Project name: c12725d40a3d35e

Chain sequence(s)	B: DLRAKLDEVMKKLKEFKKEVKEQGTPALEAMKKLIEIAKMKGEALKALEA
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                                          (00:03:25)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:25)

• Minimal score value: -5.2853
• Maximal score value: 0.6686
• Average score: -2.1013
• Total score value: -105.0667

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	D	B	-2.5531
2	L	B	0.0000
3	R	B	-3.0439
4	A	B	-2.7702
5	K	B	-3.1815
6	L	B	-2.9368
7	D	B	-3.8745
8	E	B	-3.8122
9	V	B	0.0000
10	M	B	-2.6032
11	K	B	-4.1383
12	K	B	-3.7463
13	L	B	-3.1809
14	K	B	-4.4198
15	E	B	-4.6881
16	F	B	0.0000
17	K	B	-4.7335
18	K	B	-5.2853
19	E	B	-4.3773
20	V	B	-3.1877
21	K	B	-4.1846
22	E	B	-4.2469
23	Q	B	-3.4165
24	G	B	-2.2382
25	T	B	-1.6336
26	P	B	-0.2550
27	A	B	0.2756
28	L	B	0.6686
29	E	B	-0.9452
30	A	B	0.0000
31	M	B	0.3620
32	K	B	-1.4240
33	K	B	-1.4619
34	L	B	-0.3868
35	I	B	-0.4797
36	E	B	-1.8178
37	I	B	0.0000
38	A	B	-1.3815
39	K	B	-2.4375
40	M	B	-2.1539
41	K	B	-2.3496
42	G	B	-2.0377
43	E	B	-2.9184
44	A	B	0.0000
45	L	B	-1.3299
46	K	B	-2.2980
47	A	B	-1.3619
48	L	B	-0.5415
49	E	B	-1.7840
50	A	B	-0.7562