Project name: d3264a1b8df19aa

Chain sequence(s)	B: MEELMKMKEEFKKKKSEFEKLAPVEQMKKLTEVAKEIKQKVEEIEARLAA
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                                          (00:02:46)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:47)

• Minimal score value: -4.7364
• Maximal score value: 1.1962
• Average score: -2.2701
• Total score value: -113.5046

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	0.1399
2	E	B	-1.8183
3	E	B	-1.7155
4	L	B	-0.9474
5	M	B	-1.2220
6	K	B	-3.1787
7	M	B	0.0000
8	K	B	-3.1941
9	E	B	-4.3854
10	E	B	-4.5413
11	F	B	-3.5849
12	K	B	-4.7364
13	K	B	-4.6787
14	K	B	-4.5466
15	K	B	-4.1216
16	S	B	-3.4309
17	E	B	-4.0700
18	F	B	0.0000
19	E	B	-3.5999
20	K	B	-3.1086
21	L	B	-1.1932
22	A	B	-0.2723
23	P	B	-0.1251
24	V	B	1.1962
25	E	B	-0.6959
26	Q	B	-1.3946
27	M	B	0.1344
28	K	B	-1.8069
29	K	B	-2.0840
30	L	B	-1.4370
31	T	B	-2.0974
32	E	B	-3.4968
33	V	B	0.0000
34	A	B	-2.7127
35	K	B	-4.1052
36	E	B	-4.1763
37	I	B	-3.0513
38	K	B	-4.1082
39	Q	B	-4.1588
40	K	B	-3.2372
41	V	B	-2.8638
42	E	B	-3.9717
43	E	B	-3.2229
44	I	B	0.0000
45	E	B	-2.8290
46	A	B	-2.0222
47	R	B	-2.1008
48	L	B	-0.2730
49	A	B	-0.3504
50	A	B	-0.3081