Project name: 6fac6f0614d0c4

Chain sequence(s)	B: APTSVTFVWMSRGPLEKTPQRVATSTVVGAGLQAVSISVSGGVLTVTLRL
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                                          (00:00:14)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:14)

• Minimal score value: -2.5069
• Maximal score value: 2.6997
• Average score: 0.3121
• Total score value: 15.6047

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	A	B	0.0780
2	P	B	0.2117
3	T	B	0.3993
4	S	B	0.8672
5	V	B	1.0623
6	T	B	0.7135
7	F	B	0.8346
8	V	B	1.0096
9	W	B	0.9798
10	M	B	0.1330
11	S	B	-1.1079
12	R	B	-2.5069
13	G	B	-1.3581
14	P	B	-0.4057
15	L	B	0.3834
16	E	B	-1.5293
17	K	B	-2.1883
18	T	B	-1.8355
19	P	B	-2.0376
20	Q	B	-2.2506
21	R	B	-1.3474
22	V	B	0.7962
23	A	B	0.6615
24	T	B	0.4441
25	S	B	0.5001
26	T	B	0.7169
27	V	B	1.5084
28	V	B	2.0114
29	G	B	0.9611
30	A	B	0.3106
31	G	B	-0.1954
32	L	B	0.0762
33	Q	B	-1.1931
34	A	B	-0.0619
35	V	B	0.4609
36	S	B	0.8083
37	I	B	2.6379
38	S	B	2.1476
39	V	B	2.6997
40	S	B	1.0105
41	G	B	0.2388
42	G	B	0.6863
43	V	B	2.2545
44	L	B	2.6260
45	T	B	1.8882
46	V	B	1.6320
47	T	B	0.5123
48	L	B	-0.0644
49	R	B	-1.2357
50	L	B	0.6606