Project name: a0b1a4304762b2e

Chain sequence(s)	B: SSRLIARHTVQVSAGGPLSSVTFVFGDDATLTVPLTLPAGETVRLEARTA
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                                          (00:00:20)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:21)

• Minimal score value: -3.2669
• Maximal score value: 2.3472
• Average score: -0.6762
• Total score value: -33.8117

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	-0.8804
2	S	B	-1.2938
3	R	B	-1.9267
4	L	B	-1.2588
5	I	B	-0.1291
6	A	B	-1.3279
7	R	B	-3.2538
8	H	B	-2.9020
9	T	B	-2.0157
10	V	B	-1.1377
11	Q	B	-1.7243
12	V	B	-0.9651
13	S	B	-0.8559
14	A	B	-0.7917
15	G	B	-0.6387
16	G	B	-0.5456
17	P	B	-0.5080
18	L	B	-0.1003
19	S	B	0.0478
20	S	B	0.3714
21	V	B	1.0250
22	T	B	1.4342
23	F	B	2.3158
24	V	B	2.3472
25	F	B	1.5851
26	G	B	-0.4898
27	D	B	-2.1534
28	D	B	-1.9809
29	A	B	-0.0527
30	T	B	1.1769
31	L	B	2.1227
32	T	B	1.3238
33	V	B	1.3131
34	P	B	0.5137
35	L	B	0.5082
36	T	B	0.1189
37	L	B	0.0000
38	P	B	-0.8600
39	A	B	-1.0077
40	G	B	-1.3381
41	E	B	-1.7371
42	T	B	-1.3790
43	V	B	-1.5361
44	R	B	-2.9870
45	L	B	-2.5565
46	E	B	-3.2669
47	A	B	-1.7417
48	R	B	-2.4827
49	T	B	-1.3266
50	A	B	-0.8638