Project name: 160dd342014c8aa

Chain sequence(s)	B: LAEVKAFVDGMKAAMKIAKRMAEVDGNKEMLEKTEEKQKKIEEKGKKILA
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                                          (00:02:47)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:47)

• Minimal score value: -5.0969
• Maximal score value: 1.1332
• Average score: -2.0994
• Total score value: -104.9677

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	L	B	1.1332
2	A	B	-0.1320
3	E	B	-1.2746
4	V	B	-0.0276
5	K	B	-1.2353
6	A	B	-0.9316
7	F	B	0.2433
8	V	B	0.0000
9	D	B	-2.3096
10	G	B	-1.0455
11	M	B	-0.8671
12	K	B	-1.6598
13	A	B	-0.7216
14	A	B	-0.5042
15	M	B	0.0000
16	K	B	-1.1049
17	I	B	0.5377
18	A	B	-0.1701
19	K	B	-1.8135
20	R	B	-1.7303
21	M	B	-0.4993
22	A	B	0.0000
23	E	B	-2.3899
24	V	B	-0.5498
25	D	B	-2.2560
26	G	B	-2.4153
27	N	B	-3.1372
28	K	B	-4.1447
29	E	B	-3.8562
30	M	B	-3.3540
31	L	B	-3.9336
32	E	B	-4.7288
33	K	B	-4.6662
34	T	B	0.0000
35	E	B	-4.6422
36	E	B	-5.0969
37	K	B	-4.9167
38	Q	B	-4.7584
39	K	B	-5.0361
40	K	B	-5.0487
41	I	B	-3.9440
42	E	B	-4.5798
43	E	B	-4.9212
44	K	B	-3.9138
45	G	B	0.0000
46	K	B	-3.6635
47	K	B	-3.0091
48	I	B	-0.9333
49	L	B	-0.3936
50	A	B	-0.5659