Project name: 95e1f2ae740627f

Chain sequence(s)	L: KWLMLPISEAYGGD
Selected Chain(s)	L
Distance of aggregation	5 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 L 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                                          (00:00:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:12)

• Minimal score value: -1.8483
• Maximal score value: 1.8354
• Average score: 0.0715
• Total score value: 1.0014

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
47	K	L	-1.4865
48	W	L	1.1626
49	L	L	1.8354
50	M	L	0.9250
51	L	L	1.2772
52	P	L	0.1293
53	I	L	0.6149
54	S	L	-0.3582
55	E	L	-1.8483
56	A	L	-0.0318
57	Y	L	1.2415
58	G	L	-0.2450
59	G	L	-0.5665
60	D	L	-1.6482