| Chain sequence(s) |
A: EAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLPQPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDDEEDMDDVVDADEYLIPQ
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 (00:06:08)
[INFO] Main: Simulation completed successfully. (00:06:10)
|
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 | |
| 697 | E | A | -2.2434 | |
| 698 | A | A | -1.3167 | |
| 699 | P | A | -1.4125 | |
| 700 | N | A | -1.5586 | |
| 701 | Q | A | -1.2943 | |
| 702 | A | A | -0.1554 | |
| 703 | L | A | 1.6384 | |
| 704 | L | A | 2.0796 | |
| 705 | R | A | 1.4563 | |
| 706 | I | A | 2.0243 | |
| 707 | L | A | 0.0000 | |
| 708 | K | A | -2.2304 | |
| 709 | E | A | -2.6956 | |
| 710 | T | A | -2.0410 | |
| 711 | E | A | -2.0383 | |
| 712 | F | A | 0.0000 | |
| 713 | K | A | -2.5211 | |
| 714 | K | A | -2.0515 | |
| 715 | I | A | -0.2678 | |
| 716 | K | A | -0.4308 | |
| 717 | V | A | 1.4794 | |
| 718 | L | A | 1.9347 | |
| 719 | G | A | 0.9878 | |
| 720 | S | A | 0.4168 | |
| 721 | G | A | 0.2906 | |
| 722 | A | A | 0.3873 | |
| 723 | F | A | 1.0047 | |
| 724 | G | A | 0.0000 | |
| 725 | T | A | 0.0034 | |
| 726 | V | A | 0.7196 | |
| 727 | Y | A | 0.6098 | |
| 728 | K | A | -0.2128 | |
| 729 | G | A | 0.0000 | |
| 730 | L | A | 0.0000 | |
| 731 | W | A | 0.0000 | |
| 732 | I | A | -0.9064 | |
| 733 | P | A | 0.0000 | |
| 734 | E | A | -2.7909 | |
| 735 | G | A | -2.3214 | |
| 736 | E | A | -2.6369 | |
| 737 | K | A | -2.7642 | |
| 738 | V | A | -1.6940 | |
| 739 | K | A | -1.0662 | |
| 740 | I | A | 0.0000 | |
| 741 | P | A | -0.6118 | |
| 742 | V | A | 0.0000 | |
| 743 | A | A | 0.1495 | |
| 744 | I | A | 0.0000 | |
| 745 | K | A | -0.4272 | |
| 746 | E | A | -0.7912 | |
| 747 | L | A | 0.0000 | |
| 748 | R | A | -2.2395 | |
| 749 | E | A | -2.5298 | |
| 750 | A | A | -1.4401 | |
| 751 | T | A | -1.2076 | |
| 752 | S | A | -1.3266 | |
| 753 | P | A | -1.8563 | |
| 754 | K | A | -2.7883 | |
| 755 | A | A | -2.1148 | |
| 756 | N | A | -2.4697 | |
| 757 | K | A | -3.5946 | |
| 758 | E | A | -3.5188 | |
| 759 | I | A | 0.0000 | |
| 760 | L | A | -1.4078 | |
| 761 | D | A | -2.4772 | |
| 762 | E | A | 0.0000 | |
| 763 | A | A | 0.0000 | |
| 764 | Y | A | 0.2919 | |
| 765 | V | A | 0.0000 | |
| 766 | M | A | 0.0000 | |
| 767 | A | A | 0.0000 | |
| 768 | S | A | -0.4253 | |
| 769 | V | A | 0.0000 | |
| 770 | D | A | -2.2322 | |
| 771 | N | A | -1.6100 | |
| 772 | P | A | -1.1987 | |
| 773 | H | A | 0.0000 | |
| 774 | V | A | 0.0000 | |
| 775 | C | A | 0.0000 | |
| 776 | R | A | -1.3391 | |
| 777 | L | A | 0.0000 | |
| 778 | L | A | 0.5089 | |
| 779 | G | A | 0.0000 | |
| 780 | I | A | 0.0000 | |
| 781 | C | A | 0.0000 | |
| 782 | L | A | 1.3246 | |
| 783 | T | A | 0.0162 | |
| 784 | S | A | -0.0169 | |
| 785 | T | A | -0.3526 | |
| 786 | V | A | 0.1728 | |
| 787 | Q | A | 0.0000 | |
| 788 | L | A | 0.0000 | |
| 789 | I | A | 0.0000 | |
| 790 | T | A | -0.1267 | |
| 791 | Q | A | 0.0000 | |
| 792 | L | A | 0.0699 | |
| 793 | M | A | 0.0000 | |
| 794 | P | A | 0.3656 | |
| 795 | F | A | 1.0649 | |
| 796 | G | A | 0.3913 | |
| 797 | C | A | -0.1948 | |
| 798 | L | A | 0.0000 | |
| 799 | L | A | -1.2522 | |
| 800 | D | A | -2.3714 | |
| 801 | Y | A | -1.6232 | |
| 802 | V | A | 0.0000 | |
| 803 | R | A | -2.9752 | |
| 804 | E | A | -3.5352 | |
| 805 | H | A | -3.2271 | |
| 806 | K | A | -3.3844 | |
| 807 | D | A | -3.8873 | |
| 808 | N | A | -3.2902 | |
| 809 | I | A | 0.0000 | |
| 810 | G | A | -1.7557 | |
| 811 | S | A | 0.0000 | |
| 812 | Q | A | -2.0401 | |
| 813 | Y | A | -0.7704 | |
| 814 | L | A | 0.0000 | |
| 815 | L | A | 0.0000 | |
| 816 | N | A | -1.0013 | |
| 817 | W | A | 0.0000 | |
| 818 | C | A | 0.0000 | |
| 819 | V | A | -0.3365 | |
| 820 | Q | A | -0.6074 | |
| 821 | I | A | 0.0000 | |
| 822 | A | A | 0.0000 | |
| 823 | K | A | -1.0715 | |
| 824 | G | A | 0.0000 | |
| 825 | M | A | 0.0000 | |
| 826 | N | A | -2.1014 | |
| 827 | Y | A | -1.8023 | |
| 828 | L | A | 0.0000 | |
| 829 | E | A | -2.0938 | |
| 830 | D | A | -2.5697 | |
| 831 | R | A | -2.1249 | |
| 832 | R | A | -1.8985 | |
| 833 | L | A | 0.0000 | |
| 834 | V | A | 0.0000 | |
| 835 | H | A | 0.0000 | |
| 836 | R | A | -0.3058 | |
| 837 | D | A | -0.3603 | |
| 838 | L | A | 0.0000 | |
| 839 | A | A | 0.0000 | |
| 840 | A | A | 0.0000 | |
| 841 | R | A | -0.9157 | |
| 842 | N | A | 0.0000 | |
| 843 | V | A | 0.0000 | |
| 844 | L | A | 0.0820 | |
| 845 | V | A | 0.0000 | |
| 846 | K | A | -0.1539 | |
| 847 | T | A | -0.3436 | |
| 848 | P | A | -0.4323 | |
| 849 | Q | A | -1.5050 | |
| 850 | H | A | -0.9205 | |
| 851 | V | A | 0.0000 | |
| 852 | K | A | 0.0000 | |
| 853 | I | A | 0.0000 | |
| 854 | T | A | -0.5465 | |
| 855 | D | A | -0.8740 | |
| 856 | F | A | 0.0000 | |
| 857 | G | A | -1.1741 | |
| 858 | L | A | -0.5444 | |
| 859 | A | A | -0.4104 | |
| 860 | K | A | -0.3152 | |
| 861 | L | A | 0.1740 | |
| 862 | L | A | 0.0000 | |
| 863 | G | A | -1.6000 | |
| 864 | A | A | -1.7900 | |
| 865 | E | A | -3.1990 | |
| 866 | E | A | -3.0390 | |
| 867 | K | A | -3.1699 | |
| 868 | E | A | -2.9133 | |
| 869 | Y | A | -1.8086 | |
| 870 | H | A | -2.2763 | |
| 871 | A | A | 0.0000 | |
| 872 | E | A | -2.8085 | |
| 873 | G | A | -2.0814 | |
| 874 | G | A | -1.7978 | |
| 875 | K | A | -1.9288 | |
| 876 | V | A | -0.4268 | |
| 877 | P | A | -0.1471 | |
| 878 | I | A | 0.0565 | |
| 879 | K | A | -0.5765 | |
| 880 | W | A | 0.0431 | |
| 881 | M | A | 0.0000 | |
| 882 | A | A | 0.0000 | |
| 883 | L | A | 0.0090 | |
| 884 | E | A | -0.5039 | |
| 885 | S | A | 0.0000 | |
| 886 | I | A | 0.0696 | |
| 887 | L | A | -0.1311 | |
| 888 | H | A | -1.5202 | |
| 889 | R | A | -2.4792 | |
| 890 | I | A | -1.5789 | |
| 891 | Y | A | 0.0000 | |
| 892 | T | A | 0.0000 | |
| 893 | H | A | -1.0638 | |
| 894 | Q | A | -1.1041 | |
| 895 | S | A | 0.0000 | |
| 896 | D | A | 0.0000 | |
| 897 | V | A | 0.0000 | |
| 898 | W | A | 0.0000 | |
| 899 | S | A | 0.0000 | |
| 900 | Y | A | 0.0000 | |
| 901 | G | A | 0.0000 | |
| 902 | V | A | 0.0000 | |
| 903 | T | A | 0.0000 | |
| 904 | V | A | 0.0000 | |
| 905 | W | A | 0.0000 | |
| 906 | E | A | 0.0000 | |
| 907 | L | A | 0.0000 | |
| 908 | M | A | 0.0000 | |
| 909 | T | A | -0.5773 | |
| 910 | F | A | -1.2350 | |
| 911 | G | A | 0.0000 | |
| 912 | S | A | -1.2636 | |
| 913 | K | A | -2.4052 | |
| 914 | P | A | 0.0000 | |
| 915 | Y | A | 0.0000 | |
| 916 | D | A | -2.5093 | |
| 917 | G | A | -1.3215 | |
| 918 | I | A | -0.8113 | |
| 919 | P | A | -0.8816 | |
| 920 | A | A | -0.6595 | |
| 921 | S | A | -0.8556 | |
| 922 | E | A | -1.4817 | |
| 923 | I | A | 0.0000 | |
| 924 | S | A | -1.0082 | |
| 925 | S | A | -1.8566 | |
| 926 | I | A | -2.0562 | |
| 927 | L | A | 0.0000 | |
| 928 | E | A | -2.7703 | |
| 929 | K | A | -3.2588 | |
| 930 | G | A | -2.4051 | |
| 931 | E | A | -2.7861 | |
| 932 | R | A | -1.6296 | |
| 933 | L | A | 0.0000 | |
| 934 | P | A | -0.8427 | |
| 935 | Q | A | -0.3683 | |
| 936 | P | A | 0.0000 | |
| 937 | P | A | -0.1225 | |
| 938 | I | A | 0.0000 | |
| 939 | C | A | 0.0000 | |
| 940 | T | A | 0.5601 | |
| 941 | I | A | 1.6410 | |
| 942 | D | A | -0.1361 | |
| 943 | V | A | 0.0000 | |
| 944 | Y | A | 0.6436 | |
| 945 | M | A | 0.8680 | |
| 946 | I | A | 0.2548 | |
| 947 | M | A | 0.0000 | |
| 948 | V | A | 0.1199 | |
| 949 | K | A | -0.3475 | |
| 950 | C | A | 0.0000 | |
| 951 | W | A | 0.0000 | |
| 952 | M | A | 0.2615 | |
| 953 | I | A | 0.6596 | |
| 954 | D | A | -1.4015 | |
| 955 | A | A | -1.2380 | |
| 956 | D | A | -2.1960 | |
| 957 | S | A | -1.4141 | |
| 958 | R | A | 0.0000 | |
| 959 | P | A | -1.5932 | |
| 960 | K | A | -2.1337 | |
| 961 | F | A | 0.0000 | |
| 962 | R | A | -2.5823 | |
| 963 | E | A | -2.0016 | |
| 964 | L | A | 0.0000 | |
| 965 | I | A | -0.8550 | |
| 966 | I | A | -0.1498 | |
| 967 | E | A | -1.2863 | |
| 968 | F | A | 0.0000 | |
| 969 | S | A | -1.4123 | |
| 970 | K | A | -2.5234 | |
| 971 | M | A | 0.0000 | |
| 972 | A | A | 0.0000 | |
| 973 | R | A | -3.8356 | |
| 974 | D | A | -4.0596 | |
| 975 | P | A | -3.0253 | |
| 976 | Q | A | -2.8474 | |
| 977 | R | A | -2.9033 | |
| 978 | Y | A | -1.4837 | |
| 979 | L | A | 0.0000 | |
| 980 | V | A | 0.5741 | |
| 981 | I | A | -0.6998 | |
| 982 | Q | A | -1.7874 | |
| 983 | G | A | -2.0553 | |
| 984 | D | A | -2.6352 | |
| 1003 | D | A | -2.9221 | |
| 1004 | E | A | -3.2225 | |
| 1005 | E | A | -3.0551 | |
| 1006 | D | A | -3.3593 | |
| 1007 | M | A | -2.4234 | |
| 1008 | D | A | -2.8734 | |
| 1009 | D | A | -2.7427 | |
| 1010 | V | A | -1.3972 | |
| 1011 | V | A | -0.9510 | |
| 1012 | D | A | -1.1448 | |
| 1013 | A | A | 0.0000 | |
| 1014 | D | A | -2.0689 | |
| 1015 | E | A | -1.9863 | |
| 1016 | Y | A | -0.2357 | |
| 1017 | L | A | 0.8878 | |
| 1018 | I | A | 0.7348 | |
| 1019 | P | A | -0.0679 | |
| 1020 | Q | A | -0.8530 |
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