Project name: f79349a280ac223

Chain sequence(s)	B: SLAAVDAFAKGVEAAGEIALRLAEEAGLDKEKVEKELAKIKEKVAKLKAA
Selected Chain(s)	B
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 B 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                                          (00:02:03)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:04)

• Minimal score value: -4.915
• Maximal score value: 1.3244
• Average score: -1.7467
• Total score value: -87.3345

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	B	0.5038
2	L	B	1.3244
3	A	B	0.5422
4	A	B	0.3082
5	V	B	0.2992
6	D	B	-0.6972
7	A	B	-0.4544
8	F	B	0.0439
9	A	B	0.0000
10	K	B	-2.2567
11	G	B	-1.4756
12	V	B	-1.1608
13	E	B	-2.2565
14	A	B	-1.1559
15	A	B	-0.7071
16	G	B	0.0000
17	E	B	-1.2677
18	I	B	0.4834
19	A	B	-0.2433
20	L	B	-1.6158
21	R	B	-1.8350
22	L	B	-0.2531
23	A	B	0.0000
24	E	B	-2.6990
25	E	B	-2.4221
26	A	B	-1.1871
27	G	B	-1.2455
28	L	B	-0.6747
29	D	B	-2.5230
30	K	B	-3.7753
31	E	B	-4.4423
32	K	B	-4.4234
33	V	B	-3.5199
34	E	B	-4.8553
35	K	B	-4.9150
36	E	B	-4.5415
37	L	B	-3.5922
38	A	B	-3.5832
39	K	B	-3.9810
40	I	B	-2.9622
41	K	B	-3.6956
42	E	B	-4.0887
43	K	B	-3.5412
44	V	B	0.0000
45	A	B	-2.5536
46	K	B	-2.7805
47	L	B	-1.1434
48	K	B	-1.3139
49	A	B	-0.7657
50	A	B	-0.2352