Project name: 1_rank

Chain sequence(s)	B: MIDVSKFSIQERQVLVYEIMREVEENPHDPRLKGVSWYMLDRMMMYPEDEENIKRLEELLNG
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:31)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:31)

• Minimal score value: -3.7446
• Maximal score value: 1.0322
• Average score: -1.1527
• Total score value: -71.4655

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	0.9346
2	I	B	0.1165
3	D	B	-1.3838
4	V	B	0.0000
5	S	B	-1.8601
6	K	B	-1.8438
7	F	B	-1.1459
8	S	B	-1.0188
9	I	B	-0.4067
10	Q	B	-1.3659
11	E	B	-1.2262
12	R	B	-0.6167
13	Q	B	-0.0088
14	V	B	0.7923
15	L	B	0.6179
16	V	B	0.0000
17	Y	B	0.8631
18	E	B	0.1160
19	I	B	0.0000
20	M	B	-0.5223
21	R	B	-1.9110
22	E	B	-2.5208
23	V	B	-2.6068
24	E	B	-3.5065
25	E	B	-3.7446
26	N	B	-3.3161
27	P	B	-2.6469
28	H	B	-2.6445
29	D	B	0.0000
30	P	B	-2.2079
31	R	B	-2.9468
32	L	B	-2.3424
33	K	B	-2.6693
34	G	B	-1.4806
35	V	B	-0.3069
36	S	B	0.3698
37	W	B	0.9564
38	Y	B	1.0322
39	M	B	0.1104
40	L	B	0.0000
41	D	B	-0.7597
42	R	B	-0.5612
43	M	B	0.0000
44	M	B	0.4208
45	M	B	0.5164
46	Y	B	0.2274
47	P	B	0.0000
48	E	B	-2.2645
49	D	B	-2.9715
50	E	B	-3.7342
51	E	B	-3.4972
52	N	B	0.0000
53	I	B	-3.0243
54	K	B	-3.6986
55	R	B	-2.7000
56	L	B	0.0000
57	E	B	-2.2267
58	E	B	-2.9090
59	L	B	0.0000
60	L	B	-0.9286
61	N	B	-1.1681
62	G	B	-1.8456