Project name: b01aa660e1ef04d

Chain sequence(s)	B: SAELREMIERMERAIAIAKRFAAEHPELAPLLAEAAAKYAALKERLEKTM
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                                          (00:01:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:12)

• Minimal score value: -4.2835
• Maximal score value: 0.8442
• Average score: -1.6507
• Total score value: -82.5331

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	-1.1670
2	A	B	-1.7896
3	E	B	-2.8589
4	L	B	-2.3209
5	R	B	-3.5213
6	E	B	-3.7520
7	M	B	-2.7088
8	I	B	0.0000
9	E	B	-4.2835
10	R	B	-3.9761
11	M	B	-2.4539
12	E	B	-3.2578
13	R	B	-3.0778
14	A	B	-1.7049
15	I	B	-1.3682
16	A	B	-1.2242
17	I	B	0.1616
18	A	B	0.0000
19	K	B	-1.8103
20	R	B	-1.8154
21	F	B	-0.1466
22	A	B	-0.8538
23	A	B	-1.5466
24	E	B	-2.3674
25	H	B	-1.8386
26	P	B	-1.1879
27	E	B	-1.7745
28	L	B	-0.2442
29	A	B	-0.7344
30	P	B	-0.1523
31	L	B	0.8442
32	L	B	-0.0557
33	A	B	-0.5737
34	E	B	-1.6945
35	A	B	-1.0005
36	A	B	0.0000
37	A	B	-0.8984
38	K	B	-1.7640
39	Y	B	-1.1602
40	A	B	-1.2261
41	A	B	-1.2839
42	L	B	-1.1569
43	K	B	-2.6016
44	E	B	-3.3853
45	R	B	-3.1648
46	L	B	-2.1307
47	E	B	-2.9573
48	K	B	-2.9048
49	T	B	-1.3320
50	M	B	-0.3116