Project name: KGHKGHG12

Chain sequence(s)	A: KGHKGHG; C: KGHKGHG; B: KGHKGHG; E: KGHKGHG; D: KGHKGHG; G: KGHKGHG; F: KGHKGHG; I: KGHKGHG; H: KGHKGHG; K: KGHKGHG; J: KGHKGHG; L: KGHKGHG
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                                          (00:03:44)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:47)

• Minimal score value: -4.2739
• Maximal score value: 0.0
• Average score: -2.9583
• Total score value: -248.4951

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	-3.8163
2	G	A	0.0000
3	H	A	-3.8422
4	K	A	-3.9007
5	G	A	-2.8311
6	H	A	-2.9945
7	G	A	-2.8946
1	K	B	-2.9485
2	G	B	-3.3453
3	H	B	-3.5573
4	K	B	-4.0618
5	G	B	-3.3923
6	H	B	-3.6836
7	G	B	-3.2743
1	K	C	-2.8600
2	G	C	-2.6443
3	H	C	-3.2743
4	K	C	-4.0485
5	G	C	-3.4498
6	H	C	-4.1864
7	G	C	-3.4540
1	K	D	-2.9107
2	G	D	-2.9348
3	H	D	-3.2712
4	K	D	-3.7449
5	G	D	0.0000
6	H	D	-3.3778
7	G	D	-3.6723
1	K	E	-2.7123
2	G	E	-3.0558
3	H	E	-3.9938
4	K	E	-4.2739
5	G	E	-3.3465
6	H	E	-3.2376
7	G	E	-2.4755
1	K	F	-2.9300
2	G	F	-3.4107
3	H	F	-3.7140
4	K	F	-3.7750
5	G	F	-3.0961
6	H	F	-2.3088
7	G	F	-2.2368
1	K	G	-3.7302
2	G	G	0.0000
3	H	G	-3.1620
4	K	G	-3.3744
5	G	G	-2.7186
6	H	G	-2.8311
7	G	G	-2.7530
1	K	H	-3.3631
2	G	H	-3.1393
3	H	H	0.0000
4	K	H	-3.2251
5	G	H	0.0000
6	H	H	-2.2332
7	G	H	-1.8166
1	K	I	-3.7682
2	G	I	-3.1245
3	H	I	-2.9468
4	K	I	-3.3156
5	G	I	-2.6380
6	H	I	-2.7355
7	G	I	-3.1003
1	K	J	-2.7478
2	G	J	-2.5940
3	H	J	-3.6530
4	K	J	-3.8324
5	G	J	-3.4837
6	H	J	-3.6356
7	G	J	0.0000
1	K	K	-2.8487
2	G	K	-2.9760
3	H	K	-3.6110
4	K	K	-3.9831
5	G	K	0.0000
6	H	K	-2.7978
7	G	K	-2.5743
1	K	L	-3.2924
2	G	L	-3.4143
3	H	L	-3.7658
4	K	L	-3.3108
5	G	L	-2.7388
6	H	L	-3.0363
7	G	L	-3.2855