Project name: 5dc2a351e6f0f32

Chain sequence(s)	A: GSKGHFF; B: GSKGHFF
Selected Chain(s)	A,B
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                                          (00:00:19)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:19)

• Minimal score value: -3.0829
• Maximal score value: 3.3848
• Average score: -0.4466
• Total score value: -6.2522

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	-1.4546
2	S	A	-2.2116
3	K	A	-3.0036
4	G	A	-1.8419
5	H	A	-0.1531
6	F	A	2.6678
7	F	A	3.3848
1	G	B	-1.5773
2	S	B	-2.0999
3	K	B	-3.0829
4	G	B	-1.5738
5	H	B	-0.4292
6	F	B	1.9470
7	F	B	3.1761