Project name: f67dccfecea871c

Chain sequence(s)	B: AELAALKAKLKGAREALKLMEEVAKQLGLDAEKVEKKTKEMRKRIDEIIA
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                                          (00:02:19)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:20)

• Minimal score value: -4.7849
• Maximal score value: 0.676
• Average score: -1.76
• Total score value: -87.9981

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	-0.2814
2	E	B	-0.8933
3	L	B	0.6760
4	A	B	0.1259
5	A	B	-0.4926
6	L	B	0.0050
7	K	B	-0.6592
8	A	B	-1.3930
9	K	B	-2.2467
10	L	B	-1.8842
11	K	B	-3.0351
12	G	B	-2.5252
13	A	B	-1.8670
14	R	B	-2.8692
15	E	B	-2.4819
16	A	B	-1.1158
17	L	B	0.0000
18	K	B	-1.4797
19	L	B	0.1435
20	M	B	-0.2059
21	E	B	-2.1996
22	E	B	-1.5725
23	V	B	0.4122
24	A	B	0.0000
25	K	B	-2.3778
26	Q	B	-1.1906
27	L	B	0.4329
28	G	B	-0.7560
29	L	B	-0.6731
30	D	B	-2.7434
31	A	B	-3.1740
32	E	B	-4.2153
33	K	B	-4.2149
34	V	B	0.0000
35	E	B	-4.5244
36	K	B	-4.6188
37	K	B	-3.8429
38	T	B	0.0000
39	K	B	-4.7849
40	E	B	-4.6613
41	M	B	-3.5224
42	R	B	-4.1527
43	K	B	-4.3467
44	R	B	-3.8130
45	I	B	0.0000
46	D	B	-2.7100
47	E	B	-2.2785
48	I	B	0.2670
49	I	B	0.0343
50	A	B	-0.2919