Project name: e187197fa1a084b

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

• Minimal score value: -1.8096
• Maximal score value: 3.7752
• Average score: -0.0238
• Total score value: -0.6655

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	-0.9034
2	S	A	-1.1368
3	G	A	-1.5903
4	H	A	-1.5790
5	K	A	-0.3202
6	F	A	2.6073
7	F	A	3.3206
1	G	B	-1.1178
2	S	B	-1.2022
3	G	B	-1.6550
4	H	B	-1.3098
5	K	B	0.1034
6	F	B	2.3546
7	F	B	3.7752
1	G	C	-1.1479
2	S	C	-1.1832
3	G	C	-1.7141
4	H	C	-1.5422
5	K	C	-0.3045
6	F	C	2.3273
7	F	C	3.5519
1	G	D	-0.9824
2	S	D	-1.0594
3	G	D	-1.7773
4	H	D	-1.8096
5	K	D	-0.9619
6	F	D	1.6985
7	F	D	2.8927