Project name: jn1rbd

Chain sequence(s)	A: WSEEEEWELAMKLHELMWKLYHEARKTVPNPDTEEGHYKVHEIAMTKFIPESRKLKEEMA
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:09)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:09)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:09)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:09)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:09)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:54)

• Minimal score value: -4.1663
• Maximal score value: 0.0724
• Average score: -1.8625
• Total score value: -111.7519

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	W	A	-0.5017
2	S	A	-1.9591
3	E	A	-3.4266
4	E	A	-3.7110
5	E	A	-3.4123
6	E	A	-3.3972
7	W	A	-1.7393
8	E	A	-2.4719
9	L	A	0.0000
10	A	A	-1.3371
11	M	A	-0.9427
12	K	A	-1.6985
13	L	A	-0.9401
14	H	A	-1.4214
15	E	A	-1.9763
16	L	A	-1.2084
17	M	A	-0.7384
18	W	A	-0.7525
19	K	A	-2.1040
20	L	A	0.0000
21	Y	A	-1.6355
22	H	A	-2.5110
23	E	A	-2.7877
24	A	A	0.0000
25	R	A	-3.1308
26	K	A	-2.9522
27	T	A	-1.8491
28	V	A	0.0000
29	P	A	-2.0645
30	N	A	-2.9621
31	P	A	-3.1214
32	D	A	-3.1977
33	T	A	-2.7648
34	E	A	-3.3561
35	E	A	-3.3069
36	G	A	0.0000
37	H	A	-2.7464
38	Y	A	-1.2956
39	K	A	-2.3369
40	V	A	0.0000
41	H	A	-1.5030
42	E	A	-2.0067
43	I	A	-0.9595
44	A	A	0.0000
45	M	A	-0.2410
46	T	A	-0.4685
47	K	A	-0.6426
48	F	A	-0.1890
49	I	A	0.0724
50	P	A	-1.1986
51	E	A	-2.0935
52	S	A	0.0000
53	R	A	-3.7108
54	K	A	-4.1365
55	L	A	-3.1673
56	K	A	-4.0330
57	E	A	-4.1663
58	E	A	-3.5725
59	M	A	-2.2142
60	A	A	-1.7641