Project name: 8afc0159f5f7382

Chain sequence(s)	B: SSRLLQTHTIQVSAGGPLSSVTWVFNGDATLTSSLTLPAGATERFRAESA
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.                                          (00:00:15)

• Minimal score value: -3.0357
• Maximal score value: 1.7956
• Average score: -0.7604
• Total score value: -38.0188

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	-0.8852
2	S	B	-1.4240
3	R	B	-2.1403
4	L	B	-1.3556
5	L	B	-0.7067
6	Q	B	-1.8028
7	T	B	-2.0126
8	H	B	-2.3342
9	T	B	-1.9882
10	I	B	0.0000
11	Q	B	-1.9317
12	V	B	0.0000
13	S	B	-0.8081
14	A	B	-0.6954
15	G	B	-0.6753
16	G	B	-0.5767
17	P	B	-0.4265
18	L	B	-0.0961
19	S	B	-0.1055
20	S	B	0.0122
21	V	B	0.5773
22	T	B	0.8354
23	W	B	1.5109
24	V	B	1.7956
25	F	B	0.6005
26	N	B	-1.0775
27	G	B	-1.3484
28	D	B	-1.7880
29	A	B	-0.1721
30	T	B	0.8120
31	L	B	1.6742
32	T	B	0.7612
33	S	B	0.2649
34	S	B	-0.0252
35	L	B	0.3455
36	T	B	0.0721
37	L	B	0.0000
38	P	B	-0.6996
39	A	B	-0.7346
40	G	B	-1.0494
41	A	B	-1.1454
42	T	B	-1.6288
43	E	B	-2.3759
44	R	B	-3.0357
45	F	B	-2.4252
46	R	B	-2.8604
47	A	B	-1.7961
48	E	B	-2.6332
49	S	B	-1.6113
50	A	B	-0.9089