Project name: FTGHKT12

Chain sequence(s)	A: FTGHKTF; C: FTGHKTF; B: FTGHKTF; E: FTGHKTF; D: FTGHKTF; G: FTGHKTF; F: FTGHKTF; I: FTGHKTF; H: FTGHKTF; K: FTGHKTF; J: FTGHKTF; L: FTGHKTF
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,L
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                                          (00:04:40)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:44)

• Minimal score value: -1.2643
• Maximal score value: 2.8728
• Average score: 0.7525
• Total score value: 63.2123

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	1.7714
2	T	A	0.0000
3	G	A	0.0000
4	H	A	0.0000
5	K	A	-0.2471
6	T	A	0.8761
7	F	A	2.3516
1	F	B	2.4181
2	T	B	0.7003
3	G	B	0.0000
4	H	B	0.0000
5	K	B	0.0291
6	T	B	0.7516
7	F	B	2.0344
1	F	C	2.7097
2	T	C	1.2492
3	G	C	0.0000
4	H	C	0.0000
5	K	C	0.2563
6	T	C	0.3887
7	F	C	1.8930
1	F	D	0.0000
2	T	D	0.0000
3	G	D	0.0000
4	H	D	-0.3902
5	K	D	0.8535
6	T	D	1.6322
7	F	D	2.7221
1	F	E	2.3941
2	T	E	0.9501
3	G	E	-0.2443
4	H	E	0.0000
5	K	E	-1.2278
6	T	E	0.0000
7	F	E	2.5173
1	F	F	1.6844
2	T	F	0.0000
3	G	F	-0.9532
4	H	F	-1.2643
5	K	F	-0.8232
6	T	F	1.1451
7	F	F	2.2811
1	F	G	2.4001
2	T	G	1.1234
3	G	G	-0.2990
4	H	G	0.0000
5	K	G	-1.0939
6	T	G	0.0000
7	F	G	2.8728
1	F	H	2.7226
2	T	H	0.0000
3	G	H	-0.1419
4	H	H	0.0000
5	K	H	0.0248
6	T	H	1.8706
7	F	H	2.6312
1	F	I	1.8201
2	T	I	0.4450
3	G	I	-0.6226
4	H	I	0.0000
5	K	I	-0.7025
6	T	I	1.1374
7	F	I	2.2843
1	F	J	2.3321
2	T	J	0.0000
3	G	J	-0.0374
4	H	J	0.0000
5	K	J	-0.4991
6	T	J	0.7303
7	F	J	1.9712
1	F	K	2.1542
2	T	K	1.0824
3	G	K	0.0000
4	H	K	0.0000
5	K	K	0.8777
6	T	K	1.1650
7	F	K	2.0641
1	F	L	0.8048
2	T	L	0.0000
3	G	L	0.0000
4	H	L	0.0000
5	K	L	1.3637
6	T	L	1.6825
7	F	L	2.5891