Project name: 262e34ba8ba22ea

Chain sequence(s)	A: GGKGHFF; C: GGKGHFF; B: GGKGHFF; D: GGKGHFF
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:51)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:53)

• Minimal score value: -2.8553
• Maximal score value: 2.0992
• Average score: -0.526
• Total score value: -14.7288

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	-0.1972
2	G	A	-0.9442
3	K	A	-2.7861
4	G	A	0.0000
5	H	A	-1.2737
6	F	A	0.3745
7	F	A	2.0992
1	G	B	-0.0084
2	G	B	-0.9482
3	K	B	-2.8553
4	G	B	-2.7438
5	H	B	-1.3271
6	F	B	0.2691
7	F	B	2.0699
1	G	C	-0.0612
2	G	C	-0.8191
3	K	C	-2.6047
4	G	C	0.0000
5	H	C	-1.2880
6	F	C	0.2908
7	F	C	2.0783
1	G	D	-0.0615
2	G	D	-0.9581
3	K	D	-2.4531
4	G	D	-2.4181
5	H	D	-0.8241
6	F	D	0.6083
7	F	D	2.0530