Project name: e76703bd2d997ed

Chain sequence(s)	L: KRLPAAMAPWTD
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with L chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:14)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:14)

• Minimal score value: -2.0443
• Maximal score value: 1.1286
• Average score: -0.283
• Total score value: -3.3965

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
36	K	L	-2.0338
37	R	L	-2.0443
38	L	L	0.2093
39	P	L	-0.1393
40	A	L	0.0248
41	A	L	0.2577
42	M	L	1.0660
43	A	L	0.1613
44	P	L	-0.0407
45	W	L	1.1286
46	T	L	-0.1837
47	D	L	-1.8024