| Chain sequence(s) |
A: FNFGIGYGTESGVSFQAGVQQDNWLGTGYAVGINGTKNDYQTYAELSVTNPYFTVDGVSLGGRLFYNDFQADDADLSDYTNKSYGTDVTLGFPINEYNSLRAGLGYVHNSLSNMQPQVAMWRYLYSMGEHPSTSDQDNSFKTDDFTFNYGWTYNKLDRGYFPTDGSRVNLTGKVTIPGSDNEYYKVTLDTATYVPIDDDHKWVVLGRTRWGYGDGLGGKEMPFYENFYAGGSSTVRGFQSNTIGPKAVYFPHQAKDLSKSDDAVGGNAMAVASLEFITPTPFISDKYANSVRTSFFWDMGTVWDTNWDSSQYSGYPDYSDPSNIRMSAGIALQWMSPLGPLVFSYAQPFKKYDGDKAEQFQFNIGKTW
B: GPSQVQLVESGGGLVQAGGSLRLSCAASGRTFSRYAMAWFRRAPGKEREFVAAISASAGTIFYTDSVKGRFTISRDHAKNTVSLQMNSLRPEDTAVYYCAAKTGTWATLDRRYDYWGQGTRVTVSA input PDB |
| Selected Chain(s) | A,B |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:03)
[INFO] Main: Simulation completed successfully. (00:05:07)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 426 | F | A | 1.8539 | |
| 427 | N | A | 0.2950 | |
| 428 | F | A | 1.1895 | |
| 429 | G | A | 0.6258 | |
| 430 | I | A | 1.4664 | |
| 431 | G | A | 1.0042 | |
| 432 | Y | A | 1.6146 | |
| 433 | G | A | 0.0000 | |
| 434 | T | A | 0.3617 | |
| 435 | E | A | -0.5876 | |
| 436 | S | A | -0.7500 | |
| 437 | G | A | -0.2179 | |
| 438 | V | A | 0.7922 | |
| 439 | S | A | 0.4770 | |
| 440 | F | A | 0.8073 | |
| 441 | Q | A | -0.1504 | |
| 442 | A | A | 0.5984 | |
| 443 | G | A | 0.6735 | |
| 444 | V | A | 0.7306 | |
| 445 | Q | A | -1.2575 | |
| 446 | Q | A | -1.9785 | |
| 447 | D | A | -2.5995 | |
| 448 | N | A | -1.6542 | |
| 449 | W | A | -0.1319 | |
| 450 | L | A | 0.9580 | |
| 451 | G | A | -0.1652 | |
| 452 | T | A | -0.1022 | |
| 453 | G | A | -0.2121 | |
| 454 | Y | A | 0.3221 | |
| 455 | A | A | -0.8069 | |
| 456 | V | A | -0.0107 | |
| 457 | G | A | 0.2344 | |
| 458 | I | A | 1.8596 | |
| 459 | N | A | 0.5016 | |
| 460 | G | A | 0.1414 | |
| 461 | T | A | -0.5581 | |
| 462 | K | A | -1.3206 | |
| 463 | N | A | -1.3043 | |
| 464 | D | A | -2.0344 | |
| 465 | Y | A | -1.4884 | |
| 466 | Q | A | -1.4120 | |
| 467 | T | A | -0.9476 | |
| 468 | Y | A | -0.1135 | |
| 469 | A | A | 0.6255 | |
| 470 | E | A | 1.1188 | |
| 471 | L | A | 1.7221 | |
| 472 | S | A | 0.9860 | |
| 473 | V | A | 1.2995 | |
| 474 | T | A | 0.5962 | |
| 475 | N | A | 0.9989 | |
| 476 | P | A | 1.0727 | |
| 477 | Y | A | 2.1908 | |
| 478 | F | A | 2.2008 | |
| 479 | T | A | 1.3202 | |
| 480 | V | A | 1.4669 | |
| 481 | D | A | -0.5922 | |
| 482 | G | A | 0.3785 | |
| 483 | V | A | 0.0000 | |
| 484 | S | A | 0.9826 | |
| 485 | L | A | 1.4753 | |
| 486 | G | A | 0.6868 | |
| 487 | G | A | 0.6648 | |
| 488 | R | A | 0.6232 | |
| 489 | L | A | 2.0802 | |
| 490 | F | A | 1.7533 | |
| 491 | Y | A | 1.5501 | |
| 492 | N | A | -0.0553 | |
| 493 | D | A | -0.7863 | |
| 494 | F | A | -0.8664 | |
| 495 | Q | A | -1.1629 | |
| 496 | A | A | 0.0000 | |
| 497 | D | A | 0.0000 | |
| 498 | D | A | -1.7968 | |
| 499 | A | A | 0.0000 | |
| 500 | D | A | -1.7547 | |
| 501 | L | A | 0.0000 | |
| 502 | S | A | 0.0000 | |
| 503 | D | A | 0.0000 | |
| 504 | Y | A | 0.0000 | |
| 505 | T | A | 0.0000 | |
| 506 | N | A | -1.1621 | |
| 507 | K | A | -1.6921 | |
| 508 | S | A | 0.0000 | |
| 509 | Y | A | 1.4644 | |
| 510 | G | A | 0.0000 | |
| 511 | T | A | 1.1576 | |
| 512 | D | A | 0.7344 | |
| 513 | V | A | 1.2810 | |
| 514 | T | A | 0.8079 | |
| 515 | L | A | 0.9855 | |
| 516 | G | A | 0.8014 | |
| 517 | F | A | 0.8130 | |
| 518 | P | A | 0.1699 | |
| 519 | I | A | 1.1923 | |
| 520 | N | A | -1.0488 | |
| 521 | E | A | -2.1279 | |
| 522 | Y | A | -1.1811 | |
| 523 | N | A | -0.2745 | |
| 524 | S | A | 0.3538 | |
| 525 | L | A | 1.2134 | |
| 526 | R | A | 0.2425 | |
| 527 | A | A | 0.9220 | |
| 528 | G | A | 0.9863 | |
| 529 | L | A | 1.7864 | |
| 530 | G | A | 0.0000 | |
| 531 | Y | A | 1.3667 | |
| 532 | V | A | 0.9902 | |
| 533 | H | A | -0.3803 | |
| 534 | N | A | 0.0000 | |
| 535 | S | A | -1.4239 | |
| 536 | L | A | 0.0000 | |
| 537 | S | A | -1.0629 | |
| 538 | N | A | 0.0000 | |
| 539 | M | A | 0.0000 | |
| 540 | Q | A | 0.0000 | |
| 541 | P | A | 0.0000 | |
| 542 | Q | A | 0.0000 | |
| 543 | V | A | 0.0000 | |
| 544 | A | A | -0.1570 | |
| 545 | M | A | 0.0000 | |
| 546 | W | A | 0.0000 | |
| 547 | R | A | -0.4669 | |
| 548 | Y | A | 0.0000 | |
| 549 | L | A | 0.0000 | |
| 550 | Y | A | -0.0673 | |
| 551 | S | A | -0.4450 | |
| 552 | M | A | -0.7140 | |
| 553 | G | A | -0.8794 | |
| 554 | E | A | -1.4406 | |
| 555 | H | A | -1.4444 | |
| 556 | P | A | -1.2309 | |
| 557 | S | A | -1.1137 | |
| 558 | T | A | -0.7871 | |
| 559 | S | A | -1.2967 | |
| 560 | D | A | -1.9854 | |
| 561 | Q | A | 0.0000 | |
| 562 | D | A | -1.9929 | |
| 563 | N | A | -1.3454 | |
| 564 | S | A | -1.0398 | |
| 565 | F | A | 0.0000 | |
| 566 | K | A | -2.3208 | |
| 567 | T | A | 0.0000 | |
| 568 | D | A | -1.2513 | |
| 569 | D | A | 0.0000 | |
| 570 | F | A | 1.3444 | |
| 571 | T | A | 0.0000 | |
| 572 | F | A | 2.6902 | |
| 573 | N | A | 1.2737 | |
| 574 | Y | A | 1.2399 | |
| 575 | G | A | 0.0000 | |
| 576 | W | A | 0.7242 | |
| 577 | T | A | 0.0457 | |
| 578 | Y | A | -0.6868 | |
| 579 | N | A | -2.0195 | |
| 580 | K | A | -2.6046 | |
| 581 | L | A | -2.1597 | |
| 582 | D | A | -2.8202 | |
| 583 | R | A | -2.3869 | |
| 584 | G | A | -1.0539 | |
| 585 | Y | A | 0.3554 | |
| 586 | F | A | 0.0000 | |
| 587 | P | A | 0.0000 | |
| 588 | T | A | 0.0000 | |
| 589 | D | A | -0.9694 | |
| 590 | G | A | -1.4095 | |
| 591 | S | A | -1.2759 | |
| 592 | R | A | -1.7238 | |
| 593 | V | A | -0.8528 | |
| 594 | N | A | -0.4432 | |
| 595 | L | A | 0.5766 | |
| 596 | T | A | 0.2915 | |
| 597 | G | A | 0.0000 | |
| 598 | K | A | 1.0178 | |
| 599 | V | A | 1.4484 | |
| 600 | T | A | 0.0000 | |
| 601 | I | A | 0.8968 | |
| 602 | P | A | -0.3528 | |
| 603 | G | A | -0.7549 | |
| 604 | S | A | -0.7218 | |
| 605 | D | A | -1.5950 | |
| 606 | N | A | 0.0000 | |
| 607 | E | A | -0.8599 | |
| 608 | Y | A | 0.0000 | |
| 609 | Y | A | 0.7368 | |
| 610 | K | A | 0.0918 | |
| 611 | V | A | 0.6770 | |
| 612 | T | A | 0.3855 | |
| 613 | L | A | 0.5309 | |
| 614 | D | A | -0.4596 | |
| 615 | T | A | -0.7024 | |
| 616 | A | A | -0.8260 | |
| 617 | T | A | -0.1764 | |
| 618 | Y | A | 0.4838 | |
| 619 | V | A | 1.7910 | |
| 620 | P | A | 0.5664 | |
| 621 | I | A | 1.3660 | |
| 622 | D | A | -0.9955 | |
| 623 | D | A | -2.6557 | |
| 624 | D | A | -2.9894 | |
| 625 | H | A | -1.8144 | |
| 626 | K | A | -2.0734 | |
| 627 | W | A | 0.3695 | |
| 628 | V | A | 0.0000 | |
| 629 | V | A | 1.8850 | |
| 630 | L | A | 0.8063 | |
| 631 | G | A | 0.3595 | |
| 632 | R | A | -0.6372 | |
| 633 | T | A | -0.3163 | |
| 634 | R | A | -0.3848 | |
| 635 | W | A | 0.5795 | |
| 636 | G | A | 0.0000 | |
| 637 | Y | A | 0.6413 | |
| 638 | G | A | 0.0000 | |
| 639 | D | A | -0.3122 | |
| 640 | G | A | -0.5193 | |
| 641 | L | A | -0.2053 | |
| 642 | G | A | -0.7064 | |
| 643 | G | A | -0.8602 | |
| 644 | K | A | -0.9860 | |
| 645 | E | A | -0.6786 | |
| 646 | M | A | 0.0000 | |
| 647 | P | A | 0.0000 | |
| 648 | F | A | 0.0000 | |
| 649 | Y | A | -0.0543 | |
| 650 | E | A | -0.3577 | |
| 651 | N | A | -0.1780 | |
| 652 | F | A | 0.0000 | |
| 653 | Y | A | 0.2497 | |
| 654 | A | A | 0.0000 | |
| 655 | G | A | 0.0000 | |
| 656 | G | A | 0.0000 | |
| 657 | S | A | -0.0608 | |
| 658 | S | A | -0.3227 | |
| 659 | T | A | -0.2699 | |
| 660 | V | A | 0.0000 | |
| 661 | R | A | 0.1663 | |
| 662 | G | A | 0.0000 | |
| 663 | F | A | 0.0000 | |
| 664 | Q | A | -0.7181 | |
| 665 | S | A | -0.7336 | |
| 666 | N | A | -0.5344 | |
| 667 | T | A | 0.0000 | |
| 668 | I | A | 0.0000 | |
| 669 | G | A | 0.0000 | |
| 670 | P | A | 0.0000 | |
| 671 | K | A | 0.0000 | |
| 672 | A | A | 0.0000 | |
| 673 | V | A | 0.0000 | |
| 674 | Y | A | 0.0000 | |
| 675 | F | A | -0.7392 | |
| 676 | P | A | -1.1844 | |
| 677 | H | A | -1.2205 | |
| 678 | Q | A | -1.5898 | |
| 679 | A | A | -0.9245 | |
| 697 | K | A | -2.4661 | |
| 698 | D | A | -2.4731 | |
| 699 | L | A | -1.2502 | |
| 700 | S | A | -0.6089 | |
| 701 | K | A | -1.0972 | |
| 702 | S | A | 0.0000 | |
| 703 | D | A | -1.2455 | |
| 704 | D | A | 0.0000 | |
| 705 | A | A | 0.0000 | |
| 706 | V | A | -0.0377 | |
| 707 | G | A | 0.0000 | |
| 708 | G | A | 0.0000 | |
| 709 | N | A | 0.0000 | |
| 710 | A | A | 0.0000 | |
| 711 | M | A | 0.0000 | |
| 712 | A | A | 0.3577 | |
| 713 | V | A | 0.0000 | |
| 714 | A | A | 0.0737 | |
| 715 | S | A | 0.0000 | |
| 716 | L | A | 1.2744 | |
| 717 | E | A | 0.0000 | |
| 718 | F | A | 1.9970 | |
| 719 | I | A | 0.0000 | |
| 720 | T | A | 0.1575 | |
| 721 | P | A | -0.3426 | |
| 722 | T | A | 0.0000 | |
| 723 | P | A | 0.7788 | |
| 724 | F | A | 1.7608 | |
| 725 | I | A | 0.6588 | |
| 726 | S | A | -0.6818 | |
| 727 | D | A | -1.9009 | |
| 728 | K | A | -2.0787 | |
| 729 | Y | A | -0.3880 | |
| 730 | A | A | -0.8143 | |
| 731 | N | A | -1.2737 | |
| 732 | S | A | -0.1420 | |
| 733 | V | A | 0.0000 | |
| 734 | R | A | -0.5006 | |
| 735 | T | A | 0.0000 | |
| 736 | S | A | 0.0000 | |
| 737 | F | A | 2.1959 | |
| 738 | F | A | 0.0000 | |
| 739 | W | A | 1.2973 | |
| 740 | D | A | 0.0000 | |
| 741 | M | A | 0.4931 | |
| 742 | G | A | 0.0000 | |
| 743 | T | A | 0.0000 | |
| 744 | V | A | 0.0000 | |
| 745 | W | A | -0.4041 | |
| 746 | D | A | 0.0000 | |
| 747 | T | A | -0.6714 | |
| 748 | N | A | -0.8335 | |
| 749 | W | A | 0.0000 | |
| 750 | D | A | -1.6163 | |
| 751 | S | A | -1.5660 | |
| 752 | S | A | -1.3029 | |
| 753 | Q | A | -1.5581 | |
| 754 | Y | A | -1.1963 | |
| 755 | S | A | -1.0306 | |
| 756 | G | A | -0.8714 | |
| 757 | Y | A | -0.7057 | |
| 758 | P | A | -1.1765 | |
| 759 | D | A | -1.7996 | |
| 760 | Y | A | -1.0665 | |
| 761 | S | A | -1.2418 | |
| 762 | D | A | -1.4933 | |
| 763 | P | A | -0.8630 | |
| 764 | S | A | -0.5989 | |
| 765 | N | A | -0.9334 | |
| 766 | I | A | 0.0422 | |
| 767 | R | A | 0.0000 | |
| 768 | M | A | -0.1144 | |
| 769 | S | A | 0.0000 | |
| 770 | A | A | 0.6275 | |
| 771 | G | A | 1.1526 | |
| 772 | I | A | 2.3510 | |
| 773 | A | A | 1.7485 | |
| 774 | L | A | 1.2239 | |
| 775 | Q | A | 0.4483 | |
| 776 | W | A | 0.4771 | |
| 777 | M | A | 0.5136 | |
| 778 | S | A | 0.4868 | |
| 779 | P | A | 0.3393 | |
| 780 | L | A | 1.0151 | |
| 781 | G | A | 0.2915 | |
| 782 | P | A | 0.1965 | |
| 783 | L | A | 0.8502 | |
| 784 | V | A | 1.1251 | |
| 785 | F | A | 1.9939 | |
| 786 | S | A | 0.0000 | |
| 787 | Y | A | 2.2815 | |
| 788 | A | A | 0.0000 | |
| 789 | Q | A | -0.5431 | |
| 790 | P | A | -0.9245 | |
| 791 | F | A | -0.1472 | |
| 792 | K | A | -1.5336 | |
| 793 | K | A | -1.9262 | |
| 794 | Y | A | -1.5332 | |
| 795 | D | A | -2.1578 | |
| 796 | G | A | -1.6959 | |
| 797 | D | A | 0.0000 | |
| 798 | K | A | -1.6441 | |
| 799 | A | A | -0.9036 | |
| 800 | E | A | -0.2065 | |
| 801 | Q | A | 0.2725 | |
| 802 | F | A | 2.2172 | |
| 803 | Q | A | 0.0000 | |
| 804 | F | A | 1.3610 | |
| 805 | N | A | 0.3904 | |
| 806 | I | A | 1.1074 | |
| 807 | G | A | 0.4594 | |
| 808 | K | A | -0.0040 | |
| 809 | T | A | 0.2465 | |
| 810 | W | A | 1.2091 | |
| -1 | G | B | -1.1488 | |
| 0 | P | B | -1.3438 | |
| 1 | S | B | -1.1003 | |
| 2 | Q | B | -1.6704 | |
| 3 | V | B | -1.1211 | |
| 4 | Q | B | -0.9883 | |
| 5 | L | B | 0.0000 | |
| 6 | V | B | 0.4329 | |
| 7 | E | B | -0.4457 | |
| 8 | S | B | -0.8299 | |
| 9 | G | B | -1.4563 | |
| 10 | G | B | -1.0123 | |
| 11 | G | B | -0.2450 | |
| 12 | L | B | 0.9782 | |
| 13 | V | B | -0.0395 | |
| 14 | Q | B | -1.2960 | |
| 15 | A | B | -1.6803 | |
| 16 | G | B | -1.6034 | |
| 17 | G | B | -1.1060 | |
| 18 | S | B | -1.3066 | |
| 19 | L | B | -1.1076 | |
| 20 | R | B | -2.2626 | |
| 21 | L | B | 0.0000 | |
| 22 | S | B | -0.8565 | |
| 23 | C | B | 0.0000 | |
| 24 | A | B | -0.3669 | |
| 25 | A | B | -0.5850 | |
| 26 | S | B | -1.0589 | |
| 27 | G | B | -1.6104 | |
| 28 | R | B | -2.0551 | |
| 29 | T | B | -0.8269 | |
| 30 | F | B | 0.7641 | |
| 31 | S | B | -0.4954 | |
| 32 | R | B | -1.7987 | |
| 33 | Y | B | 0.0000 | |
| 34 | A | B | 0.0000 | |
| 35 | M | B | 0.0000 | |
| 36 | A | B | 0.0000 | |
| 37 | W | B | 0.0000 | |
| 38 | F | B | 0.0000 | |
| 39 | R | B | 0.0000 | |
| 40 | R | B | -2.2460 | |
| 41 | A | B | -2.1727 | |
| 42 | P | B | -1.5606 | |
| 43 | G | B | -2.0032 | |
| 44 | K | B | -3.2565 | |
| 45 | E | B | -3.4113 | |
| 46 | R | B | -2.4090 | |
| 47 | E | B | -1.7059 | |
| 48 | F | B | 0.0000 | |
| 49 | V | B | 0.0000 | |
| 50 | A | B | 0.0000 | |
| 51 | A | B | 0.0000 | |
| 52 | I | B | 0.0000 | |
| 53 | S | B | 0.0000 | |
| 54 | A | B | -0.9217 | |
| 55 | S | B | -0.8363 | |
| 56 | A | B | -0.3489 | |
| 57 | G | B | -0.8561 | |
| 58 | T | B | 0.0000 | |
| 59 | I | B | 0.6367 | |
| 60 | F | B | 0.0000 | |
| 61 | Y | B | -0.3833 | |
| 62 | T | B | 0.0000 | |
| 63 | D | B | -1.4389 | |
| 64 | S | B | -1.2952 | |
| 65 | V | B | 0.0000 | |
| 66 | K | B | -1.6760 | |
| 67 | G | B | -1.4392 | |
| 68 | R | B | -1.4606 | |
| 69 | F | B | 0.0000 | |
| 70 | T | B | -0.7504 | |
| 71 | I | B | 0.0000 | |
| 72 | S | B | -0.6147 | |
| 73 | R | B | -1.4802 | |
| 74 | D | B | -2.2250 | |
| 75 | H | B | -2.0460 | |
| 76 | A | B | -1.7431 | |
| 77 | K | B | -2.5079 | |
| 78 | N | B | 0.0000 | |
| 79 | T | B | -1.1239 | |
| 80 | V | B | 0.0000 | |
| 81 | S | B | -1.0395 | |
| 82 | L | B | 0.0000 | |
| 83 | Q | B | -1.3681 | |
| 84 | M | B | 0.0000 | |
| 85 | N | B | -2.0121 | |
| 86 | S | B | -1.6155 | |
| 87 | L | B | 0.0000 | |
| 88 | R | B | -2.9621 | |
| 89 | P | B | -2.0991 | |
| 90 | E | B | -2.5315 | |
| 91 | D | B | 0.0000 | |
| 92 | T | B | -1.1431 | |
| 93 | A | B | 0.0000 | |
| 94 | V | B | -0.6419 | |
| 95 | Y | B | 0.0000 | |
| 96 | Y | B | -0.3852 | |
| 97 | C | B | 0.0000 | |
| 98 | A | B | 0.0000 | |
| 99 | A | B | 0.0000 | |
| 100 | K | B | 0.0000 | |
| 101 | T | B | -1.2091 | |
| 102 | G | B | -1.1882 | |
| 103 | T | B | 0.0000 | |
| 104 | W | B | 0.0000 | |
| 105 | A | B | 0.0000 | |
| 106 | T | B | 0.0000 | |
| 107 | L | B | -1.3508 | |
| 108 | D | B | -1.9061 | |
| 109 | R | B | -2.5284 | |
| 110 | R | B | -1.6893 | |
| 111 | Y | B | 0.0000 | |
| 112 | D | B | -2.0521 | |
| 113 | Y | B | -0.9486 | |
| 114 | W | B | -0.2839 | |
| 115 | G | B | -0.2901 | |
| 116 | Q | B | -1.0121 | |
| 117 | G | B | -0.8634 | |
| 118 | T | B | -1.1246 | |
| 119 | R | B | -1.6380 | |
| 120 | V | B | 0.0000 | |
| 121 | T | B | -0.4746 | |
| 122 | V | B | 0.0000 | |
| 123 | S | B | -0.8230 | |
| 124 | A | B | -0.9056 |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine