Project name: 59b6a24ff3f49f0

Chain sequence(s)	B: SFADELAAAGKKIAALAKEMEAQGEEELAAKLKAMQALVAAKLQEVEELL
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                                          (00:01:17)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:18)

• Minimal score value: -4.3081
• Maximal score value: 1.0022
• Average score: -1.6791
• Total score value: -83.9553

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	S	B	-0.3295
2	F	B	0.5070
3	A	B	0.0000
4	D	B	-2.0817
5	E	B	-2.1695
6	L	B	0.0000
7	A	B	-1.7814
8	A	B	-1.8640
9	A	B	-1.7647
10	G	B	0.0000
11	K	B	-2.5818
12	K	B	-2.4428
13	I	B	-1.7074
14	A	B	-1.7979
15	A	B	-1.9959
16	L	B	-1.4683
17	A	B	0.0000
18	K	B	-3.6166
19	E	B	-3.0068
20	M	B	-3.1546
21	E	B	-4.3081
22	A	B	-2.8898
23	Q	B	-3.0616
24	G	B	-3.1380
25	E	B	-3.7031
26	E	B	-4.2476
27	E	B	-3.5605
28	L	B	-2.6442
29	A	B	0.0000
30	A	B	-2.7539
31	K	B	-2.4442
32	L	B	-1.7344
33	K	B	-1.9135
34	A	B	-0.5914
35	M	B	0.1709
36	Q	B	-0.7911
37	A	B	0.1649
38	L	B	1.0022
39	V	B	0.0000
40	A	B	-0.4148
41	A	B	-0.8148
42	K	B	-1.8768
43	L	B	-1.8532
44	Q	B	-2.8119
45	E	B	-3.1686
46	V	B	-1.4477
47	E	B	-2.4413
48	E	B	-2.4409
49	L	B	0.2472
50	L	B	0.7668