Project name: b8cceb1e942f0b6

Chain sequence(s)	A: SETMFTWQNYDNYAS
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                                          (00:00:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:07)

• Minimal score value: -1.3664
• Maximal score value: 2.3401
• Average score: 0.0828
• Total score value: 1.2417

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	S	A	-0.9202
2	E	A	-1.3664
3	T	A	-0.0878
4	M	A	1.4674
5	F	A	2.3401
6	T	A	1.2628
7	W	A	1.0091
8	Q	A	-0.8119
9	N	A	-0.2751
10	Y	A	0.6899
11	D	A	-1.0869
12	N	A	-1.2148
13	Y	A	0.4920
14	A	A	0.0460
15	S	A	-0.3025