Project name: d9b2883f99208a11082db7ee58c46543

Chain sequence(s)	B: CGSGEPEFLGEAEVNGKEVKVSLVEINGKKVVVAEAGDKTYYLPSLAGAKTDEEAVKGAAEAVG
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                                          (00:01:50)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:51)

• Minimal score value: -4.2712
• Maximal score value: 1.023
• Average score: -1.6892
• Total score value: -108.107

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	C	B	0.2859
2	G	B	-1.1027
3	S	B	-1.3887
4	G	B	-2.2413
5	E	B	-2.3971
6	P	B	-1.6674
7	E	B	-1.5086
8	F	B	0.2180
9	L	B	-0.8412
10	G	B	-1.6121
11	E	B	-3.3930
12	A	B	-3.4321
13	E	B	-3.7535
14	V	B	-2.7703
15	N	B	-2.4915
16	G	B	-2.4998
17	K	B	-3.5607
18	E	B	-4.2712
19	V	B	0.0000
20	K	B	-2.6404
21	V	B	0.0000
22	S	B	-0.8099
23	L	B	-0.8612
24	V	B	0.0000
25	E	B	-2.9997
26	I	B	-1.9832
27	N	B	-2.3243
28	G	B	-2.3450
29	K	B	-2.9765
30	K	B	-2.5648
31	V	B	0.0000
32	V	B	0.0000
33	V	B	0.0000
34	A	B	0.0000
35	E	B	-3.1608
36	A	B	0.0000
37	G	B	-2.9964
38	D	B	-3.1510
39	K	B	-3.0717
40	T	B	-1.6321
41	Y	B	0.0519
42	Y	B	1.0230
43	L	B	0.6401
44	P	B	-0.2505
45	S	B	-0.1772
46	L	B	-0.6049
47	A	B	-1.1730
48	G	B	-1.1225
49	A	B	-1.8210
50	K	B	-2.6066
51	T	B	-2.7783
52	D	B	-3.3400
53	E	B	-3.9267
54	E	B	-3.1278
55	A	B	0.0000
56	V	B	-2.7917
57	K	B	-3.3211
58	G	B	-2.0632
59	A	B	0.0000
60	A	B	-2.8212
61	E	B	-2.2693
62	A	B	-0.9301
63	V	B	-1.2601
64	G	B	-1.4925