Project name: a447e67eb4820bc

Chain sequence(s)	B: LAALEEMKKRMEEAIKIMKKMAELASPEVVKKAEEFAKELKKRFEEIVAA
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                                          (00:03:11)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:12)

• Minimal score value: -4.5192
• Maximal score value: 1.2545
• Average score: -1.9151
• Total score value: -95.7561

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	1.2545
2	A	B	0.1117
3	A	B	-0.2466
4	L	B	-0.5236
5	E	B	-2.1776
6	E	B	-2.6787
7	M	B	-1.9982
8	K	B	-3.4477
9	K	B	-4.2868
10	R	B	-4.2497
11	M	B	-2.9768
12	E	B	-3.5196
13	E	B	-3.7272
14	A	B	-2.1387
15	I	B	0.0000
16	K	B	-2.7047
17	I	B	-0.8700
18	M	B	-0.4956
19	K	B	-2.0530
20	K	B	-1.4904
21	M	B	0.2454
22	A	B	0.0000
23	E	B	-1.5852
24	L	B	0.6790
25	A	B	0.0711
26	S	B	-0.8704
27	P	B	-1.7559
28	E	B	-2.9242
29	V	B	-1.7714
30	V	B	-2.2296
31	K	B	-3.5297
32	K	B	-3.1466
33	A	B	0.0000
34	E	B	-2.8888
35	E	B	-2.6130
36	F	B	-0.9090
37	A	B	0.0000
38	K	B	-3.5560
39	E	B	-3.6234
40	L	B	-2.5743
41	K	B	-3.6947
42	K	B	-4.5192
43	R	B	-4.2196
44	F	B	-2.7840
45	E	B	-3.6617
46	E	B	-3.1319
47	I	B	-0.9086
48	V	B	-0.6678
49	A	B	-0.7496
50	A	B	-0.2183