Project name: 258d92071e19f5e

Status: done

Started: 2026-06-27 16:04:53
Settings
Chain sequence(s) A: GGGGSGGGGSGGGGS
C: GGGGSGGGGSGGGGS
B: GGGGSGGGGSGGGGS
D: GGGGSGGGGSGGGGS
input PDB
Selected Chain(s) A,C,B,D
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                                          (00:00:02)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:03)
Show buried residues

Minimal score value
-2.048
Maximal score value
-0.831
Average score
-1.536
Total score value
-92.1617

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 G A -1.6862
2 G A -1.7163
3 G A -1.9313
4 G A -1.5805
5 S A -1.3273
6 G A -1.5094
7 G A -1.4820
8 G A -1.7664
9 G A -1.5598
10 S A -1.3529
11 G A -1.5759
12 G A -1.5536
13 G A -1.6965
14 G A -1.5451
15 S A -0.9587
1 G B -1.5259
2 G B -1.7751
3 G B -1.6779
4 G B -1.7507
5 S B -1.3056
6 G B -1.5070
7 G B -1.5295
8 G B -1.5497
9 G B -1.7175
10 S B -1.3772
11 G B -1.5264
12 G B -1.6850
13 G B -1.5346
14 G B -1.5185
15 S B -0.9498
1 G C -1.5624
2 G C -2.0480
3 G C -1.8197
4 G C -1.6731
5 S C -1.5415
6 G C -1.4584
7 G C -1.7284
8 G C -1.6208
9 G C -1.5771
10 S C -1.5258
11 G C -1.4999
12 G C -1.7412
13 G C -1.7985
14 G C -1.4951
15 S C -1.0865
1 G D -1.5282
2 G D -1.8212
3 G D -1.9204
4 G D -1.3767
5 S D -1.3157
6 G D -1.3081
7 G D -1.5081
8 G D -1.6799
9 G D -1.2878
10 S D -1.3205
11 G D -1.4169
12 G D -1.4111
13 G D -1.7621
14 G D -1.3253
15 S D -0.8310
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Laboratory of Theory of Biopolymers 2018