Project name: GKGHKGH20

Chain sequence(s)	A: GKGHKGH; C: GKGHKGH; B: GKGHKGH; E: GKGHKGH; D: GKGHKGH; G: GKGHKGH; F: GKGHKGH; I: GKGHKGH; H: GKGHKGH; K: GKGHKGH; J: GKGHKGH; M: GKGHKGH; L: GKGHKGH; O: GKGHKGH; N: GKGHKGH; Q: GKGHKGH; P: GKGHKGH; S: GKGHKGH; R: GKGHKGH; T: GKGHKGH
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:07:26)
[INFO]       Main:     Simulation completed successfully.                                          (00:07:31)

• Minimal score value: -6.032
• Maximal score value: 0.0
• Average score: -3.4055
• Total score value: -476.7647

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	G	A	-2.7870
2	K	A	-3.6891
3	G	A	-4.1050
4	H	A	-3.9253
5	K	A	-4.3567
6	G	A	0.0000
7	H	A	-3.6582
1	G	B	-2.4980
2	K	B	-3.5383
3	G	B	-3.7858
4	H	B	-4.1100
5	K	B	-4.3778
6	G	B	-3.5373
7	H	B	-3.9194
1	G	C	-3.0555
2	K	C	-3.4670
3	G	C	-3.4662
4	H	C	-2.8665
5	K	C	-3.9541
6	G	C	-2.7935
7	H	C	-2.7087
1	G	D	-4.0291
2	K	D	-4.4285
3	G	D	0.0000
4	H	D	-4.0073
5	K	D	-4.0168
6	G	D	-2.7747
7	H	D	-2.9244
1	G	E	-3.6531
2	K	E	-4.8996
3	G	E	0.0000
4	H	E	-3.7268
5	K	E	-4.5531
6	G	E	-3.1577
7	H	E	-2.8480
1	G	F	-1.6822
2	K	F	-3.1986
3	G	F	-2.8206
4	H	F	-3.7956
5	K	F	-4.2948
6	G	F	-3.2050
7	H	F	-3.9867
1	G	G	-1.6005
2	K	G	-2.6490
3	G	G	-2.4826
4	H	G	-2.8138
5	K	G	-2.9515
6	G	G	-2.1084
7	H	G	-1.6612
1	G	H	-4.0238
2	K	H	-4.8788
3	G	H	-3.7239
4	H	H	-3.7588
5	K	H	-3.8573
6	G	H	-2.5252
7	H	H	-3.2461
1	G	I	-2.8003
2	K	I	-3.5852
3	G	I	-3.4789
4	H	I	-4.1629
5	K	I	-4.7581
6	G	I	-4.1340
7	H	I	-3.7199
1	G	J	-4.0625
2	K	J	-4.3986
3	G	J	-3.9163
4	H	J	-3.8985
5	K	J	-3.9128
6	G	J	-2.8129
7	H	J	-3.5552
1	G	K	-3.6320
2	K	K	-3.9732
3	G	K	-3.6750
4	H	K	-4.1715
5	K	K	-4.5407
6	G	K	-4.0877
7	H	K	-4.1732
1	G	L	-2.5143
2	K	L	-3.1430
3	G	L	-3.0475
4	H	L	-3.5375
5	K	L	-4.3023
6	G	L	-3.6722
7	H	L	-3.9847
1	G	M	-3.2452
2	K	M	-3.5139
3	G	M	-4.4823
4	H	M	-4.8797
5	K	M	-4.8064
6	G	M	0.0000
7	H	M	-4.5416
1	G	N	-2.7241
2	K	N	-3.5116
3	G	N	0.0000
4	H	N	-3.8155
5	K	N	-3.7289
6	G	N	-3.5367
7	H	N	-3.3732
1	G	O	-2.4851
2	K	O	-3.9218
3	G	O	-3.7802
4	H	O	-4.1458
5	K	O	-3.5998
6	G	O	-2.5529
7	H	O	-3.0056
1	G	P	-2.8049
2	K	P	-3.7923
3	G	P	-3.6871
4	H	P	-4.2977
5	K	P	-4.3192
6	G	P	-3.0049
7	H	P	-2.5429
1	G	Q	0.0000
2	K	Q	-6.0320
3	G	Q	0.0000
4	H	Q	-3.8215
5	K	Q	-4.2122
6	G	Q	-2.8997
7	H	Q	-3.4914
1	G	R	-3.9444
2	K	R	-4.8691
3	G	R	0.0000
4	H	R	-4.5946
5	K	R	-4.8907
6	G	R	-3.7975
7	H	R	-3.0337
1	G	S	-2.6346
2	K	S	-3.8284
3	G	S	-3.5472
4	H	S	-4.6674
5	K	S	-4.2525
6	G	S	-4.2301
7	H	S	-3.6561
1	G	T	-2.7227
2	K	T	-3.2100
3	G	T	-3.5220
4	H	T	-3.9451
5	K	T	-4.8031
6	G	T	0.0000
7	H	T	-5.5256