Chain sequence(s) |
A: SSALIKAQELHALTHVNAAGLKNKFDVTWKQAKDIVQHCTQCQVLHLPTQEAGVNPRGLCPNALWQMDVTHVPSFGRLSYVHVTVDTYSHFIWATCQTGESTSHVKKHLLSCFAVMGVPEKIKTDNGPGYCSKAFQKFLSQWKISHTTGIPYNSQGQAIVERTNRTLKTQLVKQKEGGDSKECTTPQMQLNLALYTLNFLNIYRNQTTTSAEQHLTGKKNSPHEGKLIWWKDNKNKTWEIGKVITWGRGFACVSPGENQLPVWIPTRHLKFYNEPI
input PDB |
Selected Chain(s) | A |
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] (00:00:01) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:00:01) [INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01) [INFO] runJob: Creating pdb object from: input.pdb (00:00:01) [INFO] FoldX: Starting FoldX energy minimalization (00:00:01) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:03:08) [INFO] Main: Simulation completed successfully. (00:03:10) |
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 | |
586 | S | A | -0.2707 | |
587 | S | A | -0.2932 | |
588 | A | A | -0.7280 | |
589 | L | A | -0.4536 | |
590 | I | A | 0.1733 | |
591 | K | A | -1.9472 | |
592 | A | A | 0.0000 | |
593 | Q | A | -1.2868 | |
594 | E | A | -1.7852 | |
595 | L | A | -0.6564 | |
596 | H | A | 0.0000 | |
597 | A | A | -0.4659 | |
598 | L | A | 0.7139 | |
599 | T | A | 0.0000 | |
600 | H | A | 0.0000 | |
601 | V | A | 0.0000 | |
602 | N | A | -0.4821 | |
603 | A | A | -1.2138 | |
604 | A | A | -1.2534 | |
605 | G | A | 0.0000 | |
606 | L | A | 0.0000 | |
607 | K | A | -2.3720 | |
608 | N | A | -2.2527 | |
609 | K | A | -2.1476 | |
610 | F | A | -1.7975 | |
611 | D | A | -2.4377 | |
612 | V | A | 0.0000 | |
613 | T | A | -1.2049 | |
614 | W | A | -0.9017 | |
615 | K | A | -2.0152 | |
616 | Q | A | -1.9482 | |
617 | A | A | 0.0000 | |
618 | K | A | -2.0299 | |
619 | D | A | -2.0248 | |
620 | I | A | 0.0000 | |
621 | V | A | -1.4261 | |
622 | Q | A | -2.0924 | |
623 | H | A | -1.9314 | |
624 | C | A | -1.0021 | |
625 | T | A | -0.5522 | |
626 | Q | A | -0.6134 | |
627 | C | A | -0.4095 | |
628 | Q | A | -0.9389 | |
629 | V | A | 1.1218 | |
630 | L | A | 0.9816 | |
631 | H | A | 0.1510 | |
632 | L | A | 0.8686 | |
633 | P | A | -0.5000 | |
634 | T | A | -0.9750 | |
635 | Q | A | -2.2671 | |
636 | E | A | -2.7691 | |
637 | A | A | -1.7082 | |
638 | G | A | -1.1886 | |
639 | V | A | -0.2805 | |
640 | N | A | 0.0000 | |
641 | P | A | -0.0797 | |
642 | R | A | 0.0002 | |
643 | G | A | 0.0000 | |
644 | L | A | 0.8966 | |
645 | C | A | 0.5391 | |
646 | P | A | 0.2107 | |
647 | N | A | -0.4109 | |
648 | A | A | -0.5218 | |
649 | L | A | -0.7502 | |
650 | W | A | 0.0000 | |
651 | Q | A | 0.0000 | |
652 | M | A | 0.0000 | |
653 | D | A | -0.6511 | |
654 | V | A | -0.3818 | |
655 | T | A | 0.0000 | |
656 | H | A | -0.8766 | |
657 | V | A | 0.0000 | |
658 | P | A | -0.8889 | |
659 | S | A | -0.9741 | |
660 | F | A | 0.0000 | |
661 | G | A | -1.4455 | |
662 | R | A | -1.9412 | |
663 | L | A | -0.8575 | |
664 | S | A | -0.7885 | |
665 | Y | A | -0.3659 | |
666 | V | A | 0.0000 | |
667 | H | A | 0.0000 | |
668 | V | A | 0.0000 | |
669 | T | A | 0.0000 | |
670 | V | A | 0.0000 | |
671 | D | A | 0.0000 | |
672 | T | A | 0.0000 | |
673 | Y | A | 0.2320 | |
674 | S | A | 0.0000 | |
675 | H | A | -0.0676 | |
676 | F | A | 0.0000 | |
677 | I | A | 0.0000 | |
678 | W | A | 0.2524 | |
679 | A | A | 0.0000 | |
680 | T | A | 0.0000 | |
681 | C | A | 0.0000 | |
682 | Q | A | 0.0000 | |
683 | T | A | -0.6839 | |
684 | G | A | -0.7731 | |
685 | E | A | -1.0403 | |
686 | S | A | -0.8909 | |
687 | T | A | -1.0236 | |
688 | S | A | -1.0830 | |
689 | H | A | -1.2820 | |
690 | V | A | 0.0000 | |
691 | K | A | -1.0295 | |
692 | K | A | -1.6640 | |
693 | H | A | 0.0000 | |
694 | L | A | 0.0000 | |
695 | L | A | 0.6507 | |
696 | S | A | 0.1991 | |
697 | C | A | 0.0000 | |
698 | F | A | 1.0368 | |
699 | A | A | 0.7489 | |
700 | V | A | 0.8346 | |
701 | M | A | 0.0000 | |
702 | G | A | 0.7817 | |
703 | V | A | 0.4787 | |
704 | P | A | 0.0000 | |
705 | E | A | -2.4454 | |
706 | K | A | -2.1666 | |
707 | I | A | 0.0000 | |
708 | K | A | -0.9658 | |
709 | T | A | 0.0000 | |
710 | D | A | -1.1791 | |
711 | N | A | -1.1205 | |
712 | G | A | -0.9659 | |
713 | P | A | -0.6443 | |
714 | G | A | 0.0000 | |
715 | Y | A | 0.0000 | |
716 | C | A | -0.4974 | |
717 | S | A | -1.1747 | |
718 | K | A | -2.2049 | |
719 | A | A | -1.4609 | |
720 | F | A | 0.0000 | |
721 | Q | A | -2.0620 | |
722 | K | A | -2.7901 | |
723 | F | A | -1.6575 | |
724 | L | A | 0.0000 | |
725 | S | A | -1.9699 | |
726 | Q | A | -2.0033 | |
727 | W | A | -1.1661 | |
728 | K | A | -2.4744 | |
729 | I | A | 0.0000 | |
730 | S | A | -1.6424 | |
731 | H | A | -1.1728 | |
732 | T | A | -0.4842 | |
733 | T | A | -0.2689 | |
734 | G | A | 0.0178 | |
735 | I | A | 1.4635 | |
736 | P | A | 0.7487 | |
737 | Y | A | 1.0998 | |
738 | N | A | -0.1088 | |
739 | S | A | -0.7112 | |
740 | Q | A | -1.4463 | |
741 | G | A | -0.6997 | |
742 | Q | A | -1.0061 | |
743 | A | A | -1.0202 | |
744 | I | A | 0.0000 | |
745 | V | A | 0.0000 | |
746 | E | A | -1.2781 | |
747 | R | A | -1.5923 | |
748 | T | A | 0.0000 | |
749 | N | A | 0.0000 | |
750 | R | A | -2.1690 | |
751 | T | A | -0.9041 | |
752 | L | A | 0.0000 | |
753 | K | A | -0.9560 | |
754 | T | A | -0.1387 | |
755 | Q | A | 0.0000 | |
756 | L | A | 0.0000 | |
757 | V | A | 0.3813 | |
758 | K | A | -0.4721 | |
759 | Q | A | -0.9913 | |
760 | K | A | -2.3525 | |
761 | E | A | -2.8488 | |
762 | G | A | -1.8645 | |
763 | G | A | -2.0467 | |
764 | D | A | -2.8844 | |
765 | S | A | -2.6806 | |
766 | K | A | -3.2499 | |
767 | E | A | -2.8847 | |
768 | C | A | -1.8216 | |
769 | T | A | -1.2386 | |
770 | T | A | -0.4502 | |
771 | P | A | -0.5488 | |
772 | Q | A | -0.4089 | |
773 | M | A | -0.3922 | |
774 | Q | A | -0.7329 | |
775 | L | A | 0.0000 | |
776 | N | A | -0.5436 | |
777 | L | A | 0.1769 | |
778 | A | A | 0.0000 | |
779 | L | A | 0.0000 | |
780 | Y | A | 0.8048 | |
781 | T | A | 0.0000 | |
782 | L | A | 0.0000 | |
783 | N | A | 0.0000 | |
784 | F | A | 1.0358 | |
785 | L | A | 0.0000 | |
786 | N | A | 0.0000 | |
787 | I | A | 0.0000 | |
788 | Y | A | -0.8613 | |
789 | R | A | -2.5044 | |
790 | N | A | -2.5872 | |
791 | Q | A | -1.6020 | |
792 | T | A | -1.1919 | |
793 | T | A | -0.9580 | |
794 | T | A | 0.0000 | |
795 | S | A | 0.0000 | |
796 | A | A | 0.0000 | |
797 | E | A | -0.7821 | |
798 | Q | A | 0.0000 | |
799 | H | A | 0.0000 | |
800 | L | A | 0.8199 | |
801 | T | A | -0.2889 | |
802 | G | A | -0.6069 | |
803 | K | A | -2.0399 | |
804 | K | A | -1.9496 | |
805 | N | A | -1.9933 | |
806 | S | A | -1.6852 | |
807 | P | A | -1.5411 | |
808 | H | A | -1.7023 | |
809 | E | A | -2.7301 | |
810 | G | A | -2.1725 | |
811 | K | A | -1.9997 | |
812 | L | A | -0.8850 | |
813 | I | A | 0.0000 | |
814 | W | A | 0.1116 | |
815 | W | A | 0.0000 | |
816 | K | A | -2.0884 | |
817 | D | A | -2.5151 | |
818 | N | A | -3.0698 | |
819 | K | A | -3.5077 | |
820 | N | A | -3.3886 | |
821 | K | A | -3.4030 | |
822 | T | A | -1.9144 | |
823 | W | A | -0.9084 | |
824 | E | A | -0.7080 | |
825 | I | A | 0.2603 | |
826 | G | A | 0.0000 | |
827 | K | A | -2.2353 | |
828 | V | A | 0.0000 | |
829 | I | A | -0.6727 | |
830 | T | A | -0.8005 | |
831 | W | A | -0.6699 | |
832 | G | A | -1.2322 | |
833 | R | A | -2.4874 | |
834 | G | A | -1.5652 | |
835 | F | A | -0.5588 | |
836 | A | A | 0.0000 | |
837 | C | A | 0.0000 | |
838 | V | A | 0.0000 | |
839 | S | A | -0.8411 | |
840 | P | A | -1.0242 | |
841 | G | A | -1.9562 | |
842 | E | A | -2.9075 | |
843 | N | A | -2.4399 | |
844 | Q | A | -1.6392 | |
845 | L | A | 0.4720 | |
846 | P | A | 0.1981 | |
847 | V | A | 0.6619 | |
848 | W | A | 0.6068 | |
849 | I | A | 0.0000 | |
850 | P | A | -0.7698 | |
851 | T | A | -1.4301 | |
852 | R | A | -2.2198 | |
853 | H | A | -1.5822 | |
854 | L | A | 0.0000 | |
855 | K | A | -0.8687 | |
856 | F | A | 0.7627 | |
857 | Y | A | -0.2062 | |
858 | N | A | -1.4759 | |
859 | E | A | -1.6891 | |
860 | P | A | -0.4251 | |
861 | I | A | 1.2287 |