Project name: 6444955b29f46fe

Chain sequence(s)	B: ALRAALDAVMKELKAFKERHKKEGTPALEALKELIKIAEKAGEAKKALAA
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                                          (00:02:32)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:32)

• Minimal score value: -4.8107
• Maximal score value: 0.9533
• Average score: -1.8707
• Total score value: -93.5345

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	A	B	-0.3681
2	L	B	-1.1278
3	R	B	-2.0531
4	A	B	-1.0832
5	A	B	-1.4396
6	L	B	-1.8097
7	D	B	-2.2138
8	A	B	-1.7777
9	V	B	0.0000
10	M	B	-1.0897
11	K	B	-2.7427
12	E	B	-2.4290
13	L	B	-2.1509
14	K	B	-3.0847
15	A	B	-2.8000
16	F	B	0.0000
17	K	B	-3.7802
18	E	B	-4.3074
19	R	B	-4.8107
20	H	B	-4.2968
21	K	B	-4.4924
22	K	B	-4.6781
23	E	B	-4.3256
24	G	B	-2.8925
25	T	B	-1.9017
26	P	B	-0.2391
27	A	B	0.3645
28	L	B	0.9533
29	E	B	-0.6593
30	A	B	0.0000
31	L	B	0.9116
32	K	B	-1.1368
33	E	B	-1.4287
34	L	B	-0.3045
35	I	B	-0.2946
36	K	B	-2.1677
37	I	B	0.0000
38	A	B	-1.4795
39	E	B	-3.2472
40	K	B	-3.2077
41	A	B	-2.4500
42	G	B	-3.1638
43	E	B	-3.7622
44	A	B	0.0000
45	K	B	-3.4103
46	K	B	-3.0620
47	A	B	-1.5413
48	L	B	-1.0987
49	A	B	-0.9876
50	A	B	-0.4675