Project name: query_structure

Chain sequence(s)	A: EAMHSFCAFKAETGPCRARFDRWFFNIFTRQCEEFIYGGCEGNQNRFESLEECKKMCTRD
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]                                                (00:00:00)
[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 A 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                                          (00:00:36)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:37)

• Minimal score value: -3.3657
• Maximal score value: 1.6336
• Average score: -1.3003
• Total score value: -78.0155

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	E	A	-1.9463
2	A	A	-0.9427
3	M	A	-0.5257
4	H	A	-0.4304
5	S	A	0.1314
6	F	A	0.3483
7	C	A	0.0000
8	A	A	0.5652
9	F	A	0.1846
10	K	A	-1.4514
11	A	A	0.0000
12	E	A	-2.0830
13	T	A	-1.4882
14	G	A	-1.4136
15	P	A	-1.1053
16	C	A	-1.2529
17	R	A	-2.0384
18	A	A	-1.6228
19	R	A	-2.1248
20	F	A	-1.2159
21	D	A	-2.4744
22	R	A	-2.1079
23	W	A	-2.0392
24	F	A	-1.3415
25	F	A	0.0000
26	N	A	-0.3989
27	I	A	0.9484
28	F	A	1.6336
29	T	A	-0.1623
30	R	A	-1.4916
31	Q	A	-2.0080
32	C	A	-1.9453
33	E	A	-1.7404
34	E	A	-2.5359
35	F	A	-1.3338
36	I	A	-1.0914
37	Y	A	0.0000
38	G	A	0.0000
39	G	A	-1.0692
40	C	A	-1.0530
41	E	A	-2.1967
42	G	A	-2.1801
43	N	A	-1.5846
44	Q	A	-1.6810
45	N	A	0.0000
46	R	A	-1.9580
47	F	A	0.0000
48	E	A	-2.7695
49	S	A	-2.5297
50	L	A	-2.1554
51	E	A	-3.2041
52	E	A	-3.0589
53	C	A	0.0000
54	K	A	-3.3657
55	K	A	-3.3229
56	M	A	-1.5335
57	C	A	0.0000
58	T	A	-2.5842
59	R	A	-2.6509
60	D	A	-2.6176