Project name: 5d4427c611e30e1

Chain sequence(s)	B: SSLLAEELERRRNAELEAQLSAALQQDQQDGTYVWQVDGEVVARHLVRRA
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                                          (00:00:45)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:45)

• Minimal score value: -5.2761
• Maximal score value: 1.566
• Average score: -1.6527
• Total score value: -82.6368

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	0.3364
2	S	B	0.4574
3	L	B	1.5660
4	L	B	1.1666
5	A	B	-0.5760
6	E	B	-2.2125
7	E	B	-2.3635
8	L	B	-2.4386
9	E	B	-4.6511
10	R	B	-4.9952
11	R	B	-5.2761
12	R	B	-5.2051
13	N	B	-4.4436
14	A	B	-3.7387
15	E	B	-4.1019
16	L	B	-2.4862
17	E	B	-2.9437
18	A	B	-1.9910
19	Q	B	-1.9231
20	L	B	-1.0362
21	S	B	-1.3567
22	A	B	-1.1815
23	A	B	-1.2730
24	L	B	-1.4994
25	Q	B	-2.3751
26	Q	B	-2.4057
27	D	B	-2.5721
28	Q	B	-3.1007
29	Q	B	-3.1033
30	D	B	-2.3287
31	G	B	-1.0737
32	T	B	-0.3354
33	Y	B	0.3779
34	V	B	0.6396
35	W	B	0.4061
36	Q	B	-0.7746
37	V	B	-0.2660
38	D	B	-2.0327
39	G	B	-1.8180
40	E	B	-1.6903
41	V	B	-0.0926
42	V	B	1.1482
43	A	B	0.1198
44	R	B	-1.0371
45	H	B	-0.9281
46	L	B	-0.0214
47	V	B	-1.2139
48	R	B	-2.5367
49	R	B	-2.3736
50	A	B	-1.0820