Project name: a3full

Chain sequence(s)	A: MEFVAKLFKFFKDLLGKFLGNN
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                                          (00:00:25)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:25)

• Minimal score value: -2.0747
• Maximal score value: 1.7656
• Average score: 0.03
• Total score value: 0.6595

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	A	0.6696
2	E	A	-0.7352
3	F	A	1.0397
4	V	A	1.0718
5	A	A	-0.1112
6	K	A	-0.8715
7	L	A	0.9228
8	F	A	1.4536
9	K	A	-0.8408
10	F	A	1.0466
11	F	A	0.8509
12	K	A	-1.1965
13	D	A	-1.3109
14	L	A	0.3961
15	L	A	1.1474
16	G	A	-0.4453
17	K	A	-1.0551
18	F	A	1.7656
19	L	A	1.3577
20	G	A	-0.4125
21	N	A	-2.0086
22	N	A	-2.0747