Project name: 5a3dd9cf79352322dace4f490e230494

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

• Minimal score value: -3.1408
• Maximal score value: 0.8382
• Average score: -0.8704
• Total score value: -55.7081

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	-0.9197
2	S	B	-0.5857
3	A	B	0.1056
4	A	B	-0.1726
5	A	B	-0.4874
6	L	B	-0.7700
7	A	B	-0.6008
8	A	B	0.0000
9	A	B	0.0000
10	R	B	-2.2028
11	A	B	-0.7746
12	A	B	-0.7516
13	G	B	-1.2458
14	G	B	-1.8383
15	E	B	-2.3799
16	A	B	-1.3977
17	G	B	0.0000
18	A	B	0.0000
19	A	B	-1.2815
20	A	B	0.0000
21	L	B	0.0000
22	E	B	-1.7901
23	A	B	-0.7560
24	W	B	-0.7456
25	D	B	-1.4699
26	A	B	-1.2854
27	A	B	0.0000
28	S	B	-1.8756
29	G	B	-1.4424
30	G	B	-1.7396
31	D	B	-2.2985
32	G	B	-1.5103
33	G	B	-1.2976
34	P	B	-1.0287
35	V	B	-1.3134
36	K	B	-2.6516
37	D	B	-3.1349
38	K	B	-3.1408
39	A	B	-1.9259
40	A	B	-1.6314
41	K	B	-2.0353
42	D	B	-2.1900
43	A	B	-0.7968
44	A	B	0.0000
45	W	B	0.1312
46	A	B	-0.0257
47	A	B	0.0837
48	L	B	0.0000
49	A	B	0.1762
50	P	B	-0.3198
51	T	B	0.0000
52	L	B	0.0000
53	A	B	-0.4823
54	A	B	-0.2155
55	A	B	0.0000
56	R	B	-1.5146
57	A	B	-0.1346
58	L	B	0.8382
59	G	B	-0.2884
60	L	B	-0.1349
61	G	B	-0.7076
62	S	B	-0.9267
63	G	B	-0.8247
64	C	B	0.0000