Project name: FFKGHFF8

Status: done

Started: 2026-02-09 08:31:16
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Chain sequence(s) A: FFKGHFF
C: FFKGHFF
B: FFKGHFF
E: FFKGHFF
D: FFKGHFF
G: FFKGHFF
F: FFKGHFF
H: FFKGHFF
input PDB
Selected Chain(s) A,C,B,E,D,G,F,H
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:03)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:03)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:03)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:04:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:12)
Show buried residues

Minimal score value
-1.4184
Maximal score value
3.4992
Average score
0.8681
Total score value
48.6113

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
mutation
1 F A -0.0312
2 F A 0.4039
3 K A -0.8556
4 G A -0.1414
5 H A 0.2967
6 F A 2.8587
7 F A 3.0589
1 F B 1.4506
2 F B 0.0000
3 K B -0.3671
4 G B 0.0000
5 H B 0.4467
6 F B 3.0902
7 F B 3.4992
1 F C 1.1758
2 F C 0.0000
3 K C -1.4184
4 G C 0.0000
5 H C -0.2461
6 F C 1.9162
7 F C 2.5775
1 F D 1.5073
2 F D 0.8650
3 K D -1.4054
4 G D 0.0000
5 H D 0.2568
6 F D 2.1137
7 F D 2.7102
1 F E 1.3927
2 F E 0.0000
3 K E -0.0567
4 G E 0.0000
5 H E 0.9381
6 F E 2.7260
7 F E 2.9139
1 F F 1.1839
2 F F 0.0000
3 K F -0.7206
4 G F 0.0000
5 H F 0.1047
6 F F 1.8896
7 F F 2.4692
1 F G 1.3243
2 F G 0.0000
3 K G -0.9006
4 G G 0.0000
5 H G 0.1602
6 F G 2.8354
7 F G 3.2526
1 F H 1.5913
2 F H 0.6818
3 K H -1.0155
4 G H 0.0000
5 H H -0.1062
6 F H 1.6259
7 F H 2.5591
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Laboratory of Theory of Biopolymers 2018