Project name: 81d89fdbd410950

Chain sequence(s)	B: GQLTVNSISVEDFPDGTGVLTVTLTLSQEQPVTLWWEDLETGERRRAGTI
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:35)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:36)

• Minimal score value: -4.4049
• Maximal score value: 2.4084
• Average score: -0.8288
• Total score value: -41.4395

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	G	B	-1.7283
2	Q	B	-1.3965
3	L	B	-0.0173
4	T	B	0.1914
5	V	B	1.0098
6	N	B	-0.2277
7	S	B	0.5787
8	I	B	2.4084
9	S	B	1.5931
10	V	B	1.2644
11	E	B	-1.2916
12	D	B	-2.1486
13	F	B	-1.3640
14	P	B	-1.3880
15	D	B	-2.2340
16	G	B	-1.6779
17	T	B	-1.3344
18	G	B	-0.9639
19	V	B	0.7704
20	L	B	1.4309
21	T	B	1.3998
22	V	B	1.6788
23	T	B	0.5525
24	L	B	0.8133
25	T	B	0.0622
26	L	B	-0.3175
27	S	B	-1.4343
28	Q	B	-2.6249
29	E	B	-2.6952
30	Q	B	-2.3277
31	P	B	-0.6106
32	V	B	0.4017
33	T	B	0.3876
34	L	B	0.2574
35	W	B	-0.8917
36	W	B	-1.6200
37	E	B	-3.6367
38	D	B	-2.9455
39	L	B	-0.9215
40	E	B	-1.9681
41	T	B	-1.9438
42	G	B	-2.4385
43	E	B	-3.8265
44	R	B	-4.4049
45	R	B	-4.1480
46	R	B	-2.8596
47	A	B	-1.0202
48	G	B	-0.1162
49	T	B	0.6613
50	I	B	1.6224