Project name: V1K

Chain sequence(s)	A: VFSKLAYILYGSGKQSSRVPLY
Selected Chain(s)	A
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 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                                          (00:00:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:19)

• Minimal score value: -1.9966
• Maximal score value: 2.2163
• Average score: 0.4066
• Total score value: 8.9455

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	V	A	2.1156
2	F	A	2.2163
3	S	A	-0.1718
4	K	A	-1.4815
5	L	A	1.1197
6	A	A	0.5065
7	Y	A	1.5147
8	I	A	1.6097
9	L	A	1.9809
10	Y	A	1.5833
11	G	A	0.1428
12	S	A	-0.3063
13	G	A	-0.8035
14	K	A	-1.9966
15	Q	A	-1.5410
16	S	A	-0.4665
17	S	A	-0.5911
18	R	A	-1.5318
19	V	A	1.3607
20	P	A	0.3536
21	L	A	1.7376
22	Y	A	1.5942