data_nef_c19214_2m7v save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 4FOF PDB 4GLQ stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 94 CYS SG 2 1 PVN C31 stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 429 MET start . . 2 A 430 ALA middle . . 3 A 431 ALA middle . . 4 A 432 VAL middle . . 5 A 433 GLN middle . . 6 A 434 LEU middle . . 7 A 435 SER middle . . 8 A 436 GLU middle . . 9 A 437 LEU middle . . 10 A 438 ARG middle . . 11 A 439 ASP middle . . 12 A 440 ARG middle . . 13 A 441 GLN middle . . 14 A 442 ALA middle . . 15 A 443 ILE middle . . 16 A 444 PHE middle . . 17 A 445 GLU middle . . 18 A 446 THR middle . . 19 A 447 LEU middle . . 20 A 448 VAL middle . . 21 A 449 ALA middle . . 22 A 450 LYS middle . . 23 A 451 GLY middle . false 24 A 452 ARG middle . . 25 A 453 GLU middle . . 26 A 454 LEU middle . . 27 A 455 LEU middle . . 28 A 456 ALA middle . . 29 A 457 CYS middle . . 30 A 458 ASP middle . . 31 A 459 ARG middle . . 32 A 460 VAL middle . . 33 A 461 ILE middle . . 34 A 462 VAL middle . . 35 A 463 TYR middle . . 36 A 464 ALA middle . . 37 A 465 PHE middle . . 38 A 466 ASP middle . . 39 A 467 ASP middle . . 40 A 468 ASN middle . . 41 A 469 TYR middle . . 42 A 470 VAL middle . . 43 A 471 GLY middle . false 44 A 472 THR middle . . 45 A 473 VAL middle . . 46 A 474 VAL middle . . 47 A 475 ALA middle . . 48 A 476 GLU middle . . 49 A 477 SER middle . . 50 A 478 VAL middle . . 51 A 479 ALA middle . . 52 A 480 GLU middle . . 53 A 481 GLY middle . false 54 A 482 TRP middle . . 55 A 483 PRO middle . false 56 A 484 GLN middle . . 57 A 485 ALA middle . . 58 A 486 ARG middle . . 59 A 487 ASP middle . . 60 A 488 GLN middle . . 61 A 489 VAL middle . . 62 A 490 ILE middle . . 63 A 491 GLU middle . . 64 A 492 ASP middle . . 65 A 493 PRO middle . false 66 A 494 CYS middle . . 67 A 495 PHE middle . . 68 A 496 ARG middle . . 69 A 497 GLU middle . . 70 A 498 HIS middle . . 71 A 499 TRP middle . . 72 A 500 VAL middle . . 73 A 501 GLU middle . . 74 A 502 ALA middle . . 75 A 503 TYR middle . . 76 A 504 ARG middle . . 77 A 505 GLN middle . . 78 A 506 GLY middle . false 79 A 507 ARG middle . . 80 A 508 ILE middle . . 81 A 509 GLN middle . . 82 A 510 ALA middle . . 83 A 511 THR middle . . 84 A 512 THR middle . . 85 A 513 ASP middle . . 86 A 514 ILE middle . . 87 A 515 PHE middle . . 88 A 516 LYS middle . . 89 A 517 ALA middle . . 90 A 518 GLY middle . false 91 A 519 LEU middle . . 92 A 520 THR middle . . 93 A 521 GLU middle . . 94 A 522 CYS middle -HG . 95 A 523 HIS middle . . 96 A 524 LEU middle . . 97 A 525 ASN middle . . 98 A 526 GLN middle . . 99 A 527 LEU middle . . 100 A 528 ARG middle . . 101 A 529 PRO middle . false 102 A 530 LEU middle . . 103 A 531 LYS middle . . 104 A 532 VAL middle . . 105 A 533 ARG middle . . 106 A 534 ALA middle . . 107 A 535 ASN middle . . 108 A 536 LEU middle . . 109 A 537 VAL middle . . 110 A 538 VAL middle . . 111 A 539 PRO middle . false 112 A 540 MET middle . . 113 A 541 VAL middle . . 114 A 542 ILE middle . . 115 A 543 ASP middle . . 116 A 544 ASP middle . . 117 A 545 GLN middle . . 118 A 546 LEU middle . . 119 A 547 PHE middle . . 120 A 548 GLY middle . false 121 A 549 LEU middle . . 122 A 550 LEU middle . . 123 A 551 ILE middle . . 124 A 552 ALA middle . . 125 A 553 HIS middle . . 126 A 554 GLN middle . . 127 A 555 ALA middle . . 128 A 556 SER middle . . 129 A 557 GLU middle . . 130 A 558 PRO middle . false 131 A 559 ARG middle . . 132 A 560 GLN middle . . 133 A 561 TRP middle . . 134 A 562 GLN middle . . 135 A 563 GLU middle . . 136 A 564 ILE middle . . 137 A 565 GLU middle . . 138 A 566 ILE middle . . 139 A 567 ASP middle . . 140 A 568 GLN middle . . 141 A 569 PHE middle . . 142 A 570 SER middle . . 143 A 571 GLU middle . . 144 A 572 LEU middle . . 145 A 573 ALA middle . . 146 A 574 SER middle . . 147 A 575 THR middle . . 148 A 576 GLY middle . false 149 A 577 SER middle . . 150 A 578 LEU middle . . 151 A 579 VAL middle . . 152 A 580 LEU middle . . 153 A 581 GLU middle . . 154 A 582 ARG middle . . 155 A 583 LEU middle . . 156 A 584 HIS middle . . 157 A 585 PHE middle . . 158 A 586 LEU middle . . 159 A 587 GLU middle . . 160 A 588 GLN middle . . 161 A 589 THR middle . . 162 A 590 ILE middle . . 163 A 591 ALA middle . . 164 A 592 SER middle . . 165 A 593 LEU end . . 166 B 1 PVN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 431 ALA HA H 1 4.315 0.04 A 431 ALA HB% H 1 1.326 0.04 A 431 ALA C C 13 177.643 0.25 A 431 ALA CA C 13 52.380 0.25 A 431 ALA CB C 13 19.190 0.25 A 432 VAL H H 1 8.178 0.04 A 432 VAL HA H 1 4.019 0.04 A 432 VAL HB H 1 1.933 0.04 A 432 VAL HG1% H 1 0.864 0.04 A 432 VAL HG2% H 1 0.894 0.04 A 432 VAL C C 13 175.763 0.25 A 432 VAL CA C 13 62.234 0.25 A 432 VAL CB C 13 33.009 0.25 A 432 VAL CG1 C 13 21.065 0.25 A 432 VAL N N 15 120.312 0.25 A 433 GLN H H 1 8.502 0.04 A 433 GLN CB C 13 29.519 0.25 A 433 GLN N N 15 124.379 0.25 A 435 SER HA H 1 4.069 0.04 A 435 SER HB2 H 1 3.770 0.04 A 435 SER HB3 H 1 3.928 0.04 A 435 SER C C 13 178.994 0.25 A 435 SER CA C 13 60.511 0.25 A 435 SER CB C 13 62.860 0.25 A 436 GLU H H 1 7.805 0.04 A 436 GLU HA H 1 4.293 0.04 A 436 GLU HB2 H 1 1.949 0.04 A 436 GLU HB3 H 1 2.151 0.04 A 436 GLU HG3 H 1 2.171 0.04 A 436 GLU C C 13 176.644 0.25 A 436 GLU CA C 13 56.016 0.25 A 436 GLU CB C 13 30.335 0.25 A 436 GLU CG C 13 36.745 0.25 A 436 GLU N N 15 119.753 0.25 A 437 LEU H H 1 7.352 0.04 A 437 LEU HA H 1 4.150 0.04 A 437 LEU HB2 H 1 1.120 0.04 A 437 LEU HD1% H 1 0.750 0.04 A 437 LEU HD2% H 1 0.730 0.04 A 437 LEU CA C 13 55.497 0.25 A 437 LEU CB C 13 43.460 0.25 A 437 LEU CD1 C 13 24.900 0.25 A 437 LEU CD2 C 13 23.300 0.25 A 437 LEU N N 15 120.618 0.25 A 440 ARG HA H 1 3.240 0.04 A 440 ARG HB2 H 1 1.440 0.04 A 440 ARG HB3 H 1 1.515 0.04 A 440 ARG HD3 H 1 3.140 0.04 A 440 ARG HE H 1 7.470 0.04 A 440 ARG HG2 H 1 1.096 0.04 A 440 ARG HG3 H 1 1.341 0.04 A 440 ARG C C 13 175.895 0.25 A 440 ARG CA C 13 60.040 0.25 A 440 ARG CB C 13 30.218 0.25 A 440 ARG CD C 13 43.618 0.25 A 440 ARG CG C 13 28.303 0.25 A 441 GLN H H 1 8.075 0.04 A 441 GLN HA H 1 3.894 0.04 A 441 GLN HB2 H 1 2.024 0.04 A 441 GLN HB3 H 1 2.200 0.04 A 441 GLN HE21 H 1 8.080 0.04 A 441 GLN HE22 H 1 7.170 0.04 A 441 GLN HG3 H 1 2.463 0.04 A 441 GLN C C 13 177.959 0.25 A 441 GLN CA C 13 58.904 0.25 A 441 GLN CB C 13 27.387 0.25 A 441 GLN CG C 13 33.076 0.25 A 441 GLN N N 15 117.761 0.25 A 441 GLN NE2 N 15 111.900 0.25 A 442 ALA H H 1 7.859 0.04 A 442 ALA HA H 1 4.142 0.04 A 442 ALA HB% H 1 1.494 0.04 A 442 ALA C C 13 181.535 0.25 A 442 ALA CA C 13 54.843 0.25 A 442 ALA CB C 13 18.746 0.25 A 442 ALA N N 15 120.325 0.25 A 443 ILE H H 1 7.668 0.04 A 443 ILE HA H 1 3.412 0.04 A 443 ILE HB H 1 1.726 0.04 A 443 ILE HD1% H 1 0.470 0.04 A 443 ILE HG12 H 1 0.820 0.04 A 443 ILE HG13 H 1 1.530 0.04 A 443 ILE HG2% H 1 0.567 0.04 A 443 ILE C C 13 177.554 0.25 A 443 ILE CA C 13 65.839 0.25 A 443 ILE CB C 13 37.236 0.25 A 443 ILE CD1 C 13 14.600 0.25 A 443 ILE CG1 C 13 30.500 0.25 A 443 ILE CG2 C 13 16.403 0.25 A 443 ILE N N 15 120.878 0.25 A 444 PHE H H 1 8.128 0.04 A 444 PHE HA H 1 4.364 0.04 A 444 PHE HB2 H 1 2.938 0.04 A 444 PHE HB3 H 1 3.215 0.04 A 444 PHE HD2 H 1 6.970 0.04 A 444 PHE HE2 H 1 7.160 0.04 A 444 PHE C C 13 178.054 0.25 A 444 PHE CA C 13 58.952 0.25 A 444 PHE CB C 13 37.948 0.25 A 444 PHE CD2 C 13 130.200 0.25 A 444 PHE N N 15 119.157 0.25 A 445 GLU H H 1 8.711 0.04 A 445 GLU HA H 1 3.985 0.04 A 445 GLU HB3 H 1 2.104 0.04 A 445 GLU HG2 H 1 2.507 0.04 A 445 GLU HG3 H 1 2.593 0.04 A 445 GLU C C 13 179.563 0.25 A 445 GLU CA C 13 59.156 0.25 A 445 GLU CB C 13 29.177 0.25 A 445 GLU CG C 13 36.709 0.25 A 445 GLU N N 15 116.382 0.25 A 446 THR H H 1 8.105 0.04 A 446 THR HA H 1 4.066 0.04 A 446 THR HB H 1 4.142 0.04 A 446 THR HG2% H 1 1.136 0.04 A 446 THR C C 13 175.861 0.25 A 446 THR CA C 13 67.041 0.25 A 446 THR CB C 13 68.218 0.25 A 446 THR CG2 C 13 21.503 0.25 A 446 THR N N 15 118.118 0.25 A 447 LEU H H 1 8.552 0.04 A 447 LEU HA H 1 3.852 0.04 A 447 LEU HB2 H 1 1.254 0.04 A 447 LEU HB3 H 1 1.984 0.04 A 447 LEU HD1% H 1 0.800 0.04 A 447 LEU HD2% H 1 0.708 0.04 A 447 LEU HG H 1 1.780 0.04 A 447 LEU C C 13 179.512 0.25 A 447 LEU CA C 13 58.956 0.25 A 447 LEU CB C 13 42.493 0.25 A 447 LEU CD1 C 13 24.606 0.25 A 447 LEU CD2 C 13 24.300 0.25 A 447 LEU CG C 13 26.600 0.25 A 447 LEU N N 15 121.874 0.25 A 448 VAL H H 1 7.695 0.04 A 448 VAL HA H 1 4.039 0.04 A 448 VAL HB H 1 1.980 0.04 A 448 VAL HG1% H 1 1.015 0.04 A 448 VAL HG2% H 1 0.816 0.04 A 448 VAL C C 13 177.323 0.25 A 448 VAL CA C 13 64.562 0.25 A 448 VAL CB C 13 30.055 0.25 A 448 VAL CG1 C 13 20.244 0.25 A 448 VAL CG2 C 13 24.557 0.25 A 448 VAL N N 15 108.313 0.25 A 449 ALA H H 1 7.421 0.04 A 449 ALA HA H 1 4.246 0.04 A 449 ALA HB% H 1 1.579 0.04 A 449 ALA C C 13 181.275 0.25 A 449 ALA CA C 13 55.054 0.25 A 449 ALA CB C 13 18.528 0.25 A 449 ALA N N 15 124.683 0.25 A 450 LYS H H 1 8.806 0.04 A 450 LYS HA H 1 4.170 0.04 A 450 LYS HB2 H 1 1.839 0.04 A 450 LYS HB3 H 1 1.996 0.04 A 450 LYS HD2 H 1 2.860 0.04 A 450 LYS HD3 H 1 2.940 0.04 A 450 LYS HG3 H 1 1.603 0.04 A 450 LYS C C 13 180.083 0.25 A 450 LYS CA C 13 58.219 0.25 A 450 LYS CB C 13 31.697 0.25 A 450 LYS CD C 13 41.900 0.25 A 450 LYS CG C 13 25.300 0.25 A 450 LYS N N 15 118.092 0.25 A 451 GLY H H 1 8.816 0.04 A 451 GLY HA2 H 1 3.645 0.04 A 451 GLY HA3 H 1 3.783 0.04 A 451 GLY C C 13 173.724 0.25 A 451 GLY CA C 13 47.965 0.25 A 451 GLY N N 15 108.217 0.25 A 452 ARG H H 1 8.190 0.04 A 452 ARG HA H 1 4.100 0.04 A 452 ARG HB2 H 1 1.560 0.04 A 452 ARG HB3 H 1 2.180 0.04 A 452 ARG HD3 H 1 2.890 0.04 A 452 ARG HE H 1 7.410 0.04 A 452 ARG C C 13 178.908 0.25 A 452 ARG CA C 13 60.504 0.25 A 452 ARG CB C 13 30.208 0.25 A 452 ARG N N 15 122.310 0.25 A 452 ARG NE N 15 82.800 0.25 A 453 GLU H H 1 7.872 0.04 A 453 GLU HA H 1 4.076 0.04 A 453 GLU HB3 H 1 2.175 0.04 A 453 GLU HG3 H 1 2.366 0.04 A 453 GLU C C 13 178.638 0.25 A 453 GLU CA C 13 58.999 0.25 A 453 GLU CB C 13 30.188 0.25 A 453 GLU CG C 13 36.249 0.25 A 453 GLU N N 15 119.749 0.25 A 454 LEU H H 1 8.275 0.04 A 454 LEU HA H 1 4.157 0.04 A 454 LEU HB2 H 1 1.883 0.04 A 454 LEU HB3 H 1 1.925 0.04 A 454 LEU HD1% H 1 0.941 0.04 A 454 LEU HG H 1 1.648 0.04 A 454 LEU C C 13 178.446 0.25 A 454 LEU CA C 13 57.868 0.25 A 454 LEU CB C 13 43.001 0.25 A 454 LEU CD1 C 13 25.396 0.25 A 454 LEU CD2 C 13 24.064 0.25 A 454 LEU CG C 13 27.069 0.25 A 454 LEU N N 15 119.235 0.25 A 455 LEU H H 1 7.393 0.04 A 455 LEU HA H 1 4.406 0.04 A 455 LEU HB2 H 1 1.304 0.04 A 455 LEU HB3 H 1 1.770 0.04 A 455 LEU HD1% H 1 0.610 0.04 A 455 LEU HG H 1 -0.148 0.04 A 455 LEU C C 13 177.047 0.25 A 455 LEU CA C 13 54.730 0.25 A 455 LEU CB C 13 43.848 0.25 A 455 LEU CD1 C 13 22.515 0.25 A 455 LEU CG C 13 26.904 0.25 A 455 LEU N N 15 112.983 0.25 A 456 ALA H H 1 8.567 0.04 A 456 ALA HA H 1 4.239 0.04 A 456 ALA HB% H 1 1.453 0.04 A 456 ALA C C 13 177.010 0.25 A 456 ALA CA C 13 52.955 0.25 A 456 ALA CB C 13 16.479 0.25 A 456 ALA N N 15 124.090 0.25 A 457 CYS H H 1 6.942 0.04 A 457 CYS HA H 1 5.658 0.04 A 457 CYS HB2 H 1 2.521 0.04 A 457 CYS HB3 H 1 3.712 0.04 A 457 CYS C C 13 173.094 0.25 A 457 CYS CA C 13 54.770 0.25 A 457 CYS CB C 13 29.803 0.25 A 457 CYS N N 15 111.388 0.25 A 458 ASP H H 1 7.157 0.04 A 458 ASP HA H 1 4.808 0.04 A 458 ASP HB2 H 1 1.830 0.04 A 458 ASP HB3 H 1 2.039 0.04 A 458 ASP C C 13 175.313 0.25 A 458 ASP CA C 13 57.780 0.25 A 458 ASP CB C 13 42.699 0.25 A 458 ASP N N 15 117.058 0.25 A 459 ARG H H 1 7.946 0.04 A 459 ARG HA H 1 5.396 0.04 A 459 ARG HB3 H 1 1.861 0.04 A 459 ARG HE H 1 6.350 0.04 A 459 ARG HG3 H 1 1.310 0.04 A 459 ARG C C 13 174.465 0.25 A 459 ARG CA C 13 55.628 0.25 A 459 ARG CB C 13 35.127 0.25 A 459 ARG CG C 13 29.997 0.25 A 459 ARG N N 15 117.570 0.25 A 459 ARG NE N 15 83.200 0.25 A 460 VAL H H 1 9.200 0.04 A 460 VAL HA H 1 5.410 0.04 A 460 VAL HB H 1 2.020 0.04 A 460 VAL HG1% H 1 1.092 0.04 A 460 VAL HG2% H 1 0.751 0.04 A 460 VAL C C 13 174.698 0.25 A 460 VAL CA C 13 61.229 0.25 A 460 VAL CB C 13 35.335 0.25 A 460 VAL CG1 C 13 23.113 0.25 A 460 VAL CG2 C 13 23.300 0.25 A 460 VAL N N 15 126.878 0.25 A 461 ILE H H 1 9.247 0.04 A 461 ILE HA H 1 5.198 0.04 A 461 ILE HB H 1 1.836 0.04 A 461 ILE HD1% H 1 0.540 0.04 A 461 ILE HG12 H 1 0.710 0.04 A 461 ILE HG13 H 1 1.190 0.04 A 461 ILE HG2% H 1 0.771 0.04 A 461 ILE C C 13 174.647 0.25 A 461 ILE CA C 13 59.112 0.25 A 461 ILE CB C 13 42.959 0.25 A 461 ILE CD1 C 13 14.200 0.25 A 461 ILE CG1 C 13 26.800 0.25 A 461 ILE CG2 C 13 18.100 0.25 A 461 ILE N N 15 120.070 0.25 A 462 VAL H H 1 7.400 0.04 A 462 VAL HA H 1 4.668 0.04 A 462 VAL HB H 1 1.320 0.04 A 462 VAL HG1% H 1 0.776 0.04 A 462 VAL HG2% H 1 0.265 0.04 A 462 VAL C C 13 173.970 0.25 A 462 VAL CA C 13 61.528 0.25 A 462 VAL CB C 13 33.865 0.25 A 462 VAL CG1 C 13 22.300 0.25 A 462 VAL CG2 C 13 21.000 0.25 A 462 VAL N N 15 118.676 0.25 A 463 TYR H H 1 8.782 0.04 A 463 TYR HA H 1 4.937 0.04 A 463 TYR HB2 H 1 2.152 0.04 A 463 TYR HB3 H 1 2.697 0.04 A 463 TYR HD2 H 1 6.310 0.04 A 463 TYR HE2 H 1 6.530 0.04 A 463 TYR C C 13 173.196 0.25 A 463 TYR CA C 13 55.589 0.25 A 463 TYR CB C 13 41.849 0.25 A 463 TYR CD2 C 13 132.100 0.25 A 463 TYR CE2 C 13 117.700 0.25 A 463 TYR N N 15 131.551 0.25 A 464 ALA H H 1 8.295 0.04 A 464 ALA HA H 1 4.418 0.04 A 464 ALA HB% H 1 0.774 0.04 A 464 ALA C C 13 175.095 0.25 A 464 ALA CA C 13 50.422 0.25 A 464 ALA CB C 13 22.676 0.25 A 464 ALA N N 15 127.436 0.25 A 465 PHE H H 1 7.426 0.04 A 465 PHE HA H 1 4.434 0.04 A 465 PHE HB2 H 1 2.266 0.04 A 465 PHE HB3 H 1 2.550 0.04 A 465 PHE HD2 H 1 6.860 0.04 A 465 PHE HE2 H 1 7.180 0.04 A 465 PHE C C 13 176.189 0.25 A 465 PHE CA C 13 56.771 0.25 A 465 PHE CB C 13 42.082 0.25 A 465 PHE N N 15 116.385 0.25 A 466 ASP H H 1 8.012 0.04 A 466 ASP HA H 1 4.765 0.04 A 466 ASP HB3 H 1 3.256 0.04 A 466 ASP C C 13 178.212 0.25 A 466 ASP CA C 13 52.007 0.25 A 466 ASP CB C 13 41.201 0.25 A 466 ASP N N 15 121.980 0.25 A 467 ASP H H 1 8.335 0.04 A 467 ASP HA H 1 4.146 0.04 A 467 ASP HB2 H 1 2.495 0.04 A 467 ASP HB3 H 1 2.608 0.04 A 467 ASP C C 13 176.189 0.25 A 467 ASP CA C 13 56.172 0.25 A 467 ASP CB C 13 40.189 0.25 A 467 ASP N N 15 116.915 0.25 A 468 ASN H H 1 8.237 0.04 A 468 ASN HA H 1 4.689 0.04 A 468 ASN HB2 H 1 2.679 0.04 A 468 ASN HB3 H 1 2.885 0.04 A 468 ASN HD21 H 1 7.740 0.04 A 468 ASN HD22 H 1 6.820 0.04 A 468 ASN C C 13 174.068 0.25 A 468 ASN CA C 13 52.711 0.25 A 468 ASN CB C 13 39.418 0.25 A 468 ASN N N 15 116.918 0.25 A 468 ASN ND2 N 15 114.400 0.25 A 469 TYR H H 1 7.975 0.04 A 469 TYR HA H 1 3.614 0.04 A 469 TYR HB2 H 1 2.920 0.04 A 469 TYR HB3 H 1 3.000 0.04 A 469 TYR HD2 H 1 5.970 0.04 A 469 TYR HE2 H 1 6.620 0.04 A 469 TYR C C 13 173.766 0.25 A 469 TYR CA C 13 60.636 0.25 A 469 TYR CB C 13 34.697 0.25 A 469 TYR CE2 C 13 118.200 0.25 A 469 TYR N N 15 113.180 0.25 A 470 VAL H H 1 8.354 0.04 A 470 VAL HA H 1 4.100 0.04 A 470 VAL HB H 1 2.270 0.04 A 470 VAL HG1% H 1 0.940 0.04 A 470 VAL HG2% H 1 0.860 0.04 A 470 VAL CA C 13 63.555 0.25 A 470 VAL CB C 13 31.054 0.25 A 470 VAL N N 15 120.871 0.25 A 474 VAL HA H 1 4.288 0.04 A 474 VAL HB H 1 2.090 0.04 A 474 VAL HG1% H 1 0.614 0.04 A 474 VAL HG2% H 1 0.008 0.04 A 474 VAL C C 13 175.489 0.25 A 474 VAL CA C 13 61.669 0.25 A 474 VAL CB C 13 32.382 0.25 A 474 VAL CG1 C 13 22.431 0.25 A 474 VAL CG2 C 13 19.339 0.25 A 475 ALA H H 1 7.321 0.04 A 475 ALA HA H 1 4.552 0.04 A 475 ALA HB% H 1 1.228 0.04 A 475 ALA C C 13 174.363 0.25 A 475 ALA CA C 13 52.023 0.25 A 475 ALA CB C 13 23.339 0.25 A 475 ALA N N 15 118.920 0.25 A 476 GLU H H 1 8.969 0.04 A 476 GLU HA H 1 5.128 0.04 A 476 GLU HB2 H 1 1.748 0.04 A 476 GLU HB3 H 1 1.918 0.04 A 476 GLU HG3 H 1 1.891 0.04 A 476 GLU C C 13 173.921 0.25 A 476 GLU CA C 13 55.372 0.25 A 476 GLU CB C 13 35.144 0.25 A 476 GLU CG C 13 36.687 0.25 A 476 GLU N N 15 121.933 0.25 A 477 SER H H 1 9.069 0.04 A 477 SER HA H 1 4.855 0.04 A 477 SER HB3 H 1 3.579 0.04 A 477 SER C C 13 173.315 0.25 A 477 SER CA C 13 56.600 0.25 A 477 SER CB C 13 64.022 0.25 A 477 SER N N 15 121.397 0.25 A 478 VAL H H 1 9.081 0.04 A 478 VAL HA H 1 5.287 0.04 A 478 VAL HB H 1 2.143 0.04 A 478 VAL HG1% H 1 1.304 0.04 A 478 VAL HG2% H 1 0.991 0.04 A 478 VAL C C 13 173.093 0.25 A 478 VAL CA C 13 58.849 0.25 A 478 VAL CB C 13 35.764 0.25 A 478 VAL CG1 C 13 21.675 0.25 A 478 VAL CG2 C 13 19.418 0.25 A 478 VAL N N 15 128.194 0.25 A 479 ALA H H 1 8.688 0.04 A 479 ALA HA H 1 4.358 0.04 A 479 ALA HB% H 1 1.815 0.04 A 479 ALA C C 13 176.760 0.25 A 479 ALA CA C 13 52.215 0.25 A 479 ALA CB C 13 20.082 0.25 A 479 ALA N N 15 129.566 0.25 A 480 GLU H H 1 8.531 0.04 A 480 GLU HA H 1 4.011 0.04 A 480 GLU HB2 H 1 1.906 0.04 A 480 GLU HB3 H 1 1.990 0.04 A 480 GLU HG3 H 1 2.269 0.04 A 480 GLU C C 13 177.201 0.25 A 480 GLU CA C 13 58.178 0.25 A 480 GLU CB C 13 29.829 0.25 A 480 GLU CG C 13 36.318 0.25 A 480 GLU N N 15 120.391 0.25 A 481 GLY H H 1 8.557 0.04 A 481 GLY HA2 H 1 3.372 0.04 A 481 GLY HA3 H 1 3.834 0.04 A 481 GLY C C 13 174.000 0.25 A 481 GLY CA C 13 44.644 0.25 A 481 GLY N N 15 110.913 0.25 A 482 TRP H H 1 7.066 0.04 A 482 TRP HA H 1 5.200 0.04 A 482 TRP HB2 H 1 2.860 0.04 A 482 TRP HB3 H 1 3.030 0.04 A 482 TRP HD1 H 1 7.110 0.04 A 482 TRP HE1 H 1 9.900 0.04 A 482 TRP HE3 H 1 7.350 0.04 A 482 TRP HH2 H 1 7.070 0.04 A 482 TRP HZ2 H 1 7.390 0.04 A 482 TRP HZ3 H 1 7.000 0.04 A 482 TRP CA C 13 53.641 0.25 A 482 TRP CB C 13 29.556 0.25 A 482 TRP CD1 C 13 128.400 0.25 A 482 TRP CE3 C 13 119.800 0.25 A 482 TRP CH2 C 13 124.200 0.25 A 482 TRP CZ2 C 13 114.900 0.25 A 482 TRP CZ3 C 13 122.100 0.25 A 482 TRP N N 15 119.571 0.25 A 482 TRP NE1 N 15 127.900 0.25 A 484 GLN HE21 H 1 7.290 0.04 A 484 GLN CB C 13 28.700 0.25 A 484 GLN CG C 13 35.000 0.25 A 484 GLN NE2 N 15 110.200 0.25 A 485 ALA HA H 1 4.021 0.04 A 485 ALA HB% H 1 1.363 0.04 A 485 ALA C C 13 180.181 0.25 A 485 ALA CA C 13 55.328 0.25 A 485 ALA CB C 13 18.537 0.25 A 486 ARG H H 1 8.998 0.04 A 486 ARG HA H 1 4.104 0.04 A 486 ARG HB2 H 1 1.766 0.04 A 486 ARG HB3 H 1 1.974 0.04 A 486 ARG HD3 H 1 3.061 0.04 A 486 ARG HG3 H 1 1.588 0.04 A 486 ARG C C 13 176.165 0.25 A 486 ARG CA C 13 58.068 0.25 A 486 ARG CB C 13 29.624 0.25 A 486 ARG N N 15 114.901 0.25 A 487 ASP H H 1 7.424 0.04 A 487 ASP HA H 1 4.724 0.04 A 487 ASP HB2 H 1 2.654 0.04 A 487 ASP HB3 H 1 2.857 0.04 A 487 ASP C C 13 175.859 0.25 A 487 ASP CA C 13 54.873 0.25 A 487 ASP CB C 13 41.415 0.25 A 487 ASP N N 15 117.227 0.25 A 488 GLN H H 1 7.548 0.04 A 488 GLN HA H 1 4.471 0.04 A 488 GLN HB2 H 1 1.972 0.04 A 488 GLN HB3 H 1 2.131 0.04 A 488 GLN HG3 H 1 2.510 0.04 A 488 GLN C C 13 175.010 0.25 A 488 GLN CA C 13 54.037 0.25 A 488 GLN CB C 13 29.989 0.25 A 488 GLN CG C 13 33.490 0.25 A 488 GLN N N 15 117.558 0.25 A 489 VAL H H 1 8.426 0.04 A 489 VAL HA H 1 4.102 0.04 A 489 VAL HB H 1 1.970 0.04 A 489 VAL HG1% H 1 0.900 0.04 A 489 VAL C C 13 175.471 0.25 A 489 VAL CA C 13 62.947 0.25 A 489 VAL CB C 13 31.473 0.25 A 489 VAL CG1 C 13 22.200 0.25 A 489 VAL N N 15 122.991 0.25 A 490 ILE H H 1 8.474 0.04 A 490 ILE HA H 1 4.310 0.04 A 490 ILE HB H 1 1.830 0.04 A 490 ILE HD1% H 1 0.890 0.04 A 490 ILE HG12 H 1 1.210 0.04 A 490 ILE HG13 H 1 1.420 0.04 A 490 ILE HG2% H 1 0.960 0.04 A 490 ILE N N 15 128.401 0.25 A 491 GLU HA H 1 4.361 0.04 A 491 GLU HB2 H 1 1.585 0.04 A 491 GLU HB3 H 1 1.977 0.04 A 491 GLU C C 13 174.175 0.25 A 491 GLU CA C 13 54.874 0.25 A 491 GLU CB C 13 31.063 0.25 A 492 ASP H H 1 6.870 0.04 A 492 ASP HA H 1 4.730 0.04 A 492 ASP HB3 H 1 2.610 0.04 A 492 ASP CA C 13 52.914 0.25 A 492 ASP CB C 13 44.223 0.25 A 492 ASP N N 15 117.270 0.25 A 493 PRO C C 13 178.700 0.25 A 493 PRO CA C 13 63.429 0.25 A 493 PRO CB C 13 32.064 0.25 A 493 PRO CG C 13 27.260 0.25 A 494 CYS H H 1 8.010 0.04 A 494 CYS N N 15 121.800 0.25 A 495 PHE HD1 H 1 6.050 0.04 A 495 PHE HE1 H 1 5.970 0.04 A 495 PHE CB C 13 36.800 0.25 A 500 VAL C C 13 177.132 0.25 A 501 GLU H H 1 8.169 0.04 A 501 GLU C C 13 178.329 0.25 A 501 GLU N N 15 117.783 0.25 A 502 ALA H H 1 7.982 0.04 A 502 ALA HA H 1 3.976 0.04 A 502 ALA HB% H 1 1.278 0.04 A 502 ALA C C 13 181.216 0.25 A 502 ALA CA C 13 55.113 0.25 A 502 ALA CB C 13 17.660 0.25 A 502 ALA N N 15 120.877 0.25 A 503 TYR H H 1 7.310 0.04 A 503 TYR HA H 1 4.440 0.04 A 503 TYR HB2 H 1 2.960 0.04 A 503 TYR HB3 H 1 3.000 0.04 A 503 TYR HD2 H 1 7.550 0.04 A 503 TYR HE2 H 1 6.820 0.04 A 503 TYR C C 13 178.488 0.25 A 503 TYR CA C 13 62.517 0.25 A 503 TYR CB C 13 38.834 0.25 A 503 TYR CD2 C 13 133.700 0.25 A 503 TYR CE2 C 13 117.500 0.25 A 503 TYR N N 15 116.217 0.25 A 504 ARG H H 1 8.424 0.04 A 504 ARG HA H 1 3.748 0.04 A 504 ARG HB3 H 1 1.680 0.04 A 504 ARG C C 13 177.207 0.25 A 504 ARG CA C 13 59.734 0.25 A 504 ARG CB C 13 30.200 0.25 A 504 ARG N N 15 122.384 0.25 A 505 GLN H H 1 7.436 0.04 A 505 GLN HA H 1 4.220 0.04 A 505 GLN HB2 H 1 1.915 0.04 A 505 GLN HB3 H 1 2.404 0.04 A 505 GLN HE21 H 1 7.590 0.04 A 505 GLN HE22 H 1 6.720 0.04 A 505 GLN HG2 H 1 2.302 0.04 A 505 GLN HG3 H 1 2.491 0.04 A 505 GLN C C 13 176.342 0.25 A 505 GLN CA C 13 55.587 0.25 A 505 GLN CB C 13 28.591 0.25 A 505 GLN CG C 13 33.891 0.25 A 505 GLN N N 15 112.682 0.25 A 505 GLN NE2 N 15 111.900 0.25 A 506 GLY H H 1 7.910 0.04 A 506 GLY HA2 H 1 3.560 0.04 A 506 GLY HA3 H 1 4.374 0.04 A 506 GLY C C 13 174.202 0.25 A 506 GLY CA C 13 45.499 0.25 A 506 GLY N N 15 107.068 0.25 A 507 ARG H H 1 7.934 0.04 A 507 ARG HA H 1 3.857 0.04 A 507 ARG HB2 H 1 0.740 0.04 A 507 ARG HB3 H 1 1.330 0.04 A 507 ARG C C 13 172.375 0.25 A 507 ARG CA C 13 57.969 0.25 A 507 ARG CB C 13 30.269 0.25 A 507 ARG N N 15 123.044 0.25 A 508 ILE H H 1 7.572 0.04 A 508 ILE HA H 1 4.819 0.04 A 508 ILE HB H 1 1.677 0.04 A 508 ILE HD1% H 1 0.830 0.04 A 508 ILE HG12 H 1 1.167 0.04 A 508 ILE HG13 H 1 1.470 0.04 A 508 ILE HG2% H 1 0.827 0.04 A 508 ILE C C 13 177.238 0.25 A 508 ILE CA C 13 59.801 0.25 A 508 ILE CB C 13 41.877 0.25 A 508 ILE CD1 C 13 14.137 0.25 A 508 ILE CG1 C 13 27.930 0.25 A 508 ILE CG2 C 13 16.811 0.25 A 508 ILE N N 15 120.600 0.25 A 509 GLN H H 1 8.894 0.04 A 509 GLN HA H 1 4.761 0.04 A 509 GLN HE21 H 1 6.830 0.04 A 509 GLN HE22 H 1 6.710 0.04 A 509 GLN HG3 H 1 2.110 0.04 A 509 GLN C C 13 172.804 0.25 A 509 GLN CA C 13 54.158 0.25 A 509 GLN CB C 13 31.078 0.25 A 509 GLN N N 15 127.676 0.25 A 510 ALA H H 1 9.110 0.04 A 510 ALA HA H 1 4.912 0.04 A 510 ALA HB% H 1 1.317 0.04 A 510 ALA C C 13 175.581 0.25 A 510 ALA CA C 13 51.180 0.25 A 510 ALA CB C 13 19.939 0.25 A 510 ALA N N 15 132.910 0.25 A 511 THR H H 1 9.525 0.04 A 511 THR HA H 1 4.636 0.04 A 511 THR HB H 1 4.207 0.04 A 511 THR HG2% H 1 1.071 0.04 A 511 THR C C 13 174.690 0.25 A 511 THR CA C 13 61.883 0.25 A 511 THR CB C 13 69.826 0.25 A 511 THR CG2 C 13 23.900 0.25 A 511 THR N N 15 123.543 0.25 A 512 THR H H 1 9.024 0.04 A 512 THR HA H 1 4.524 0.04 A 512 THR HB H 1 3.949 0.04 A 512 THR HG2% H 1 0.876 0.04 A 512 THR C C 13 172.791 0.25 A 512 THR CA C 13 63.974 0.25 A 512 THR CB C 13 69.199 0.25 A 512 THR CG2 C 13 22.000 0.25 A 512 THR N N 15 129.502 0.25 A 513 ASP H H 1 7.263 0.04 A 513 ASP HA H 1 4.891 0.04 A 513 ASP HB2 H 1 2.304 0.04 A 513 ASP HB3 H 1 2.579 0.04 A 513 ASP C C 13 179.282 0.25 A 513 ASP CA C 13 51.637 0.25 A 513 ASP CB C 13 42.591 0.25 A 513 ASP N N 15 113.203 0.25 A 514 ILE H H 1 9.465 0.04 A 514 ILE HA H 1 3.595 0.04 A 514 ILE HB H 1 1.439 0.04 A 514 ILE HD1% H 1 0.075 0.04 A 514 ILE HG2% H 1 0.542 0.04 A 514 ILE C C 13 175.984 0.25 A 514 ILE CA C 13 64.552 0.25 A 514 ILE CB C 13 37.796 0.25 A 514 ILE CD1 C 13 16.000 0.25 A 514 ILE CG2 C 13 17.787 0.25 A 514 ILE N N 15 122.554 0.25 A 515 PHE H H 1 7.804 0.04 A 515 PHE HA H 1 4.399 0.04 A 515 PHE HB2 H 1 2.912 0.04 A 515 PHE HB3 H 1 3.337 0.04 A 515 PHE HD1 H 1 7.260 0.04 A 515 PHE HE1 H 1 7.160 0.04 A 515 PHE HZ H 1 7.320 0.04 A 515 PHE C C 13 176.347 0.25 A 515 PHE CA C 13 59.346 0.25 A 515 PHE CB C 13 37.709 0.25 A 515 PHE CD1 C 13 131.400 0.25 A 515 PHE CE1 C 13 131.300 0.25 A 515 PHE CZ C 13 131.500 0.25 A 515 PHE N N 15 117.573 0.25 A 516 LYS H H 1 7.559 0.04 A 516 LYS HA H 1 4.692 0.04 A 516 LYS HB2 H 1 1.509 0.04 A 516 LYS HB3 H 1 2.147 0.04 A 516 LYS HD2 H 1 1.272 0.04 A 516 LYS HD3 H 1 1.337 0.04 A 516 LYS HE3 H 1 2.965 0.04 A 516 LYS HG2 H 1 1.610 0.04 A 516 LYS HG3 H 1 1.684 0.04 A 516 LYS C C 13 175.821 0.25 A 516 LYS CA C 13 54.851 0.25 A 516 LYS CB C 13 33.855 0.25 A 516 LYS CD C 13 29.202 0.25 A 516 LYS CE C 13 43.600 0.25 A 516 LYS CG C 13 24.983 0.25 A 516 LYS N N 15 118.690 0.25 A 517 ALA H H 1 7.219 0.04 A 517 ALA HA H 1 4.530 0.04 A 517 ALA HB% H 1 1.330 0.04 A 517 ALA CA C 13 52.124 0.25 A 517 ALA CB C 13 20.974 0.25 A 517 ALA N N 15 121.471 0.25 A 518 GLY HA3 H 1 3.818 0.04 A 518 GLY C C 13 175.423 0.25 A 518 GLY CA C 13 46.692 0.25 A 519 LEU H H 1 8.531 0.04 A 519 LEU HA H 1 4.348 0.04 A 519 LEU HB2 H 1 1.450 0.04 A 519 LEU HB3 H 1 1.550 0.04 A 519 LEU HD1% H 1 0.490 0.04 A 519 LEU HD2% H 1 0.370 0.04 A 519 LEU HG H 1 0.690 0.04 A 519 LEU C C 13 177.704 0.25 A 519 LEU CA C 13 54.535 0.25 A 519 LEU CB C 13 41.174 0.25 A 519 LEU N N 15 119.857 0.25 A 520 THR H H 1 9.352 0.04 A 520 THR HA H 1 4.260 0.04 A 520 THR HB H 1 4.360 0.04 A 520 THR HG2% H 1 1.460 0.04 A 520 THR CA C 13 61.653 0.25 A 520 THR CB C 13 71.260 0.25 A 520 THR CG2 C 13 23.000 0.25 A 520 THR N N 15 113.386 0.25 A 522 CYS HA H 1 4.385 0.04 A 522 CYS HB2 H 1 2.420 0.04 A 522 CYS HB3 H 1 3.430 0.04 A 522 CYS C C 13 175.903 0.25 A 522 CYS CA C 13 58.664 0.25 A 522 CYS CB C 13 31.785 0.25 A 523 HIS H H 1 7.210 0.04 A 523 HIS HA H 1 4.430 0.04 A 523 HIS HB2 H 1 2.090 0.04 A 523 HIS HB3 H 1 3.160 0.04 A 523 HIS HD2 H 1 6.230 0.04 A 523 HIS HE1 H 1 7.280 0.04 A 523 HIS C C 13 178.292 0.25 A 523 HIS CA C 13 55.874 0.25 A 523 HIS CB C 13 33.792 0.25 A 523 HIS CD2 C 13 113.600 0.25 A 523 HIS CE1 C 13 138.000 0.25 A 523 HIS N N 15 125.416 0.25 A 524 LEU H H 1 8.407 0.04 A 524 LEU HA H 1 3.447 0.04 A 524 LEU HB2 H 1 1.113 0.04 A 524 LEU HB3 H 1 1.770 0.04 A 524 LEU HD1% H 1 0.673 0.04 A 524 LEU HD2% H 1 0.439 0.04 A 524 LEU HG H 1 1.330 0.04 A 524 LEU C C 13 179.772 0.25 A 524 LEU CA C 13 58.643 0.25 A 524 LEU CB C 13 41.395 0.25 A 524 LEU CD1 C 13 25.200 0.25 A 524 LEU CD2 C 13 24.000 0.25 A 524 LEU CG C 13 26.600 0.25 A 524 LEU N N 15 120.382 0.25 A 525 ASN H H 1 8.540 0.04 A 525 ASN HA H 1 4.474 0.04 A 525 ASN HB3 H 1 2.722 0.04 A 525 ASN HD21 H 1 7.630 0.04 A 525 ASN HD22 H 1 7.040 0.04 A 525 ASN C C 13 176.493 0.25 A 525 ASN CA C 13 55.154 0.25 A 525 ASN CB C 13 38.056 0.25 A 525 ASN N N 15 115.617 0.25 A 525 ASN ND2 N 15 112.500 0.25 A 526 GLN H H 1 7.492 0.04 A 526 GLN HA H 1 4.004 0.04 A 526 GLN HE21 H 1 7.520 0.04 A 526 GLN HE22 H 1 6.850 0.04 A 526 GLN C C 13 175.549 0.25 A 526 GLN CA C 13 57.483 0.25 A 526 GLN CB C 13 29.433 0.25 A 526 GLN CG C 13 33.600 0.25 A 526 GLN N N 15 116.828 0.25 A 526 GLN NE2 N 15 112.500 0.25 A 527 LEU H H 1 6.803 0.04 A 527 LEU HA H 1 4.064 0.04 A 527 LEU HB2 H 1 0.760 0.04 A 527 LEU HB3 H 1 1.250 0.04 A 527 LEU HD1% H 1 0.510 0.04 A 527 LEU HD2% H 1 0.110 0.04 A 527 LEU HG H 1 1.310 0.04 A 527 LEU C C 13 178.808 0.25 A 527 LEU CA C 13 55.460 0.25 A 527 LEU CB C 13 43.643 0.25 A 527 LEU CD1 C 13 22.700 0.25 A 527 LEU CD2 C 13 25.200 0.25 A 527 LEU CG C 13 26.100 0.25 A 527 LEU N N 15 115.200 0.25 A 528 ARG H H 1 8.763 0.04 A 528 ARG HA H 1 4.230 0.04 A 528 ARG HB2 H 1 1.690 0.04 A 528 ARG HB3 H 1 1.930 0.04 A 528 ARG HD2 H 1 3.240 0.04 A 528 ARG HD3 H 1 3.600 0.04 A 528 ARG CA C 13 61.240 0.25 A 528 ARG CB C 13 28.670 0.25 A 528 ARG N N 15 121.174 0.25 A 529 PRO HA H 1 4.397 0.04 A 529 PRO HB2 H 1 1.620 0.04 A 529 PRO HB3 H 1 2.320 0.04 A 529 PRO HG3 H 1 1.900 0.04 A 529 PRO C C 13 176.672 0.25 A 529 PRO CA C 13 65.693 0.25 A 529 PRO CB C 13 30.983 0.25 A 529 PRO CG C 13 28.200 0.25 A 530 LEU H H 1 6.762 0.04 A 530 LEU HA H 1 4.198 0.04 A 530 LEU HB2 H 1 1.387 0.04 A 530 LEU HB3 H 1 1.660 0.04 A 530 LEU HD2% H 1 0.648 0.04 A 530 LEU HG H 1 0.880 0.04 A 530 LEU C C 13 176.746 0.25 A 530 LEU CA C 13 53.564 0.25 A 530 LEU CB C 13 42.143 0.25 A 530 LEU CD2 C 13 22.633 0.25 A 530 LEU CG C 13 26.848 0.25 A 530 LEU N N 15 112.952 0.25 A 531 LYS H H 1 8.319 0.04 A 531 LYS HA H 1 3.921 0.04 A 531 LYS HB2 H 1 2.148 0.04 A 531 LYS HB3 H 1 2.252 0.04 A 531 LYS HD2 H 1 1.740 0.04 A 531 LYS HD3 H 1 1.900 0.04 A 531 LYS HE3 H 1 3.020 0.04 A 531 LYS HG2 H 1 1.310 0.04 A 531 LYS HG3 H 1 1.530 0.04 A 531 LYS C C 13 173.427 0.25 A 531 LYS CA C 13 56.732 0.25 A 531 LYS CB C 13 28.329 0.25 A 531 LYS CD C 13 29.100 0.25 A 531 LYS CE C 13 42.600 0.25 A 531 LYS CG C 13 25.500 0.25 A 531 LYS N N 15 114.491 0.25 A 532 VAL H H 1 6.295 0.04 A 532 VAL HA H 1 2.631 0.04 A 532 VAL HB H 1 1.216 0.04 A 532 VAL HG1% H 1 0.306 0.04 A 532 VAL HG2% H 1 -0.192 0.04 A 532 VAL C C 13 174.660 0.25 A 532 VAL CA C 13 65.644 0.25 A 532 VAL CB C 13 32.120 0.25 A 532 VAL CG1 C 13 21.300 0.25 A 532 VAL CG2 C 13 21.900 0.25 A 532 VAL N N 15 114.641 0.25 A 533 ARG H H 1 8.446 0.04 A 533 ARG HA H 1 4.473 0.04 A 533 ARG HB3 H 1 1.391 0.04 A 533 ARG C C 13 173.734 0.25 A 533 ARG CA C 13 55.062 0.25 A 533 ARG CB C 13 30.163 0.25 A 533 ARG N N 15 120.970 0.25 A 534 ALA H H 1 8.477 0.04 A 534 ALA HA H 1 4.842 0.04 A 534 ALA HB% H 1 1.677 0.04 A 534 ALA C C 13 176.821 0.25 A 534 ALA CA C 13 51.093 0.25 A 534 ALA CB C 13 24.474 0.25 A 534 ALA N N 15 123.443 0.25 A 535 ASN H H 1 8.910 0.04 A 535 ASN HA H 1 5.709 0.04 A 535 ASN HB2 H 1 1.861 0.04 A 535 ASN HB3 H 1 2.683 0.04 A 535 ASN HD21 H 1 6.570 0.04 A 535 ASN HD22 H 1 6.330 0.04 A 535 ASN C C 13 171.453 0.25 A 535 ASN CA C 13 52.188 0.25 A 535 ASN CB C 13 44.081 0.25 A 535 ASN N N 15 121.981 0.25 A 535 ASN ND2 N 15 105.800 0.25 A 536 LEU H H 1 9.242 0.04 A 536 LEU HA H 1 5.104 0.04 A 536 LEU HB2 H 1 -1.020 0.04 A 536 LEU HB3 H 1 0.587 0.04 A 536 LEU HD1% H 1 0.472 0.04 A 536 LEU HD2% H 1 -0.460 0.04 A 536 LEU HG H 1 0.950 0.04 A 536 LEU C C 13 173.245 0.25 A 536 LEU CA C 13 53.812 0.25 A 536 LEU CB C 13 41.977 0.25 A 536 LEU CD1 C 13 23.900 0.25 A 536 LEU CD2 C 13 25.800 0.25 A 536 LEU CG C 13 26.800 0.25 A 536 LEU N N 15 132.341 0.25 A 537 VAL H H 1 9.258 0.04 A 537 VAL HA H 1 4.580 0.04 A 537 VAL HB H 1 2.235 0.04 A 537 VAL HG1% H 1 0.682 0.04 A 537 VAL HG2% H 1 0.581 0.04 A 537 VAL C C 13 174.764 0.25 A 537 VAL CA C 13 61.450 0.25 A 537 VAL CB C 13 35.260 0.25 A 537 VAL CG1 C 13 19.830 0.25 A 537 VAL CG2 C 13 23.596 0.25 A 537 VAL N N 15 126.829 0.25 A 538 VAL H H 1 8.809 0.04 A 538 VAL HA H 1 5.240 0.04 A 538 VAL HB H 1 2.170 0.04 A 538 VAL HG1% H 1 0.990 0.04 A 538 VAL HG2% H 1 0.750 0.04 A 538 VAL CA C 13 56.785 0.25 A 538 VAL CB C 13 33.470 0.25 A 538 VAL CG1 C 13 21.800 0.25 A 538 VAL CG2 C 13 21.800 0.25 A 538 VAL N N 15 120.280 0.25 A 539 PRO HA H 1 4.756 0.04 A 539 PRO C C 13 175.826 0.25 A 539 PRO CA C 13 62.754 0.25 A 539 PRO CB C 13 34.400 0.25 A 540 MET H H 1 8.360 0.04 A 540 MET HA H 1 4.397 0.04 A 540 MET HE% H 1 1.730 0.04 A 540 MET HG3 H 1 2.133 0.04 A 540 MET C C 13 173.839 0.25 A 540 MET CA C 13 55.758 0.25 A 540 MET CB C 13 34.217 0.25 A 540 MET CE C 13 16.300 0.25 A 540 MET N N 15 118.724 0.25 A 541 VAL H H 1 8.383 0.04 A 541 VAL HA H 1 5.100 0.04 A 541 VAL HB H 1 1.920 0.04 A 541 VAL HG1% H 1 0.838 0.04 A 541 VAL HG2% H 1 0.910 0.04 A 541 VAL C C 13 174.569 0.25 A 541 VAL CA C 13 60.526 0.25 A 541 VAL CB C 13 34.461 0.25 A 541 VAL CG1 C 13 20.200 0.25 A 541 VAL CG2 C 13 21.600 0.25 A 541 VAL N N 15 125.320 0.25 A 542 ILE H H 1 8.470 0.04 A 542 ILE HA H 1 4.256 0.04 A 542 ILE HB H 1 1.620 0.04 A 542 ILE HD1% H 1 0.530 0.04 A 542 ILE HG12 H 1 1.040 0.04 A 542 ILE HG13 H 1 1.380 0.04 A 542 ILE HG2% H 1 0.720 0.04 A 542 ILE C C 13 175.815 0.25 A 542 ILE CA C 13 60.441 0.25 A 542 ILE CB C 13 41.219 0.25 A 542 ILE CD1 C 13 14.200 0.25 A 542 ILE CG1 C 13 27.900 0.25 A 542 ILE CG2 C 13 17.100 0.25 A 542 ILE N N 15 125.677 0.25 A 543 ASP H H 1 9.650 0.04 A 543 ASP HA H 1 4.150 0.04 A 543 ASP HB3 H 1 2.910 0.04 A 543 ASP CA C 13 56.014 0.25 A 543 ASP CB C 13 39.515 0.25 A 543 ASP N N 15 130.204 0.25 A 544 ASP HA H 1 4.180 0.04 A 544 ASP HB2 H 1 2.690 0.04 A 544 ASP HB3 H 1 2.790 0.04 A 544 ASP C C 13 174.473 0.25 A 544 ASP CA C 13 55.500 0.25 A 544 ASP CB C 13 40.941 0.25 A 545 GLN H H 1 7.868 0.04 A 545 GLN CA C 13 53.533 0.25 A 545 GLN N N 15 117.251 0.25 A 546 LEU C C 13 174.500 0.25 A 547 PHE H H 1 9.120 0.04 A 547 PHE HA H 1 4.650 0.04 A 547 PHE HB2 H 1 2.980 0.04 A 547 PHE HB3 H 1 3.070 0.04 A 547 PHE HD1 H 1 7.160 0.04 A 547 PHE HE1 H 1 7.180 0.04 A 547 PHE C C 13 176.033 0.25 A 547 PHE CA C 13 59.700 0.25 A 547 PHE CB C 13 40.800 0.25 A 547 PHE CD1 C 13 131.400 0.25 A 547 PHE CE1 C 13 129.500 0.25 A 547 PHE N N 15 130.200 0.25 A 548 GLY H H 1 7.939 0.04 A 548 GLY HA3 H 1 4.072 0.04 A 548 GLY C C 13 169.494 0.25 A 548 GLY CA C 13 46.008 0.25 A 548 GLY N N 15 102.705 0.25 A 549 LEU H H 1 9.279 0.04 A 549 LEU HA H 1 4.870 0.04 A 549 LEU C C 13 173.746 0.25 A 549 LEU CA C 13 53.108 0.25 A 549 LEU CB C 13 44.752 0.25 A 549 LEU CG C 13 26.500 0.25 A 549 LEU N N 15 118.437 0.25 A 550 LEU H H 1 9.068 0.04 A 550 LEU HA H 1 4.881 0.04 A 550 LEU HB2 H 1 0.866 0.04 A 550 LEU HB3 H 1 1.529 0.04 A 550 LEU HD1% H 1 0.540 0.04 A 550 LEU HD2% H 1 -0.066 0.04 A 550 LEU HG H 1 1.120 0.04 A 550 LEU C C 13 174.669 0.25 A 550 LEU CA C 13 54.216 0.25 A 550 LEU CB C 13 42.954 0.25 A 550 LEU CD1 C 13 24.335 0.25 A 550 LEU CD2 C 13 25.756 0.25 A 550 LEU CG C 13 27.145 0.25 A 550 LEU N N 15 127.359 0.25 A 551 ILE H H 1 8.584 0.04 A 551 ILE HA H 1 5.234 0.04 A 551 ILE HB H 1 1.268 0.04 A 551 ILE HD1% H 1 0.574 0.04 A 551 ILE HG12 H 1 0.910 0.04 A 551 ILE HG13 H 1 1.280 0.04 A 551 ILE HG2% H 1 0.470 0.04 A 551 ILE C C 13 173.709 0.25 A 551 ILE CA C 13 59.720 0.25 A 551 ILE CB C 13 42.210 0.25 A 551 ILE CG1 C 13 28.121 0.25 A 551 ILE CG2 C 13 17.199 0.25 A 551 ILE N N 15 126.177 0.25 A 552 ALA H H 1 9.709 0.04 A 552 ALA HA H 1 5.194 0.04 A 552 ALA HB% H 1 0.776 0.04 A 552 ALA C C 13 175.549 0.25 A 552 ALA CA C 13 49.380 0.25 A 552 ALA CB C 13 23.712 0.25 A 552 ALA N N 15 129.345 0.25 A 553 HIS H H 1 9.151 0.04 A 553 HIS HA H 1 6.162 0.04 A 553 HIS HB2 H 1 2.628 0.04 A 553 HIS HB3 H 1 2.965 0.04 A 553 HIS HD2 H 1 7.500 0.04 A 553 HIS HE1 H 1 6.920 0.04 A 553 HIS HE2 H 1 11.150 0.04 A 553 HIS C C 13 177.121 0.25 A 553 HIS CA C 13 51.965 0.25 A 553 HIS CB C 13 36.593 0.25 A 553 HIS CD2 C 13 119.000 0.25 A 553 HIS CE1 C 13 133.900 0.25 A 553 HIS N N 15 115.303 0.25 A 554 GLN H H 1 8.647 0.04 A 554 GLN HA H 1 4.540 0.04 A 554 GLN HB2 H 1 2.140 0.04 A 554 GLN HB3 H 1 1.690 0.04 A 554 GLN HE21 H 1 6.990 0.04 A 554 GLN HE22 H 1 6.750 0.04 A 554 GLN C C 13 174.320 0.25 A 554 GLN CA C 13 55.976 0.25 A 554 GLN CB C 13 30.828 0.25 A 554 GLN N N 15 124.107 0.25 A 554 GLN NE2 N 15 111.100 0.25 A 555 ALA H H 1 11.550 0.04 A 555 ALA HA H 1 4.617 0.04 A 555 ALA HB% H 1 -0.103 0.04 A 555 ALA C C 13 177.422 0.25 A 555 ALA CA C 13 52.406 0.25 A 555 ALA CB C 13 19.553 0.25 A 555 ALA N N 15 136.582 0.25 A 556 SER H H 1 8.083 0.04 A 556 SER HA H 1 4.044 0.04 A 556 SER HB2 H 1 4.090 0.04 A 556 SER HB3 H 1 4.239 0.04 A 556 SER C C 13 174.912 0.25 A 556 SER CA C 13 61.145 0.25 A 556 SER CB C 13 62.905 0.25 A 556 SER N N 15 111.945 0.25 A 557 GLU H H 1 7.318 0.04 A 557 GLU CA C 13 53.900 0.25 A 557 GLU CB C 13 30.171 0.25 A 557 GLU N N 15 117.238 0.25 A 558 PRO HA H 1 4.194 0.04 A 558 PRO HB2 H 1 1.621 0.04 A 558 PRO HB3 H 1 2.022 0.04 A 558 PRO HG3 H 1 1.950 0.04 A 558 PRO C C 13 174.855 0.25 A 558 PRO CA C 13 62.915 0.25 A 558 PRO CB C 13 32.862 0.25 A 558 PRO CG C 13 28.114 0.25 A 559 ARG H H 1 7.836 0.04 A 559 ARG HA H 1 3.945 0.04 A 559 ARG HB2 H 1 0.518 0.04 A 559 ARG HB3 H 1 0.899 0.04 A 559 ARG HD3 H 1 2.360 0.04 A 559 ARG HE H 1 7.780 0.04 A 559 ARG HG2 H 1 -0.170 0.04 A 559 ARG HH21 H 1 7.110 0.04 A 559 ARG HH22 H 1 6.040 0.04 A 559 ARG C C 13 171.134 0.25 A 559 ARG CA C 13 55.538 0.25 A 559 ARG CB C 13 33.169 0.25 A 559 ARG CD C 13 43.310 0.25 A 559 ARG CG C 13 25.209 0.25 A 559 ARG N N 15 121.957 0.25 A 559 ARG NE N 15 87.310 0.25 A 559 ARG NH2 N 15 70.700 0.25 A 560 GLN H H 1 8.332 0.04 A 560 GLN HA H 1 4.372 0.04 A 560 GLN HB2 H 1 1.702 0.04 A 560 GLN HB3 H 1 1.857 0.04 A 560 GLN HE21 H 1 7.560 0.04 A 560 GLN HE22 H 1 6.870 0.04 A 560 GLN HG2 H 1 2.005 0.04 A 560 GLN HG3 H 1 2.105 0.04 A 560 GLN C C 13 175.848 0.25 A 560 GLN CA C 13 53.622 0.25 A 560 GLN CB C 13 27.811 0.25 A 560 GLN CG C 13 33.614 0.25 A 560 GLN N N 15 126.067 0.25 A 560 GLN NE2 N 15 113.000 0.25 A 561 TRP H H 1 7.982 0.04 A 561 TRP HA H 1 4.522 0.04 A 561 TRP HB2 H 1 2.906 0.04 A 561 TRP HB3 H 1 3.021 0.04 A 561 TRP HD1 H 1 7.250 0.04 A 561 TRP HE3 H 1 7.300 0.04 A 561 TRP HH2 H 1 6.600 0.04 A 561 TRP HZ2 H 1 6.850 0.04 A 561 TRP HZ3 H 1 6.500 0.04 A 561 TRP C C 13 176.141 0.25 A 561 TRP CA C 13 56.337 0.25 A 561 TRP CB C 13 28.840 0.25 A 561 TRP CD1 C 13 128.400 0.25 A 561 TRP CE3 C 13 120.300 0.25 A 561 TRP CH2 C 13 123.000 0.25 A 561 TRP CZ2 C 13 114.300 0.25 A 561 TRP CZ3 C 13 121.000 0.25 A 561 TRP N N 15 133.373 0.25 A 562 GLN H H 1 9.763 0.04 A 562 GLN HA H 1 4.454 0.04 A 562 GLN HB2 H 1 2.460 0.04 A 562 GLN HB3 H 1 1.744 0.04 A 562 GLN HE21 H 1 7.280 0.04 A 562 GLN HE22 H 1 6.910 0.04 A 562 GLN HG2 H 1 2.440 0.04 A 562 GLN HG3 H 1 2.490 0.04 A 562 GLN C C 13 177.088 0.25 A 562 GLN CA C 13 54.676 0.25 A 562 GLN CB C 13 30.526 0.25 A 562 GLN CG C 13 34.000 0.25 A 562 GLN N N 15 124.678 0.25 A 562 GLN NE2 N 15 113.200 0.25 A 563 GLU H H 1 9.210 0.04 A 563 GLU HA H 1 3.907 0.04 A 563 GLU HB3 H 1 2.095 0.04 A 563 GLU HG2 H 1 2.308 0.04 A 563 GLU HG3 H 1 2.397 0.04 A 563 GLU C C 13 178.742 0.25 A 563 GLU CA C 13 61.275 0.25 A 563 GLU CB C 13 29.149 0.25 A 563 GLU CG C 13 36.758 0.25 A 563 GLU N N 15 124.545 0.25 A 564 ILE H H 1 8.496 0.04 A 564 ILE HA H 1 4.208 0.04 A 564 ILE HB H 1 1.889 0.04 A 564 ILE HD1% H 1 0.900 0.04 A 564 ILE HG12 H 1 1.258 0.04 A 564 ILE HG13 H 1 1.512 0.04 A 564 ILE HG2% H 1 0.930 0.04 A 564 ILE C C 13 177.462 0.25 A 564 ILE CA C 13 63.380 0.25 A 564 ILE CB C 13 37.828 0.25 A 564 ILE CD1 C 13 13.986 0.25 A 564 ILE CG1 C 13 28.762 0.25 A 564 ILE CG2 C 13 17.846 0.25 A 564 ILE N N 15 115.275 0.25 A 565 GLU H H 1 6.668 0.04 A 565 GLU HA H 1 4.009 0.04 A 565 GLU HB2 H 1 1.806 0.04 A 565 GLU HB3 H 1 2.744 0.04 A 565 GLU HG3 H 1 2.298 0.04 A 565 GLU C C 13 178.217 0.25 A 565 GLU CA C 13 58.713 0.25 A 565 GLU CB C 13 29.685 0.25 A 565 GLU CG C 13 36.796 0.25 A 565 GLU N N 15 121.174 0.25 A 566 ILE H H 1 8.165 0.04 A 566 ILE HA H 1 3.387 0.04 A 566 ILE HB H 1 1.917 0.04 A 566 ILE HD1% H 1 0.734 0.04 A 566 ILE HG13 H 1 1.700 0.04 A 566 ILE HG2% H 1 0.953 0.04 A 566 ILE C C 13 178.911 0.25 A 566 ILE CA C 13 66.484 0.25 A 566 ILE CB C 13 38.410 0.25 A 566 ILE CD1 C 13 13.702 0.25 A 566 ILE CG1 C 13 29.200 0.25 A 566 ILE CG2 C 13 17.911 0.25 A 566 ILE N N 15 119.747 0.25 A 567 ASP H H 1 8.574 0.04 A 567 ASP HA H 1 4.373 0.04 A 567 ASP HB2 H 1 2.719 0.04 A 567 ASP HB3 H 1 2.838 0.04 A 567 ASP C C 13 179.462 0.25 A 567 ASP CA C 13 57.949 0.25 A 567 ASP CB C 13 40.516 0.25 A 567 ASP N N 15 120.827 0.25 A 568 GLN H H 1 8.321 0.04 A 568 GLN HA H 1 4.140 0.04 A 568 GLN HB2 H 1 2.089 0.04 A 568 GLN HB3 H 1 2.298 0.04 A 568 GLN HE21 H 1 7.240 0.04 A 568 GLN HE22 H 1 6.720 0.04 A 568 GLN HG2 H 1 2.379 0.04 A 568 GLN HG3 H 1 2.832 0.04 A 568 GLN C C 13 179.204 0.25 A 568 GLN CA C 13 59.294 0.25 A 568 GLN CB C 13 29.558 0.25 A 568 GLN CG C 13 35.136 0.25 A 568 GLN N N 15 118.625 0.25 A 568 GLN NE2 N 15 109.600 0.25 A 569 PHE H H 1 8.999 0.04 A 569 PHE HA H 1 4.310 0.04 A 569 PHE HB2 H 1 2.929 0.04 A 569 PHE HB3 H 1 3.197 0.04 A 569 PHE HD1 H 1 6.900 0.04 A 569 PHE HE1 H 1 6.900 0.04 A 569 PHE HZ H 1 6.810 0.04 A 569 PHE C C 13 177.387 0.25 A 569 PHE CA C 13 61.106 0.25 A 569 PHE CB C 13 40.452 0.25 A 569 PHE CD1 C 13 131.400 0.25 A 569 PHE CE1 C 13 131.400 0.25 A 569 PHE CZ C 13 130.700 0.25 A 569 PHE N N 15 124.764 0.25 A 570 SER H H 1 8.979 0.04 A 570 SER HA H 1 4.145 0.04 A 570 SER HB3 H 1 4.046 0.04 A 570 SER C C 13 177.181 0.25 A 570 SER CA C 13 61.933 0.25 A 570 SER CB C 13 63.049 0.25 A 570 SER N N 15 113.882 0.25 A 571 GLU H H 1 8.282 0.04 A 571 GLU HA H 1 4.146 0.04 A 571 GLU HB3 H 1 2.166 0.04 A 571 GLU HG2 H 1 2.150 0.04 A 571 GLU HG3 H 1 2.338 0.04 A 571 GLU C C 13 179.006 0.25 A 571 GLU CA C 13 59.437 0.25 A 571 GLU CB C 13 29.269 0.25 A 571 GLU CG C 13 36.382 0.25 A 571 GLU N N 15 123.710 0.25 A 572 LEU H H 1 7.722 0.04 A 572 LEU HA H 1 4.030 0.04 A 572 LEU HB2 H 1 1.571 0.04 A 572 LEU HB3 H 1 1.839 0.04 A 572 LEU HD1% H 1 0.851 0.04 A 572 LEU HD2% H 1 0.830 0.04 A 572 LEU HG H 1 1.350 0.04 A 572 LEU C C 13 178.204 0.25 A 572 LEU CA C 13 58.186 0.25 A 572 LEU CB C 13 41.303 0.25 A 572 LEU CD1 C 13 25.652 0.25 A 572 LEU CD2 C 13 23.898 0.25 A 572 LEU CG C 13 26.711 0.25 A 572 LEU N N 15 123.115 0.25 A 573 ALA H H 1 7.701 0.04 A 573 ALA HA H 1 3.703 0.04 A 573 ALA HB% H 1 1.296 0.04 A 573 ALA C C 13 180.276 0.25 A 573 ALA CA C 13 55.577 0.25 A 573 ALA CB C 13 19.090 0.25 A 573 ALA N N 15 120.384 0.25 A 574 SER H H 1 8.679 0.04 A 574 SER HA H 1 4.373 0.04 A 574 SER HB2 H 1 4.041 0.04 A 574 SER HB3 H 1 4.069 0.04 A 574 SER C C 13 177.259 0.25 A 574 SER CA C 13 61.851 0.25 A 574 SER CB C 13 62.460 0.25 A 574 SER N N 15 116.150 0.25 A 575 THR H H 1 8.685 0.04 A 575 THR HA H 1 3.985 0.04 A 575 THR HB H 1 4.299 0.04 A 575 THR HG2% H 1 1.199 0.04 A 575 THR C C 13 177.023 0.25 A 575 THR CA C 13 66.859 0.25 A 575 THR CB C 13 68.370 0.25 A 575 THR CG2 C 13 21.800 0.25 A 575 THR N N 15 120.316 0.25 A 576 GLY H H 1 8.565 0.04 A 576 GLY HA2 H 1 3.450 0.04 A 576 GLY HA3 H 1 3.521 0.04 A 576 GLY C C 13 174.096 0.25 A 576 GLY CA C 13 47.730 0.25 A 576 GLY N N 15 107.996 0.25 A 577 SER H H 1 8.425 0.04 A 577 SER HA H 1 3.840 0.04 A 577 SER HB3 H 1 4.260 0.04 A 577 SER CA C 13 63.146 0.25 A 577 SER N N 15 118.026 0.25 A 578 LEU HA H 1 3.700 0.04 A 578 LEU HB2 H 1 0.970 0.04 A 578 LEU HB3 H 1 1.700 0.04 A 578 LEU HD1% H 1 0.420 0.04 A 578 LEU HD2% H 1 0.430 0.04 A 578 LEU HG H 1 1.470 0.04 A 578 LEU C C 13 179.316 0.25 A 578 LEU CA C 13 57.995 0.25 A 578 LEU CB C 13 41.739 0.25 A 578 LEU CD1 C 13 25.900 0.25 A 578 LEU CD2 C 13 23.500 0.25 A 578 LEU CG C 13 27.300 0.25 A 579 VAL H H 1 8.773 0.04 A 579 VAL CB C 13 31.123 0.25 A 579 VAL N N 15 122.330 0.25 A 584 HIS HA H 1 4.332 0.04 A 584 HIS HB2 H 1 3.040 0.04 A 584 HIS HB3 H 1 3.180 0.04 A 584 HIS C C 13 177.320 0.25 A 584 HIS CA C 13 59.034 0.25 A 584 HIS CB C 13 29.981 0.25 A 585 PHE H H 1 8.065 0.04 A 585 PHE HA H 1 4.316 0.04 A 585 PHE HB2 H 1 3.180 0.04 A 585 PHE HB3 H 1 3.199 0.04 A 585 PHE HD1 H 1 7.260 0.04 A 585 PHE C C 13 178.195 0.25 A 585 PHE CA C 13 60.326 0.25 A 585 PHE CB C 13 38.773 0.25 A 585 PHE N N 15 118.557 0.25 A 586 LEU H H 1 8.153 0.04 A 586 LEU HA H 1 4.060 0.04 A 586 LEU HB2 H 1 1.680 0.04 A 586 LEU HB3 H 1 1.810 0.04 A 586 LEU HD2% H 1 0.878 0.04 A 586 LEU HG H 1 1.680 0.04 A 586 LEU C C 13 178.863 0.25 A 586 LEU CA C 13 57.423 0.25 A 586 LEU CB C 13 42.042 0.25 A 586 LEU CD2 C 13 24.817 0.25 A 586 LEU CG C 13 26.847 0.25 A 586 LEU N N 15 121.964 0.25 A 587 GLU H H 1 8.234 0.04 A 587 GLU HA H 1 4.016 0.04 A 587 GLU HB3 H 1 1.998 0.04 A 587 GLU HG2 H 1 2.201 0.04 A 587 GLU HG3 H 1 2.428 0.04 A 587 GLU C C 13 178.330 0.25 A 587 GLU CA C 13 58.475 0.25 A 587 GLU CB C 13 29.825 0.25 A 587 GLU CG C 13 36.718 0.25 A 587 GLU N N 15 119.163 0.25 A 588 GLN H H 1 8.003 0.04 A 588 GLN HA H 1 4.136 0.04 A 588 GLN HB2 H 1 1.984 0.04 A 588 GLN HB3 H 1 2.046 0.04 A 588 GLN HE21 H 1 7.250 0.04 A 588 GLN HE22 H 1 6.820 0.04 A 588 GLN HG3 H 1 2.225 0.04 A 588 GLN C C 13 177.452 0.25 A 588 GLN CA C 13 57.188 0.25 A 588 GLN CB C 13 28.932 0.25 A 588 GLN CG C 13 33.907 0.25 A 588 GLN N N 15 118.390 0.25 A 588 GLN NE2 N 15 112.500 0.25 A 589 THR H H 1 7.957 0.04 A 589 THR HA H 1 4.136 0.04 A 589 THR HB H 1 4.163 0.04 A 589 THR HG2% H 1 1.092 0.04 A 589 THR C C 13 175.620 0.25 A 589 THR CA C 13 63.840 0.25 A 589 THR CB C 13 69.380 0.25 A 589 THR CG2 C 13 21.500 0.25 A 589 THR N N 15 115.070 0.25 A 590 ILE H H 1 7.985 0.04 A 590 ILE HA H 1 3.926 0.04 A 590 ILE HB H 1 1.842 0.04 A 590 ILE HD1% H 1 0.760 0.04 A 590 ILE HG12 H 1 1.120 0.04 A 590 ILE HG13 H 1 1.470 0.04 A 590 ILE HG2% H 1 0.863 0.04 A 590 ILE C C 13 176.914 0.25 A 590 ILE CA C 13 62.663 0.25 A 590 ILE CB C 13 38.222 0.25 A 590 ILE CD1 C 13 12.900 0.25 A 590 ILE CG1 C 13 28.029 0.25 A 590 ILE CG2 C 13 17.370 0.25 A 590 ILE N N 15 122.655 0.25 A 591 ALA H H 1 8.086 0.04 A 591 ALA HA H 1 4.181 0.04 A 591 ALA HB% H 1 1.387 0.04 A 591 ALA C C 13 178.466 0.25 A 591 ALA CA C 13 53.502 0.25 A 591 ALA CB C 13 18.788 0.25 A 591 ALA N N 15 125.105 0.25 A 592 SER H H 1 7.957 0.04 A 592 SER HA H 1 4.298 0.04 A 592 SER HB2 H 1 3.790 0.04 A 592 SER HB3 H 1 3.840 0.04 A 592 SER C C 13 174.886 0.25 A 592 SER CA C 13 58.939 0.25 A 592 SER CB C 13 63.738 0.25 A 592 SER N N 15 113.591 0.25 A 593 LEU H H 1 7.905 0.04 A 593 LEU CA C 13 55.720 0.25 A 593 LEU CB C 13 42.107 0.25 A 593 LEU N N 15 122.972 0.25 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 save_