Project name: ebcc047eda269a4

Chain sequence(s)	B: AELAALKAKLKGAKKAWDLIEEVAKQLGLDYEKIKKKTEKKKAEIDKIIA
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                                          (00:02:14)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:14)

• Minimal score value: -4.7545
• Maximal score value: 0.8096
• Average score: -1.7479
• Total score value: -87.3972

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	-0.1988
2	E	B	-0.7416
3	L	B	0.8096
4	A	B	0.2452
5	A	B	-0.3215
6	L	B	0.3660
7	K	B	-0.5593
8	A	B	-1.3219
9	K	B	-2.1540
10	L	B	-1.8548
11	K	B	-3.1281
12	G	B	-2.5754
13	A	B	-2.1121
14	K	B	-3.0451
15	K	B	-2.6762
16	A	B	-1.1987
17	W	B	-1.6627
18	D	B	-1.6853
19	L	B	-0.0854
20	I	B	0.2248
21	E	B	-2.0353
22	E	B	-1.5819
23	V	B	0.3410
24	A	B	0.0000
25	K	B	-2.2807
26	Q	B	-1.1748
27	L	B	0.3822
28	G	B	-0.7603
29	L	B	-0.4306
30	D	B	-2.5028
31	Y	B	-2.8696
32	E	B	-4.0632
33	K	B	-3.9287
34	I	B	-3.2513
35	K	B	-4.4785
36	K	B	-4.7545
37	K	B	-4.1569
38	T	B	0.0000
39	E	B	-4.4746
40	K	B	-4.4094
41	K	B	-3.8261
42	K	B	-3.7064
43	A	B	-2.9208
44	E	B	-2.8503
45	I	B	0.0000
46	D	B	-2.5348
47	K	B	-1.8299
48	I	B	0.6315
49	I	B	0.1162
50	A	B	-0.3714