Project name: FGKGHGF8

Status: done

Started: 2026-02-20 07:08:46
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Chain sequence(s) A: FGKGHGF
C: FGKGHGF
B: FGKGHGF
E: FGKGHGF
D: FGKGHGF
G: FGKGHGF
F: FGKGHGF
H: FGKGHGF
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]                                                (00:00:01)
[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 all 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                                          (00:11:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:11:08)
Show buried residues

Minimal score value
-1.8677
Maximal score value
3.6884
Average score
0.7973
Total score value
44.6497

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 1.6071
2 G A 0.1619
3 K A 0.2786
4 G A 0.0000
5 H A 0.9330
6 G A 1.4751
7 F A 2.2676
1 F B 1.9729
2 G B 0.0000
3 K B -1.0664
4 G B -0.3205
5 H B -0.7500
6 G B 1.1018
7 F B 3.6884
1 F C 2.8675
2 G C 0.6337
3 K C -0.5685
4 G C -0.0128
5 H C -0.4913
6 G C 1.2767
7 F C 2.9572
1 F D 2.5824
2 G D 1.5036
3 K D 0.4365
4 G D 1.0012
5 H D 1.6302
6 G D 0.0000
7 F D 3.1252
1 F E 1.7009
2 G E -0.1854
3 K E -1.8677
4 G E -0.7650
5 H E -0.8157
6 G E 0.7820
7 F E 3.6825
1 F F 1.9756
2 G F 0.7937
3 K F 0.5668
4 G F 0.2707
5 H F 0.0000
6 G F 0.6805
7 F F 1.8772
1 F G 2.5498
2 G G 0.0000
3 K G -0.5674
4 G G 0.0000
5 H G -0.7266
6 G G 0.9295
7 F G 2.7988
1 F H 2.0574
2 G H 0.0000
3 K H 0.2710
4 G H -0.4892
5 H H -0.6329
6 G H -0.0933
7 F H 1.5654
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Laboratory of Theory of Biopolymers 2018