Project name: GGGHKGF4

Chain sequence(s)	A: GGGHKGF; C: GGGHKGF; B: GGGHKGF; D: GGGHKGF
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                                          (00:00:53)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:55)

• Minimal score value: -3.3446
• Maximal score value: 1.8123
• Average score: -1.1892
• Total score value: -33.2988

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	-0.9155
2	G	A	-1.3703
3	G	A	-1.7144
4	H	A	-2.3581
5	K	A	-1.9136
6	G	A	0.0000
7	F	A	0.6493
1	G	B	-0.9192
2	G	B	-1.9086
3	G	B	-2.8391
4	H	B	-2.5486
5	K	B	-2.7076
6	G	B	-0.4329
7	F	B	1.3267
1	G	C	-0.5098
2	G	C	0.0000
3	G	C	-3.0667
4	H	C	-2.8383
5	K	C	-2.4458
6	G	C	0.7703
7	F	C	1.8123
1	G	D	0.1732
2	G	D	-0.3378
3	G	D	-2.0838
4	H	D	-3.0123
5	K	D	-3.3446
6	G	D	-1.4981
7	F	D	0.7345