Project name: FEFEFKFK_8

Chain sequence(s)	A: FEFEFKFK; C: FEFEFKFK; B: FEFEFKFK; E: FEFEFKFK; D: FEFEFKFK; G: FEFEFKFK; F: FEFEFKFK; H: FEFEFKFK
Selected Chain(s)	A,C,B,E,D,G,F,H
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                                          (00:10:24)
[INFO]       Main:     Simulation completed successfully.                                          (00:10:26)

• Minimal score value: -2.9473
• Maximal score value: 1.6027
• Average score: -0.417
• Total score value: -26.6877

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	F	A	0.5043
2	E	A	-1.2199
3	F	A	-0.4102
4	E	A	-1.7114
5	F	A	0.0000
6	K	A	-2.9473
7	F	A	-1.5637
8	K	A	-2.1115
1	F	B	0.5914
2	E	B	-1.6987
3	F	B	-1.5997
4	E	B	-2.7342
5	F	B	-1.7179
6	K	B	-2.0087
7	F	B	-0.8351
8	K	B	-1.7328
1	F	C	1.3536
2	E	C	-0.1563
3	F	C	1.0935
4	E	C	-0.4006
5	F	C	0.8124
6	K	C	-0.5592
7	F	C	0.5271
8	K	C	-0.9511
1	F	D	0.1334
2	E	D	-1.1982
3	F	D	0.4624
4	E	D	0.8967
5	F	D	1.2031
6	K	D	0.1687
7	F	D	-0.7068
8	K	D	-1.7363
1	F	E	1.4157
2	E	E	-0.2715
3	F	E	0.7776
4	E	E	-0.1537
5	F	E	0.0653
6	K	E	-1.7400
7	F	E	0.3837
8	K	E	-1.2640
1	F	F	1.4457
2	E	F	-0.3826
3	F	F	0.9044
4	E	F	-0.3777
5	F	F	0.4713
6	K	F	-0.6334
7	F	F	0.5071
8	K	F	-1.0910
1	F	G	1.5352
2	E	G	-0.2640
3	F	G	1.6027
4	E	G	-0.2364
5	F	G	0.0913
6	K	G	-2.0630
7	F	G	0.0000
8	K	G	-2.0615
1	F	H	0.0000
2	E	H	-1.8650
3	F	H	-0.8845
4	E	H	-1.6989
5	F	H	0.4080
6	K	H	-1.0690
7	F	H	0.9363
8	K	H	-0.9228