Project name: GGKGHFG

Chain sequence(s)	A: GGKGHFG; C: GGKGHFG; B: GGKGHFG; D: GGKGHFG
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                                          (00:01:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:43)

• Minimal score value: -2.9457
• Maximal score value: 0.3366
• Average score: -1.3959
• Total score value: -39.0854

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	-1.3529
2	G	A	-1.4884
3	K	A	-1.9672
4	G	A	0.0000
5	H	A	-1.7909
6	F	A	-1.1749
7	G	A	-0.7329
1	G	B	-1.0610
2	G	B	-1.3931
3	K	B	-2.3172
4	G	B	0.0000
5	H	B	-2.1264
6	F	B	-1.3229
7	G	B	-1.6664
1	G	C	-0.7930
2	G	C	-1.0952
3	K	C	-2.4173
4	G	C	0.0000
5	H	C	-2.1267
6	F	C	-1.7007
7	G	C	-1.3676
1	G	D	-1.6480
2	G	D	-2.3867
3	K	D	-2.9457
4	G	D	-2.0964
5	H	D	-2.0254
6	F	D	0.3366
7	G	D	-0.4251