Project name: GHKGHKG20

Chain sequence(s)	A: GHKGHKG; C: GHKGHKG; B: GHKGHKG; E: GHKGHKG; D: GHKGHKG; G: GHKGHKG; F: GHKGHKG; I: GHKGHKG; H: GHKGHKG; K: GHKGHKG; J: GHKGHKG; M: GHKGHKG; L: GHKGHKG; O: GHKGHKG; N: GHKGHKG; Q: GHKGHKG; P: GHKGHKG; S: GHKGHKG; R: GHKGHKG; T: GHKGHKG
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]                                                (00:00:01)
[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                                          (00:07:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:07:12)

• Minimal score value: -5.3924
• Maximal score value: 0.0
• Average score: -3.0318
• Total score value: -424.454

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	-2.5209
2	H	A	-3.2806
3	K	A	-3.6725
4	G	A	-3.4493
5	H	A	-3.2208
6	K	A	-3.6173
7	G	A	-2.4805
1	G	B	-3.7804
2	H	B	-3.2691
3	K	B	-4.1513
4	G	B	-3.6403
5	H	B	-3.2558
6	K	B	-3.3646
7	G	B	-2.2646
1	G	C	-3.6463
2	H	C	-4.4283
3	K	C	-4.0750
4	G	C	-3.0066
5	H	C	-3.2570
6	K	C	-2.7618
7	G	C	-1.9504
1	G	D	-3.1887
2	H	D	-3.2597
3	K	D	-4.0361
4	G	D	-4.0062
5	H	D	-3.7972
6	K	D	-4.4832
7	G	D	-2.9631
1	G	E	-2.3481
2	H	E	-2.5734
3	K	E	-3.7943
4	G	E	-3.2509
5	H	E	-3.0317
6	K	E	-3.3872
7	G	E	-2.7015
1	G	F	-3.3569
2	H	F	-3.5087
3	K	F	-3.8128
4	G	F	-3.4854
5	H	F	-3.2867
6	K	F	-3.3943
7	G	F	-2.5078
1	G	G	-2.7619
2	H	G	-2.9970
3	K	G	-3.3091
4	G	G	-3.2862
5	H	G	-3.6401
6	K	G	-3.8010
7	G	G	-2.9525
1	G	H	-2.2524
2	H	H	-3.5586
3	K	H	-4.4469
4	G	H	-4.0438
5	H	H	-3.9926
6	K	H	-3.3831
7	G	H	-2.5393
1	G	I	-3.4618
2	H	I	-4.3185
3	K	I	-4.7159
4	G	I	-3.5467
5	H	I	-3.7040
6	K	I	-2.8480
7	G	I	-2.2056
1	G	J	-2.6219
2	H	J	-2.5362
3	K	J	-3.2094
4	G	J	-2.6935
5	H	J	-2.9752
6	K	J	-2.8568
7	G	J	-1.6994
1	G	K	-1.9304
2	H	K	-2.9348
3	K	K	-3.3681
4	G	K	-2.6196
5	H	K	-2.6139
6	K	K	-2.5987
7	G	K	-1.6843
1	G	L	-2.5841
2	H	L	-3.1772
3	K	L	-3.3803
4	G	L	-2.6817
5	H	L	-2.7363
6	K	L	-2.4786
7	G	L	-1.9883
1	G	M	-3.1882
2	H	M	-3.3658
3	K	M	-3.2668
4	G	M	-2.4247
5	H	M	-2.4325
6	K	M	-2.3356
7	G	M	-1.7052
1	G	N	-2.0824
2	H	N	-2.7861
3	K	N	-3.3824
4	G	N	-3.1920
5	H	N	-3.2072
6	K	N	-3.0290
7	G	N	-1.7966
1	G	O	0.0000
2	H	O	-3.0952
3	K	O	-3.5263
4	G	O	-2.9088
5	H	O	-2.7311
6	K	O	-2.7978
7	G	O	-1.7004
1	G	P	-2.3902
2	H	P	-2.5536
3	K	P	-2.8935
4	G	P	-2.4739
5	H	P	-3.4149
6	K	P	-3.2655
7	G	P	-2.8808
1	G	Q	-2.5801
2	H	Q	0.0000
3	K	Q	-3.2908
4	G	Q	0.0000
5	H	Q	-3.5405
6	K	Q	-3.5375
7	G	Q	-2.8789
1	G	R	-2.4643
2	H	R	-2.4940
3	K	R	0.0000
4	G	R	-2.5383
5	H	R	-2.7224
6	K	R	-2.4866
7	G	R	-1.6851
1	G	S	-3.1054
2	H	S	-4.3942
3	K	S	-5.3924
4	G	S	-3.9844
5	H	S	-3.8716
6	K	S	-3.7854
7	G	S	-2.5330
1	G	T	-3.8829
2	H	T	-4.4160
3	K	T	-5.0905
4	G	T	-3.8408
5	H	T	-3.6197
6	K	T	-3.2341
7	G	T	-1.8576