 434 MET H H 7.550 0.040 1 948 434 434 MET C C 173.328 0.450 1 949 434 434 MET CA C 57.142 0.450 1 950 434 434 MET N N 116.687 0.450 1 951 435 435 GLY H H 8.139 0.040 1 952 435 435 GLY C C 170.545 0.450 1 953 435 435 GLY CA C 44.765 0.450 1 954 435 435 GLY N N 105.451 0.450 1 955 436 436 PHE H H 6.781 0.040 1 956 436 436 PHE C C 171.246 0.450 1 957 436 436 PHE CA C 56.995 0.450 1 958 436 436 PHE N N 118.287 0.450 1 959 437 437 ASP H H 7.950 0.040 1 960 437 437 ASP CA C 53.889 0.450 1 961 437 437 ASP N N 120.037 0.450 1 962 438 438 ALA H H 8.605 0.040 1 963 438 438 ALA C C 173.673 0.450 1 964 438 438 ALA CA C 50.286 0.450 1 965 438 438 ALA CB C 22.328 0.450 1 966 438 438 ALA N N 129.240 0.450 1 967 439 439 THR H H 8.783 0.040 1 968 439 439 THR C C 170.575 0.450 1 969 439 439 THR CA C 59.960 0.450 1 970 439 439 THR CB C 72.639 0.450 1 971 439 439 THR N N 115.169 0.450 1 972 440 440 LEU H H 8.864 0.040 1 973 440 440 LEU C C 174.533 0.450 1 974 440 440 LEU CA C 54.932 0.450 1 975 440 440 LEU N N 122.955 0.450 1 976 441 441 SER H H 8.365 0.040 1 977 441 441 SER C C 171.901 0.450 1 978 441 441 SER CA C 58.584 0.450 1 979 441 441 SER N N 117.051 0.450 1 980 442 442 ASP H H 8.439 0.040 1 981 442 442 ASP C C 173.726 0.450 1 982 442 442 ASP CA C 54.306 0.450 1 983 442 442 ASP CB C 41.220 0.450 1 984 442 442 ASP N N 123.312 0.450 1 985 443 443 THR H H 8.120 0.040 1 986 443 443 THR C C 171.658 0.450 1 987 443 443 THR CA C 61.896 0.450 1 988 443 443 THR N N 114.028 0.450 1 989 444 444 ASN H H 8.389 0.040 1 990 444 444 ASN C C 172.028 0.450 1 991 444 444 ASN CA C 53.314 0.450 1 992 444 444 ASN N N 120.977 0.450 1 993 445 445 GLU H H 8.241 0.040 1 994 445 445 GLU C C 171.598 0.450 1 995 445 445 GLU CA C 54.421 0.450 1 996 445 445 GLU N N 122.600 0.450 1 997 461 461 THR H H 7.896 0.040 1 998 461 461 THR CA C 61.617 0.450 1 999 461 461 THR CB C 69.762 0.450 1 1000 461 461 THR N N 115.684 0.450 1 1001 462 462 SER H H 8.239 0.040 1 1002 462 462 SER CA C 58.406 0.450 1 1003 462 462 SER CB C 63.799 0.450 1 1004 462 462 SER N N 117.565 0.450 1 1005 463 463 THR H H 8.306 0.040 1 1006 463 463 THR C C 171.600 0.450 1 1007 463 463 THR CA C 58.578 0.450 1 1008 463 463 THR CB C 63.508 0.450 1 1009 463 463 THR N N 117.715 0.450 1 1010 469 469 LYS H H 8.288 0.040 1 1011 469 469 LYS C C 174.438 0.450 1 1012 469 469 LYS CA C 57.117 0.450 1 1013 469 469 LYS N N 122.222 0.450 1 1014 470 470 GLY H H 8.307 0.040 1 1015 470 470 GLY C C 171.130 0.450 1 1016 470 470 GLY CA C 45.453 0.450 1 1017 470 470 GLY N N 109.841 0.450 1 1018 471 471 MET H H 8.049 0.040 1 1019 471 471 MET C C 173.362 0.450 1 1020 471 471 MET CA C 55.319 0.450 1 1021 471 471 MET CB C 32.813 0.450 1 1022 471 471 MET N N 119.606 0.450 1 1023 472 472 THR H H 8.165 0.040 1 1024 472 472 THR C C 169.899 0.450 1 1025 472 472 THR CA C 60.072 0.450 1 1026 472 472 THR CB C 69.796 0.450 1 1027 472 472 THR N N 118.343 0.450 1 1028 480 480 GLY H H 8.379 0.040 1 1029 480 480 GLY C C 171.166 0.450 1 1030 480 480 GLY CA C 45.396 0.450 1 1031 480 480 GLY N N 109.930 0.450 1 1032 481 481 LYS H H 7.956 0.040 1 1033 481 481 LYS C C 173.559 0.450 1 1034 481 481 LYS CA C 56.712 0.450 1 1035 481 481 LYS CB C 30.005 0.450 1 1036 481 481 LYS N N 120.300 0.450 1 1037 482 482 ASN H H 8.200 0.040 1 1038 482 482 ASN C C 174.476 0.450 1 1039 482 482 ASN CA C 56.297 0.450 1 1040 482 482 ASN CB C 42.312 0.450 1 1041 482 482 ASN N N 122.818 0.450 1 1042 482 482 ASN ND2 N 112.626 0.450 1 1043 484 484 SER H H 8.457 0.040 1 1044 484 484 SER CA C 57.445 0.450 1 1045 484 484 SER N N 118.976 0.450 1 1046 485 485 LYS H H 8.516 0.040 1 1047 485 485 LYS C C 173.481 0.450 1 1048 485 485 LYS CA C 54.644 0.450 1 1049 485 485 LYS CB C 35.756 0.450 1 1050 485 485 LYS N N 121.352 0.450 1 1051 486 486 CYS H H 9.233 0.040 1 1052 486 486 CYS CA C 55.344 0.450 1 1053 486 486 CYS CB C 31.672 0.450 1 1054 486 486 CYS N N 119.286 0.450 1 1055 487 487 TYR H H 8.990 0.040 1 1056 487 487 TYR C C 171.818 0.450 1 1057 487 487 TYR CA C 56.447 0.450 1 1058 487 487 TYR CB C 44.007 0.450 1 1059 487 487 TYR N N 118.937 0.450 1 1060 488 488 ILE H H 8.969 0.040 1 1061 488 488 ILE C C 172.267 0.450 1 1062 488 488 ILE CA C 58.246 0.450 1 1063 488 488 ILE N N 121.372 0.450 1 1064 489 489 GLN H H 9.310 0.040 1 1065 489 489 GLN C C 172.506 0.450 1 1066 489 489 GLN CA C 55.494 0.450 1 1067 489 489 GLN CB C 29.287 0.450 1 1068 489 489 GLN N N 129.042 0.450 1 1069 490 490 VAL H H 8.879 0.040 1 1070 490 490 VAL C C 173.883 0.450 1 1071 490 490 VAL CA C 61.025 0.450 1 1072 490 490 VAL N N 131.213 0.450 1 1073 491 491 THR H H 9.055 0.040 1 1074 491 491 THR C C 171.668 0.450 1 1075 491 491 THR CA C 60.466 0.450 1 1076 491 491 THR N N 121.067 0.450 1 1077 492 492 GLY H H 8.687 0.040 1 1078 492 492 GLY CA C 45.005 0.450 1 1079 492 492 GLY N N 109.062 0.450 1 1080 493 493 MET H H 8.682 0.040 1 1081 493 493 MET C C 174.552 0.450 1 1082 493 493 MET CA C 56.691 0.450 1 1083 493 493 MET N N 119.803 0.450 1 1084 498 498 CYS H H 7.819 0.040 1 1085 498 498 CYS C C 174.511 0.450 1 1086 498 498 CYS CA C 63.672 0.450 1 1087 498 498 CYS N N 125.803 0.450 1 1088 499 499 VAL H H 6.621 0.040 1 1089 499 499 VAL C C 174.511 0.450 1 1090 499 499 VAL N N 117.298 0.450 1 1091 503 503 GLU H H 8.467 0.040 1 1092 503 503 GLU CA C 60.618 0.450 1 1093 503 503 GLU N N 116.761 0.450 1 1094 504 504 ARG H H 8.371 0.040 1 1095 504 504 ARG C C 175.977 0.450 1 1096 504 504 ARG CA C 59.130 0.450 1 1097 504 504 ARG N N 115.612 0.450 1 1098 505 505 ASN H H 7.425 0.040 1 1099 505 505 ASN C C 174.421 0.450 1 1100 505 505 ASN CA C 56.786 0.450 1 1101 505 505 ASN N N 114.697 0.450 1 1102 505 505 ASN ND2 N 117.133 0.450 1 1103 507 507 ARG H H 7.677 0.040 1 1104 507 507 ARG C C 173.972 0.450 1 1105 507 507 ARG CA C 58.510 0.450 1 1106 507 507 ARG N N 114.663 0.450 1 1107 508 508 ARG H H 6.737 0.040 1 1108 508 508 ARG C C 174.062 0.450 1 1109 508 508 ARG CA C 56.333 0.450 1 1110 508 508 ARG N N 114.022 0.450 1 1111 509 509 GLU H H 7.215 0.040 1 1112 509 509 GLU C C 173.943 0.450 1 1113 509 509 GLU CA C 55.368 0.450 1 1114 509 509 GLU N N 120.044 0.450 1 1115 510 510 GLU H H 8.595 0.040 1 1116 510 510 GLU C C 174.221 0.450 1 1117 510 510 GLU CA C 57.612 0.450 1 1118 510 510 GLU CB C 28.807 0.450 1 1119 510 510 GLU N N 124.841 0.450 1 1120 511 511 GLY H H 8.560 0.040 1 1121 511 511 GLY CA C 45.008 0.450 1 1122 511 511 GLY N N 108.508 0.450 1 1123 512 512 ILE H H 7.153 0.040 1 1124 512 512 ILE C C 172.985 0.450 1 1125 512 512 ILE CA C 59.894 0.450 1 1126 512 512 ILE N N 118.208 0.450 1 1127 513 513 TYR H H 8.886 0.040 1 1128 513 513 TYR C C 173.823 0.450 1 1129 513 513 TYR CA C 58.777 0.450 1 1130 513 513 TYR CB C 39.316 0.450 1 1131 513 513 TYR N N 126.513 0.450 1 1132 514 514 SER H H 7.838 0.040 1 1133 514 514 SER C C 168.856 0.450 1 1134 514 514 SER CA C 57.572 0.450 1 1135 514 514 SER N N 109.935 0.450 1 1136 515 515 ILE H H 8.452 0.040 1 1137 515 515 ILE CA C 59.134 0.450 1 1138 515 515 ILE N N 119.524 0.450 1 1139 516 516 LEU H H 8.366 0.040 1 1140 516 516 LEU CA C 53.588 0.450 1 1141 516 516 LEU CB C 44.826 0.450 1 1142 516 516 LEU N N 128.628 0.450 1 1143 517 517 VAL H H 9.548 0.040 1 1144 517 517 VAL C C 170.621 0.450 1 1145 517 517 VAL CA C 61.634 0.450 1 1146 517 517 VAL N N 127.335 0.450 1 1147 518 518 ALA H H 8.591 0.040 1 1148 518 518 ALA C C 173.883 0.450 1 1149 518 518 ALA CA C 50.073 0.450 1 1150 518 518 ALA CB C 19.801 0.450 1 1151 518 518 ALA N N 131.626 0.450 1 1152 519 519 LEU H H 8.592 0.040 1 1153 519 519 LEU CA C 58.846 0.450 1 1154 519 519 LEU N N 126.277 0.450 1 1155 520 520 MET H H 8.638 0.040 1 1156 520 520 MET CA C 57.842 0.450 1 1157 520 520 MET CB C 30.480 0.450 1 1158 520 520 MET N N 115.838 0.450 1 1159 521 521 ALA H H 7.278 0.040 1 1160 521 521 ALA C C 175.291 0.450 1 1161 521 521 ALA CA C 52.200 0.450 1 1162 521 521 ALA CB C 19.487 0.450 1 1163 521 521 ALA N N 118.181 0.450 1 1164 522 522 GLY H H 7.752 0.040 1 1165 522 522 GLY C C 170.322 0.450 1 1166 522 522 GLY CA C 46.538 0.450 1 1167 522 522 GLY N N 107.566 0.450 1 1168 523 523 LYS H H 7.123 0.040 1 1169 523 523 LYS C C 171.429 0.450 1 1170 523 523 LYS CA C 54.899 0.450 1 1171 523 523 LYS CB C 37.047 0.450 1 1172 523 523 LYS N N 115.868 0.450 1 1173 524 524 ALA H H 9.530 0.040 1 1174 524 524 ALA C C 171.998 0.450 1 1175 524 524 ALA CA C 49.599 0.450 1 1176 524 524 ALA CB C 21.220 0.450 1 1177 524 524 ALA N N 125.577 0.450 1 1178 525 525 GLU H H 8.884 0.040 1 1179 525 525 GLU C C 172.925 0.450 1 1180 525 525 GLU CA C 54.723 0.450 1 1181 525 525 GLU N N 123.578 0.450 1 1182 526 526 VAL H H 8.891 0.040 1 1183 526 526 VAL C C 171.848 0.450 1 1184 526 526 VAL CA C 60.934 0.450 1 1185 526 526 VAL N N 128.390 0.450 1 1186 527 527 ARG H H 8.611 0.040 1 1187 527 527 ARG C C 173.374 0.450 1 1188 527 527 ARG CA C 54.949 0.450 1 1189 527 527 ARG N N 127.552 0.450 1 1190 528 528 TYR H H 9.176 0.040 1 1191 528 528 TYR CA C 55.480 0.450 1 1192 528 528 TYR CB C 41.955 0.450 1 1193 528 528 TYR N N 123.732 0.450 1 1194 529 529 ASN H H 8.805 0.040 1 1195 529 529 ASN C C 172.237 0.450 1 1196 529 529 ASN CA C 48.803 0.450 1 1197 529 529 ASN N N 118.509 0.450 1 1198 529 529 ASN ND2 N 111.834 0.450 1 1199 531 531 ALA H H 7.868 0.040 1 1200 531 531 ALA C C 175.259 0.450 1 1201 531 531 ALA CA C 53.372 0.450 1 1202 531 531 ALA CB C 18.427 0.450 1 1203 531 531 ALA N N 120.119 0.450 1 1204 532 532 VAL H H 7.722 0.040 1 1205 532 532 VAL C C 171.369 0.450 1 1206 532 532 VAL CA C 62.534 0.450 1 1207 532 532 VAL N N 115.276 0.450 1 1208 533 533 ILE H H 8.364 0.040 1 1209 533 533 ILE CA C 60.155 0.450 1 1210 533 533 ILE N N 121.451 0.450 1 1211 534 534 GLN H H 6.787 0.040 1 1212 534 534 GLN C C 172.057 0.450 1 1213 534 534 GLN CA C 52.854 0.450 1 1214 534 534 GLN N N 118.742 0.450 1 1215 534 534 GLN NE2 N 113.804 0.450 1 1216 536 536 PRO CA C 66.310 0.450 1 1217 536 536 PRO CB C 30.764 0.450 1 1218 537 537 MET H H 7.202 0.040 1 1219 537 537 MET C C 174.679 0.450 1 1220 537 537 MET CA C 57.426 0.450 1 1221 537 537 MET CB C 32.356 0.450 1 1222 537 537 MET N N 115.485 0.450 1 1223 538 538 ILE H H 7.003 0.040 1 1224 538 538 ILE CA C 65.599 0.450 1 1225 538 538 ILE N N 119.937 0.450 1 1226 539 539 ALA H H 7.721 0.040 1 1227 539 539 ALA C C 176.046 0.450 1 1228 539 539 ALA CA C 55.296 0.450 1 1229 539 539 ALA CB C 16.658 0.450 1 1230 539 539 ALA N N 118.501 0.450 1 1231 540 540 GLU H H 7.484 0.040 1 1232 540 540 GLU C C 175.708 0.450 1 1233 540 540 GLU CA C 59.718 0.450 1 1234 540 540 GLU CB C 28.412 0.450 1 1235 540 540 GLU N N 118.152 0.450 1 1236 541 541 PHE H H 7.772 0.040 1 1237 541 541 PHE C C 176.306 0.450 1 1238 541 541 PHE CA C 59.489 0.450 1 1239 541 541 PHE CB C 38.268 0.450 1 1240 541 541 PHE N N 118.185 0.450 1 1241 542 542 ILE H H 7.408 0.040 1 1242 542 542 ILE CA C 66.185 0.450 1 1243 542 542 ILE N N 118.593 0.450 1 1244 544 544 GLU H H 8.189 0.040 1 1245 544 544 GLU C C 175.199 0.450 1 1246 544 544 GLU CA C 58.668 0.450 1 1247 544 544 GLU CB C 29.110 0.450 1 1248 544 544 GLU N N 120.084 0.450 1 1249 545 545 LEU H H 7.380 0.040 1 1250 545 545 LEU CA C 54.952 0.450 1 1251 545 545 LEU CB C 41.936 0.450 1 1252 545 545 LEU N N 117.056 0.450 1 1253 546 546 GLY H H 7.940 0.040 1 1254 546 546 GLY CA C 44.589 0.450 1 1255 546 546 GLY N N 105.164 0.450 1 1256 547 547 PHE H H 6.746 0.040 1 1257 547 547 PHE C C 173.135 0.450 1 1258 547 547 PHE CA C 57.061 0.450 1 1259 547 547 PHE CB C 43.523 0.450 1 1260 547 547 PHE N N 118.967 0.450 1 1261 548 548 GLY H H 8.292 0.040 1 1262 548 548 GLY CA C 44.784 0.450 1 1263 548 548 GLY N N 108.382 0.450 1 1264 549 549 ALA H H 8.293 0.040 1 1265 549 549 ALA CA C 51.790 0.450 1 1266 549 549 ALA CB C 22.409 0.450 1 1267 549 549 ALA N N 123.137 0.450 1 1268 550 550 THR H H 8.276 0.040 1 1269 550 550 THR C C 170.202 0.450 1 1270 550 550 THR CA C 60.546 0.450 1 1271 550 550 THR CB C 71.936 0.450 1 1272 550 550 THR N N 116.536 0.450 1 1273 551 551 VAL H H 8.993 0.040 1 1274 551 551 VAL C C 173.135 0.450 1 1275 551 551 VAL CA C 64.389 0.450 1 1276 551 551 VAL N N 127.573 0.450 1 1277 552 552 ILE H H 8.638 0.040 1 1278 552 552 ILE C C 172.895 0.450 1 1279 552 552 ILE CA C 61.096 0.450 1 1280 552 552 ILE N N 128.539 0.450 1 1281 555 555 ALA H H 8.274 0.040 1 1282 555 555 ALA C C 174.402 0.450 1 1283 555 555 ALA CA C 52.605 0.450 1 1284 555 555 ALA CB C 19.112 0.450 1 1285 555 555 ALA N N 124.780 0.450 1 1286 556 556 ASP H H 8.224 0.040 1 1287 556 556 ASP C C 173.583 0.450 1 1288 556 556 ASP CA C 54.376 0.450 1 1289 556 556 ASP CB C 41.203 0.450 1 1290 556 556 ASP N N 119.515 0.450 1 1291 557 557 GLU H H 8.228 0.040 1 1292 557 557 GLU C C 174.078 0.450 1 1293 557 557 GLU CA C 56.825 0.450 1 1294 557 557 GLU CB C 30.089 0.450 1 1295 557 557 GLU N N 121.539 0.450 1 1296 558 558 GLY H H 8.354 0.040 1 1297 558 558 GLY C C 170.958 0.450 1 1298 558 558 GLY CA C 45.229 0.450 1 1299 558 558 GLY N N 109.197 0.450 1 1300 559 559 ASP H H 8.058 0.040 1 1301 559 559 ASP C C 174.058 0.450 1 1302 559 559 ASP CA C 54.274 0.450 1 1303 559 559 ASP CB C 41.029 0.450 1 1304 559 559 ASP N N 119.561 0.450 1 1305 560 560 GLY H H 8.145 0.040 1 1306 560 560 GLY C C 170.210 0.450 1 1307 560 560 GLY CA C 45.334 0.450 1 1308 560 560 GLY N N 108.167 0.450 1 1309 561 561 VAL H H 7.681 0.040 1 1310 561 561 VAL C C 172.207 0.450 1 1311 561 561 VAL CA C 61.368 0.450 1 1312 561 561 VAL CB C 33.804 0.450 1 1313 561 561 VAL N N 119.737 0.450 1 1314 562 562 LEU H H 9.315 0.040 1 1315 562 562 LEU C C 170.950 0.450 1 1316 562 562 LEU CA C 53.788 0.450 1 1317 562 562 LEU CB C 46.700 0.450 1 1318 562 562 LEU N N 129.769 0.450 1 1319 563 563 GLU H H 8.552 0.040 1 1320 563 563 GLU C C 172.231 0.450 1 1321 563 563 GLU CA C 54.682 0.450 1 1322 563 563 GLU CB C 32.000 0.450 1 1323 563 563 GLU N N 125.841 0.450 1 1324 564 564 LEU H H 8.585 0.040 1 1325 564 564 LEU C C 173.733 0.450 1 1326 564 564 LEU CA C 52.539 0.450 1 1327 564 564 LEU CB C 46.200 0.450 1 1328 564 564 LEU N N 121.185 0.450 1 1329 565 565 VAL H H 8.841 0.040 1 1330 565 565 VAL C C 172.822 0.450 1 1331 565 565 VAL CA C 61.829 0.450 1 1332 565 565 VAL CB C 32.800 0.450 1 1333 565 565 VAL N N 121.416 0.450 1 1334 566 566 VAL H H 8.608 0.040 1 1335 566 566 VAL CA C 60.849 0.450 1 1336 566 566 VAL CB C 33.400 0.450 1 1337 566 566 VAL N N 127.383 0.450 1 1338 567 567 ARG H H 9.193 0.040 1 1339 567 567 ARG C C 173.265 0.450 1 1340 567 567 ARG CA C 55.218 0.450 1 1341 567 567 ARG CB C 32.500 0.450 1 1342 567 567 ARG N N 126.641 0.450 1 1343 568 568 GLY H H 8.422 0.040 1 1344 568 568 GLY CA C 44.812 0.450 1 1345 568 568 GLY N N 108.773 0.450 1 1346 569 569 MET H H 8.774 0.040 1 1347 569 569 MET C C 174.636 0.450 1 1348 569 569 MET CA C 56.968 0.450 1 1349 569 569 MET N N 120.182 0.450 1 1350 574 574 CYS H H 7.821 0.040 1 1351 574 574 CYS C C 174.391 0.450 1 1352 574 574 CYS CA C 64.010 0.450 1 1353 574 574 CYS CB C 29.500 0.450 1 1354 574 574 CYS N N 126.370 0.450 1 1355 575 575 VAL H H 6.645 0.040 1 1356 575 575 VAL C C 175.020 0.450 1 1357 575 575 VAL CA C 66.456 0.450 1 1358 575 575 VAL N N 117.311 0.450 1 1359 576 576 HIS H H 7.787 0.040 1 1360 576 576 HIS C C 175.732 0.450 1 1361 576 576 HIS CA C 59.154 0.450 1 1362 576 576 HIS N N 116.653 0.450 1 1363 577 577 LYS H H 8.235 0.040 1 1364 577 577 LYS CA C 60.043 0.450 1 1365 577 577 LYS CB C 32.032 0.450 1 1366 577 577 LYS N N 121.797 0.450 1 1367 578 578 ILE H H 7.641 0.040 1 1368 578 578 ILE CA C 66.159 0.450 1 1369 578 578 ILE CB C 38.500 0.450 1 1370 578 578 ILE N N 119.030 0.450 1 1371 579 579 GLU H H 8.599 0.040 1 1372 579 579 GLU C C 177.264 0.450 1 1373 579 579 GLU CA C 60.898 0.450 1 1374 579 579 GLU CB C 29.800 0.450 1 1375 579 579 GLU N N 117.514 0.450 1 1376 580 580 SER H H 8.543 0.040 1 1377 580 580 SER CA C 61.449 0.450 1 1378 580 580 SER CB C 62.800 0.450 1 1379 580 580 SER N N 113.315 0.450 1 1380 581 581 SER H H 7.276 0.040 1 1381 581 581 SER CA C 61.916 0.450 1 1382 581 581 SER CB C 63.200 0.450 1 1383 581 581 SER N N 115.612 0.450 1 1384 582 582 LEU H H 8.239 0.040 1 1385 582 582 LEU CA C 57.858 0.450 1 1386 582 582 LEU CB C 41.100 0.450 1 1387 582 582 LEU N N 120.452 0.450 1 1388 583 583 THR H H 7.712 0.040 1 1389 583 583 THR CA C 65.031 0.450 1 1390 583 583 THR CB C 68.900 0.450 1 1391 583 583 THR N N 107.556 0.450 1 1392 584 584 LYS H H 6.855 0.040 1 1393 584 584 LYS C C 173.711 0.450 1 1394 584 584 LYS CA C 56.514 0.450 1 1395 584 584 LYS CB C 32.400 0.450 1 1396 584 584 LYS N N 117.286 0.450 1 1397 585 585 HIS H H 7.668 0.040 1 1398 585 585 HIS C C 173.015 0.450 1 1399 585 585 HIS CA C 56.593 0.450 1 1400 585 585 HIS CB C 30.500 0.450 1 1401 585 585 HIS N N 121.901 0.450 1 1402 588 588 ILE CA C 60.092 0.450 1 1403 589 589 LEU H H 8.837 0.040 1 1404 589 589 LEU CA C 55.560 0.450 1 1405 589 589 LEU CB C 42.500 0.450 1 1406 589 589 LEU N N 128.660 0.450 1 1407 590 590 TYR H H 7.776 0.040 1 1408 590 590 TYR C C 170.673 0.450 1 1409 590 590 TYR CA C 57.781 0.450 1 1410 590 590 TYR CB C 41.900 0.450 1 1411 590 590 TYR N N 117.959 0.450 1 1412 591 591 CYS H H 8.150 0.040 1 1413 591 591 CYS C C 168.570 0.450 1 1414 591 591 CYS CA C 57.473 0.450 1 1415 591 591 CYS CB C 28.600 0.450 1 1416 591 591 CYS N N 124.898 0.450 1 1417 592 592 SER H H 8.617 0.040 1 1418 592 592 SER C C 170.914 0.450 1 1419 592 592 SER CA C 56.259 0.450 1 1420 592 592 SER CB C 65.300 0.450 1 1421 592 592 SER N N 122.067 0.450 1 1422 593 593 VAL H H 9.556 0.040 1 1423 593 593 VAL C C 170.496 0.450 1 1424 593 593 VAL CA C 61.060 0.450 1 1425 593 593 VAL CB C 33.300 0.450 1 1426 593 593 VAL N N 129.370 0.450 1 1427 594 594 ALA H H 8.494 0.040 1 1428 594 594 ALA C C 173.711 0.450 1 1429 594 594 ALA CA C 50.116 0.450 1 1430 594 594 ALA CB C 20.100 0.450 1 1431 594 594 ALA N N 129.981 0.450 1 1432 595 595 LEU H H 8.587 0.040 1 1433 595 595 LEU C C 176.209 0.450 1 1434 595 595 LEU CA C 57.628 0.450 1 1435 595 595 LEU CB C 41.900 0.450 1 1436 595 595 LEU N N 125.895 0.450 1 1437 596 596 ALA H H 8.552 0.040 1 1438 596 596 ALA C C 176.387 0.450 1 1439 596 596 ALA CA C 55.046 0.450 1 1440 596 596 ALA CB C 18.600 0.450 1 1441 596 596 ALA N N 116.253 0.450 1 1442 597 597 THR H H 6.687 0.040 1 1443 597 597 THR C C 171.908 0.450 1 1444 597 597 THR CA C 60.106 0.450 1 1445 597 597 THR CB C 69.800 0.450 1 1446 597 597 THR N N 100.894 0.450 1 1447 598 598 ASN H H 7.756 0.040 1 1448 598 598 ASN C C 169.913 0.450 1 1449 598 598 ASN CA C 55.355 0.450 1 1450 598 598 ASN CB C 37.300 0.450 1 1451 598 598 ASN N N 116.119 0.450 1 1452 598 598 ASN ND2 N 112.695 0.450 1 1453 599 599 LYS H H 7.462 0.040 1 1454 599 599 LYS C C 172.997 0.450 1 1455 599 599 LYS CA C 55.192 0.450 1 1456 599 599 LYS CB C 35.800 0.450 1 1457 599 599 LYS N N 115.359 0.450 1 1458 600 600 ALA H H 9.069 0.040 1 1459 600 600 ALA C C 171.788 0.450 1 1460 600 600 ALA CA C 49.768 0.450 1 1461 600 600 ALA CB C 22.000 0.450 1 1462 600 600 ALA N N 123.502 0.450 1 1463 601 601 HIS H H 9.019 0.040 1 1464 601 601 HIS C C 171.468 0.450 1 1465 601 601 HIS CA C 55.787 0.450 1 1466 601 601 HIS CB C 31.400 0.450 1 1467 601 601 HIS N N 122.996 0.450 1 1468 602 602 ILE H H 8.853 0.040 1 1469 602 602 ILE C C 171.943 0.450 1 1470 602 602 ILE CA C 59.543 0.450 1 1471 602 602 ILE CB C 42.700 0.450 1 1472 602 602 ILE N N 125.738 0.450 1 1473 603 603 LYS H H 8.757 0.040 1 1474 603 603 LYS C C 172.890 0.450 1 1475 603 603 LYS CA C 54.414 0.450 1 1476 603 603 LYS CB C 34.700 0.450 1 1477 603 603 LYS N N 125.957 0.450 1 1478 604 604 TYR H H 9.290 0.040 1 1479 604 604 TYR CA C 55.231 0.450 1 1480 604 604 TYR CB C 41.700 0.450 1 1481 604 604 TYR N N 124.123 0.450 1 1482 605 605 ASP H H 8.862 0.040 1 1483 605 605 ASP CA C 49.914 0.450 1 1484 605 605 ASP N N 120.284 0.450 1 1485 606 606 PRO CA C 63.250 0.450 1 1486 606 606 PRO CB C 32.600 0.450 1 1487 607 607 GLU H H 8.332 0.040 1 1488 607 607 GLU C C 174.374 0.450 1 1489 607 607 GLU CA C 57.622 0.450 1 1490 607 607 GLU CB C 29.500 0.450 1 1491 607 607 GLU N N 116.409 0.450 1 1492 608 608 ILE H H 7.923 0.040 1 1493 608 608 ILE CA C 61.504 0.450 1 1494 608 608 ILE N N 116.839 0.450 1 1495 609 609 ILE H H 8.318 0.040 1 1496 609 609 ILE CA C 60.201 0.450 1 1497 609 609 ILE CB C 42.700 0.450 1 1498 609 609 ILE N N 121.205 0.450 1 1499 610 610 GLY H H 7.882 0.040 1 1500 610 610 GLY C C 170.138 0.450 1 1501 610 610 GLY CA C 43.888 0.450 1 1502 610 610 GLY N N 108.034 0.450 1 1503 611 611 PRO CA C 65.682 0.450 1 1504 611 611 PRO CB C 31.900 0.450 1 1505 612 612 ARG H H 8.635 0.040 1 1506 612 612 ARG C C 176.038 0.450 1 1507 612 612 ARG CA C 59.431 0.450 1 1508 612 612 ARG CB C 29.000 0.450 1 1509 612 612 ARG N N 115.339 0.450 1 1510 613 613 ASP H H 7.264 0.040 1 1511 613 613 ASP C C 176.320 0.450 1 1512 613 613 ASP CA C 56.923 0.450 1 1513 613 613 ASP CB C 41.200 0.450 1 1514 613 613 ASP N N 117.763 0.450 1 1515 614 614 ILE H H 7.348 0.040 1 1516 614 614 ILE C C 174.557 0.450 1 1517 614 614 ILE CA C 66.047 0.450 1 1518 614 614 ILE N N 122.268 0.450 1 1519 615 615 ILE H H 8.146 0.040 1 1520 615 615 ILE C C 174.877 0.450 1 1521 615 615 ILE CA C 66.709 0.450 1 1522 615 615 ILE N N 120.097 0.450 1 1523 616 616 HIS H H 8.050 0.040 1 1524 616 616 HIS C C 175.522 0.450 1 1525 616 616 HIS CA C 59.270 0.450 1 1526 616 616 HIS CB C 28.800 0.450 1 1527 616 616 HIS N N 117.479 0.450 1 1528 617 617 THR H H 7.979 0.040 1 1529 617 617 THR CA C 67.371 0.450 1 1530 617 617 THR N N 117.729 0.450 1 1531 618 618 ILE H H 7.733 0.040 1 1532 618 618 ILE C C 175.225 0.450 1 1533 618 618 ILE CA C 66.700 0.450 1 1534 618 618 ILE CB C 37.800 0.450 1 1535 618 618 ILE N N 122.770 0.450 1 1536 619 619 GLU H H 8.560 0.040 1 1537 619 619 GLU C C 179.206 0.450 1 1538 619 619 GLU CA C 58.810 0.450 1 1539 619 619 GLU CB C 29.000 0.450 1 1540 619 619 GLU N N 119.996 0.450 1 1541 620 620 SER H H 8.187 0.040 1 1542 620 620 SER CA C 61.461 0.450 1 1543 620 620 SER CB C 62.800 0.450 1 1544 620 620 SER N N 117.367 0.450 1 1545 621 621 LEU H H 7.370 0.040 1 1546 621 621 LEU C C 173.525 0.450 1 1547 621 621 LEU CA C 54.911 0.450 1 1548 621 621 LEU CB C 42.800 0.450 1 1549 621 621 LEU N N 120.516 0.450 1 1550 622 622 GLY H H 7.817 0.040 1 1551 622 622 GLY C C 170.457 0.450 1 1552 622 622 GLY CA C 44.474 0.450 1 1553 622 622 GLY N N 104.626 0.450 1 1554 623 623 PHE H H 6.776 0.040 1 1555 623 623 PHE CA C 56.328 0.450 1 1556 623 623 PHE CB C 41.000 0.450 1 1557 623 623 PHE N N 118.026 0.450 1 1558 624 624 GLU H H 7.969 0.040 1 1559 624 624 GLU C C 172.387 0.450 1 1560 624 624 GLU CA C 55.043 0.450 1 1561 624 624 GLU CB C 32.700 0.450 1 1562 624 624 GLU N N 117.987 0.450 1 1563 625 625 ALA H H 9.235 0.040 1 1564 625 625 ALA C C 172.656 0.450 1 1565 625 625 ALA CA C 50.651 0.450 1 1566 625 625 ALA CB C 23.100 0.450 1 1567 625 625 ALA N N 125.643 0.450 1 1568 626 626 SER H H 8.640 0.040 1 1569 626 626 SER C C 170.087 0.450 1 1570 626 626 SER CA C 56.888 0.450 1 1571 626 626 SER CB C 65.500 0.450 1 1572 626 626 SER N N 113.703 0.450 1 1573 627 627 LEU H H 8.554 0.040 1 1574 627 627 LEU C C 171.178 0.450 1 1575 627 627 LEU CA C 56.016 0.450 1 1576 627 627 LEU CB C 42.500 0.450 1 1577 627 627 LEU N N 123.565 0.450 1 stop_ save_