Project name: FTGHKTF4

Chain sequence(s)	A: FTGHKTF; C: FTGHKTF; B: FTGHKTF; D: FTGHKTF
Selected Chain(s)	A,C,B,D
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                                          (00:02:33)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:34)

• Minimal score value: -1.6506
• Maximal score value: 3.3813
• Average score: 0.3022
• Total score value: 8.4627

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	1.5912
2	T	A	0.3430
3	G	A	-0.0692
4	H	A	-0.8011
5	K	A	-0.5920
6	T	A	-0.0869
7	F	A	1.6531
1	F	B	3.3813
2	T	B	0.6612
3	G	B	-0.5432
4	H	B	-1.1825
5	K	B	-1.6506
6	T	B	0.0280
7	F	B	2.1878
1	F	C	3.2992
2	T	C	0.0000
3	G	C	0.0000
4	H	C	-1.1197
5	K	C	-0.7766
6	T	C	0.1623
7	F	C	2.4831
1	F	D	1.6420
2	T	D	-0.0241
3	G	D	-1.1533
4	H	D	-1.2192
5	K	D	-1.2175
6	T	D	0.2536
7	F	D	1.2128