Project name: VQIVY

Chain sequence(s)	A: VQIIVYK; B: VQIVYK
Selected Chain(s)	A,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 all 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                                          (00:00:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:09)

• Minimal score value: -0.6204
• Maximal score value: 2.5937
• Average score: 1.344
• Total score value: 16.1278

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	V	A	1.6757
2	Q	A	0.7177
3	I	A	2.5937
4	V	A	2.3528
5	Y	A	1.6541
6	K	A	-0.6204
1	V	B	1.6511
2	Q	B	0.5995
3	I	B	2.1742
4	V	B	2.2206
5	Y	B	1.5981
6	K	B	-0.4893