Project name: dfc443a6e7e43e1

Chain sequence(s)	A: ARGWDYGGGYFDY
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:03)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:04)

• Minimal score value: -1.2244
• Maximal score value: 1.6501
• Average score: 0.3924
• Total score value: 5.1013

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	A	A	-0.6136
2	R	A	-1.2244
3	G	A	0.2388
4	W	A	1.0781
5	D	A	0.4787
6	Y	A	0.9317
7	G	A	-0.0484
8	G	A	-0.0909
9	G	A	0.8032
10	Y	A	1.6501
11	F	A	1.5713
12	D	A	-0.3273
13	Y	A	0.6540