Project name: A?16-22_2

Chain sequence(s)	A: KLVFFAE; B: KLVFFAE
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]                                                (00:00:00)
[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 all 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                                          (00:00:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:07)

• Minimal score value: -0.9973
• Maximal score value: 3.8946
• Average score: 1.7201
• Total score value: 24.0817

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	K	A	-0.5793
2	L	A	2.3517
3	V	A	3.5136
4	F	A	3.8946
5	F	A	3.0515
6	A	A	0.8116
7	E	A	-0.9784
1	K	B	-0.5841
2	L	B	2.3204
3	V	B	3.5113
4	F	B	3.8899
5	F	B	3.0469
6	A	B	0.8293
7	E	B	-0.9973