Project name: GGGHKFG20

Chain sequence(s)	A: GGGHKFG; C: GGGHKFG; B: GGGHKFG; E: GGGHKFG; D: GGGHKFG; G: GGGHKFG; F: GGGHKFG; I: GGGHKFG; H: GGGHKFG; K: GGGHKFG; J: GGGHKFG; M: GGGHKFG; L: GGGHKFG; O: GGGHKFG; N: GGGHKFG; Q: GGGHKFG; P: GGGHKFG; S: GGGHKFG; R: GGGHKFG; T: GGGHKFG
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                                          (00:04:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:11)

• Minimal score value: -1.9415
• Maximal score value: 1.3306
• Average score: -0.8745
• Total score value: -122.4293

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	-0.9766
2	G	A	-1.6244
3	G	A	-1.6025
4	H	A	-1.8529
5	K	A	-1.4665
6	F	A	0.5195
7	G	A	-0.1509
1	G	B	-1.7650
2	G	B	-1.6754
3	G	B	-1.7248
4	H	B	-1.6030
5	K	B	-1.7516
6	F	B	-0.2073
7	G	B	-0.5839
1	G	C	-1.3592
2	G	C	-1.5203
3	G	C	0.0000
4	H	C	-0.6313
5	K	C	-0.0071
6	F	C	1.2873
7	G	C	0.4806
1	G	D	-1.3574
2	G	D	-1.4799
3	G	D	-1.2779
4	H	D	-0.5236
5	K	D	-0.4774
6	F	D	1.3306
7	G	D	0.2654
1	G	E	-1.5271
2	G	E	-1.5798
3	G	E	-1.7582
4	H	E	-1.1498
5	K	E	-1.1913
6	F	E	0.8129
7	G	E	-0.1038
1	G	F	-1.6415
2	G	F	0.0000
3	G	F	-1.7248
4	H	F	-1.4993
5	K	F	-1.0627
6	F	F	0.8603
7	G	F	-0.0661
1	G	G	-1.6236
2	G	G	0.0000
3	G	G	-1.9097
4	H	G	-1.4682
5	K	G	-1.2568
6	F	G	0.7284
7	G	G	-0.1532
1	G	H	-1.5312
2	G	H	0.0000
3	G	H	-1.8294
4	H	H	-1.2274
5	K	H	-1.5140
6	F	H	0.7197
7	G	H	-0.1288
1	G	I	-1.3852
2	G	I	-1.5794
3	G	I	-1.7830
4	H	I	-1.1906
5	K	I	-1.4816
6	F	I	0.7381
7	G	I	-0.1122
1	G	J	-1.3374
2	G	J	-1.5918
3	G	J	-1.7089
4	H	J	-1.2912
5	K	J	-1.5938
6	F	J	0.7043
7	G	J	-0.1107
1	G	K	-1.3178
2	G	K	0.0000
3	G	K	-1.7601
4	H	K	-1.2500
5	K	K	-1.5498
6	F	K	0.7146
7	G	K	-0.0983
1	G	L	-1.2909
2	G	L	-1.5960
3	G	L	-1.7503
4	H	L	-1.1663
5	K	L	-1.4419
6	F	L	0.7772
7	G	L	-0.0539
1	G	M	-1.4004
2	G	M	-1.6836
3	G	M	-1.8271
4	H	M	-1.2273
5	K	M	-1.4813
6	F	M	0.7331
7	G	M	-0.0654
1	G	N	-1.4333
2	G	N	-1.6882
3	G	N	-1.8372
4	H	N	-1.2869
5	K	N	-1.5585
6	F	N	0.6442
7	G	N	-0.1357
1	G	O	-1.4493
2	G	O	-1.6930
3	G	O	-1.8403
4	H	O	-1.5863
5	K	O	-1.6792
6	F	O	0.4811
7	G	O	-0.2747
1	G	P	-1.3898
2	G	P	-1.6564
3	G	P	-1.9025
4	H	P	-1.4802
5	K	P	-1.9415
6	F	P	-0.2521
7	G	P	-0.6102
1	G	Q	-1.2438
2	G	Q	-1.5944
3	G	Q	-1.7768
4	H	Q	-1.2131
5	K	Q	-1.5943
6	F	Q	0.4557
7	G	Q	-0.3357
1	G	R	-1.2254
2	G	R	-1.6314
3	G	R	-1.6661
4	H	R	-1.2164
5	K	R	-1.3350
6	F	R	0.7174
7	G	R	-0.0460
1	G	S	-1.4288
2	G	S	-1.5357
3	G	S	-1.6471
4	H	S	-1.2005
5	K	S	-1.2614
6	F	S	0.9195
7	G	S	0.1276
1	G	T	-1.5254
2	G	T	0.0000
3	G	T	0.0000
4	H	T	-0.9578
5	K	T	-0.1315
6	F	T	1.2813
7	G	T	0.2256