Project name: 90a6dcb85af87d8

Chain sequence(s)	B: LMDEIMKLTEEIKKAMEEAYKLLQEDPEKAEEELKKVKELSAELQKLFDA
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                                          (00:02:33)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:33)

• Minimal score value: -4.6695
• Maximal score value: 1.347
• Average score: -2.2552
• Total score value: -112.759

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	1.3470
2	M	B	0.6518
3	D	B	-1.5096
4	E	B	-1.7065
5	I	B	-0.4679
6	M	B	-0.7742
7	K	B	-2.7471
8	L	B	-2.2132
9	T	B	-2.2049
10	E	B	-3.6325
11	E	B	-3.3005
12	I	B	-3.0712
13	K	B	-3.9539
14	K	B	-3.8512
15	A	B	0.0000
16	M	B	-2.3242
17	E	B	-2.7110
18	E	B	-2.7298
19	A	B	0.0000
20	Y	B	-0.6564
21	K	B	-2.2312
22	L	B	-2.6100
23	L	B	-1.3178
24	Q	B	-1.8321
25	E	B	-2.9178
26	D	B	-2.7678
27	P	B	-2.7561
28	E	B	-3.8945
29	K	B	-4.4813
30	A	B	0.0000
31	E	B	-3.9417
32	E	B	-4.6695
33	E	B	-3.6722
34	L	B	-2.8636
35	K	B	-4.0259
36	K	B	-3.4534
37	V	B	-3.3456
38	K	B	-3.5164
39	E	B	-3.6147
40	L	B	-2.8509
41	S	B	-2.3449
42	A	B	-2.2894
43	E	B	-2.5754
44	L	B	-1.7306
45	Q	B	-2.1216
46	K	B	-2.4967
47	L	B	-0.5761
48	F	B	0.3444
49	D	B	-1.7799
50	A	B	-0.5710