Project name: zs6.25

Chain sequence(s)	A: WLKLFFKVLKALWKLFGK
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                                          (00:00:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:50)

• Minimal score value: -0.6488
• Maximal score value: 2.4127
• Average score: 0.8503
• Total score value: 15.3058

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	W	A	0.6313
2	L	A	0.1393
3	K	A	-0.6343
4	L	A	1.5300
5	F	A	1.5295
6	F	A	1.8224
7	K	A	0.0290
8	V	A	0.0000
9	L	A	0.6720
10	K	A	-0.6488
11	A	A	0.5324
12	L	A	2.1080
13	W	A	1.8821
14	K	A	0.3322
15	L	A	2.1697
16	F	A	2.4127
17	G	A	0.9784
18	K	A	-0.1801