Project name: 7fefaac04f4308e

Chain sequence(s)	B: MAFMDELMARLKALKAVLEKLEELLSPEQAAKAREKFAEIEAKVEEIMAS
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                                          (00:01:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:55)

• Minimal score value: -4.728
• Maximal score value: 1.4736
• Average score: -1.6489
• Total score value: -82.4451

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	M	B	1.1466
2	A	B	0.6295
3	F	B	1.4736
4	M	B	0.2258
5	D	B	-1.4727
6	E	B	-1.7276
7	L	B	-1.1162
8	M	B	-1.6585
9	A	B	-1.8955
10	R	B	-2.5722
11	L	B	0.0000
12	K	B	-2.0895
13	A	B	-0.8331
14	L	B	-0.0533
15	K	B	-1.4121
16	A	B	-0.7512
17	V	B	0.3900
18	L	B	-0.8496
19	E	B	-2.1897
20	K	B	-1.9161
21	L	B	-0.6145
22	E	B	-2.1826
23	E	B	-1.8765
24	L	B	0.2487
25	L	B	-0.3713
26	S	B	-1.0978
27	P	B	-1.8018
28	E	B	-3.0997
29	Q	B	-2.7921
30	A	B	0.0000
31	A	B	-3.2803
32	K	B	-4.3220
33	A	B	-3.6803
34	R	B	-4.7097
35	E	B	-4.7280
36	K	B	-4.2175
37	F	B	0.0000
38	A	B	-3.1782
39	E	B	-3.6896
40	I	B	-2.5312
41	E	B	-3.1143
42	A	B	-2.7522
43	K	B	-3.0174
44	V	B	0.0000
45	E	B	-3.0821
46	E	B	-2.8270
47	I	B	-0.9098
48	M	B	-0.7261
49	A	B	-0.9033
50	S	B	-0.5167