Project name: bfd05c3a04704f5

Status: done

Started: 2026-02-12 08:31:11
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Chain sequence(s) A: GGGHKGG
C: GGGHKGG
B: GGGHKGG
E: GGGHKGG
D: GGGHKGG
G: GGGHKGG
F: GGGHKGG
H: GGGHKGG
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                                          (00:01:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:10)
Show buried residues

Minimal score value
-2.8954
Maximal score value
-1.0577
Average score
-1.8871
Total score value
-105.6755

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 -1.3543
2 G A -1.5986
3 G A -2.2222
4 H A -2.7295
5 K A -2.8954
6 G A -1.8919
7 G A -1.2203
1 G B -2.0781
2 G B -2.3945
3 G B -2.6903
4 H B -2.6241
5 K B -2.5476
6 G B -1.6442
7 G B -1.2173
1 G C -1.1315
2 G C -1.3695
3 G C -2.0045
4 H C -2.3333
5 K C -2.5549
6 G C -1.7916
7 G C -1.2976
1 G D -1.1345
2 G D -1.5855
3 G D -2.2981
4 H D -2.6368
5 K D -2.7537
6 G D -1.9570
7 G D -1.5108
1 G E -1.0577
2 G E -1.4855
3 G E -1.9056
4 H E -2.6179
5 K E -2.7434
6 G E -2.0855
7 G E -1.3154
1 G F -1.2500
2 G F -1.4738
3 G F -1.9675
4 H F -2.3029
5 K F -2.1419
6 G F -1.6816
7 G F -1.1255
1 G G -1.2372
2 G G -1.4902
3 G G -2.2180
4 H G -2.2765
5 K G -2.3308
6 G G -1.7617
7 G G -1.2815
1 G H -1.2110
2 G H -1.4941
3 G H -2.4004
4 H H -2.0501
5 K H -2.3895
6 G H -1.5400
7 G H -1.3727
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Laboratory of Theory of Biopolymers 2018