Project name: KGHKGHK12

Chain sequence(s)	A: KGHKGHK; C: KGHKGHK; B: KGHKGHK; E: KGHKGHK; D: KGHKGHK; G: KGHKGHK; F: KGHKGHK; I: KGHKGHK; H: KGHKGHK; K: KGHKGHK; J: KGHKGHK; L: KGHKGHK
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:05:28)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:30)

• Minimal score value: -5.3487
• Maximal score value: 0.0
• Average score: -3.4258
• Total score value: -287.7704

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	-3.6951
2	G	A	-3.6678
3	H	A	-3.8412
4	K	A	-4.6582
5	G	A	-4.0219
6	H	A	-3.3582
7	K	A	-3.0731
1	K	B	-3.2291
2	G	B	0.0000
3	H	B	-3.6236
4	K	B	-4.5889
5	G	B	0.0000
6	H	B	-3.2650
7	K	B	-3.9782
1	K	C	-2.7406
2	G	C	-3.1764
3	H	C	-3.1708
4	K	C	-3.8503
5	G	C	-2.9705
6	H	C	-2.6054
7	K	C	-2.8041
1	K	D	-3.1777
2	G	D	-2.8830
3	H	D	-3.3981
4	K	D	-4.2756
5	G	D	-3.3291
6	H	D	-2.9044
7	K	D	-2.6877
1	K	E	-2.8560
2	G	E	-2.4799
3	H	E	-3.4521
4	K	E	-4.0469
5	G	E	-3.4249
6	H	E	-3.3291
7	K	E	-2.6715
1	K	F	-2.9835
2	G	F	-2.8477
3	H	F	-3.3771
4	K	F	-3.7955
5	G	F	-3.0367
6	H	F	-3.3091
7	K	F	-3.0954
1	K	G	-4.3206
2	G	G	-3.7077
3	H	G	-3.3919
4	K	G	-4.2287
5	G	G	-3.4716
6	H	G	-3.7894
7	K	G	-3.8551
1	K	H	-3.1304
2	G	H	-2.5058
3	H	H	-3.3952
4	K	H	-3.8404
5	G	H	-3.4780
6	H	H	-3.6883
7	K	H	-4.2341
1	K	I	-3.3447
2	G	I	-3.1778
3	H	I	-3.1116
4	K	I	-3.9986
5	G	I	-3.6349
6	H	I	-3.3375
7	K	I	-2.9027
1	K	J	-3.3239
2	G	J	-3.3961
3	H	J	-2.9898
4	K	J	-4.1124
5	G	J	-4.2141
6	H	J	-5.3399
7	K	J	-4.5702
1	K	K	-3.3610
2	G	K	-3.9849
3	H	K	-4.1863
4	K	K	-5.3487
5	G	K	0.0000
6	H	K	-4.9548
7	K	K	-5.1939
1	K	L	-5.0462
2	G	L	0.0000
3	H	L	-4.5145
4	K	L	-5.3430
5	G	L	-3.5716
6	H	L	-3.2633
7	K	L	-2.8314