Project name: GGGHKFG4

Chain sequence(s)	A: GGGHKFG; C: GGGHKFG; B: GGGHKFG; D: GGGHKFG
Selected Chain(s)	A,C,B,D
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

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                                          (00:01:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:50)

• Minimal score value: -2.6192
• Maximal score value: 1.1434
• Average score: -0.9839
• Total score value: -27.5505

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
1	G	A	-1.2545
2	G	A	-1.2876
3	G	A	-1.7142
4	H	A	-1.7532
5	K	A	-2.2389
6	F	A	0.8068
7	G	A	-0.3724
1	G	B	-1.2205
2	G	B	-1.3082
3	G	B	-1.6260
4	H	B	0.0000
5	K	B	-2.6192
6	F	B	0.1175
7	G	B	-0.7861
1	G	C	-1.4334
2	G	C	-1.9886
3	G	C	0.0000
4	H	C	-1.4682
5	K	C	-1.2980
6	F	C	1.1434
7	G	C	-0.0249
1	G	D	-1.4369
2	G	D	-1.6099
3	G	D	-1.9267
4	H	D	-1.8030
5	K	D	-2.0823
6	F	D	0.7721
7	G	D	0.8624