Project name: FQKGHQF20

Chain sequence(s)	A: FQKGHQF; C: FQKGHQF; B: FQKGHQF; E: FQKGHQF; D: FQKGHQF; G: FQKGHQF; F: FQKGHQF; I: FQKGHQF; H: FQKGHQF; K: FQKGHQF; J: FQKGHQF; M: FQKGHQF; L: FQKGHQF; O: FQKGHQF; N: FQKGHQF; Q: FQKGHQF; P: FQKGHQF; S: FQKGHQF; R: FQKGHQF; T: FQKGHQF
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]                                                (00:00:00)
[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                                          (00:03:11)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:15)

• Minimal score value: -3.4513
• Maximal score value: 2.1189
• Average score: -0.9281
• Total score value: -129.9324

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	F	A	0.6154
2	Q	A	-1.4611
3	K	A	-2.2032
4	G	A	-1.1695
5	H	A	-0.9721
6	Q	A	0.5108
7	F	A	2.1189
1	F	B	0.8119
2	Q	B	-1.3099
3	K	B	-2.3045
4	G	B	-2.0285
5	H	B	-1.8784
6	Q	B	-1.4121
7	F	B	1.1406
1	F	C	0.8523
2	Q	C	-1.3277
3	K	C	-2.2767
4	G	C	-1.6657
5	H	C	-1.6419
6	Q	C	-0.9929
7	F	C	1.4884
1	F	D	0.9114
2	Q	D	-1.1749
3	K	D	-2.0823
4	G	D	-1.3443
5	H	D	-1.7201
6	Q	D	0.0441
7	F	D	1.9692
1	F	E	0.8626
2	Q	E	-1.3858
3	K	E	-2.5026
4	G	E	-2.2580
5	H	E	-2.5337
6	Q	E	-1.3274
7	F	E	1.0295
1	F	F	0.8794
2	Q	F	-1.3430
3	K	F	-2.4405
4	G	F	-1.9282
5	H	F	-1.8532
6	Q	F	-1.1155
7	F	F	1.1204
1	F	G	0.9086
2	Q	G	-1.3170
3	K	G	-2.5928
4	G	G	-2.0226
5	H	G	-1.7431
6	Q	G	-0.7655
7	F	G	1.4699
1	F	H	0.4771
2	Q	H	-1.8474
3	K	H	-3.4513
4	G	H	-2.2268
5	H	H	-1.8869
6	Q	H	-1.3190
7	F	H	1.3106
1	F	I	-0.4112
2	Q	I	-2.3394
3	K	I	-2.7464
4	G	I	-1.9717
5	H	I	-1.8102
6	Q	I	-1.3030
7	F	I	0.9607
1	F	J	1.1720
2	Q	J	-0.9674
3	K	J	-1.9684
4	G	J	-1.6787
5	H	J	-2.2289
6	Q	J	-1.6292
7	F	J	0.5282
1	F	K	0.8897
2	Q	K	-1.2696
3	K	K	-2.1757
4	G	K	-1.5405
5	H	K	-1.6655
6	Q	K	-0.5006
7	F	K	1.6035
1	F	L	0.8882
2	Q	L	-1.1879
3	K	L	-2.2607
4	G	L	-1.8960
5	H	L	-1.8759
6	Q	L	-1.1663
7	F	L	0.7139
1	F	M	0.8929
2	Q	M	-1.3434
3	K	M	-2.4346
4	G	M	-2.1039
5	H	M	-1.8697
6	Q	M	-1.4894
7	F	M	0.5991
1	F	N	0.8772
2	Q	N	-1.3243
3	K	N	-2.4191
4	G	N	-1.9112
5	H	N	-1.8646
6	Q	N	-1.0497
7	F	N	1.1663
1	F	O	0.9059
2	Q	O	-1.0883
3	K	O	-2.5083
4	G	O	-2.3838
5	H	O	-3.3011
6	Q	O	-3.0106
7	F	O	-1.9640
1	F	P	1.2165
2	Q	P	-0.6105
3	K	P	-1.8210
4	G	P	0.0000
5	H	P	-1.9963
6	Q	P	-1.2259
7	F	P	1.1422
1	F	Q	0.8947
2	Q	Q	-1.3572
3	K	Q	-2.4205
4	G	Q	-2.0265
5	H	Q	-1.5753
6	Q	Q	-0.8074
7	F	Q	1.7009
1	F	R	0.9332
2	Q	R	-1.3471
3	K	R	-2.4404
4	G	R	-2.2446
5	H	R	-2.6668
6	Q	R	-1.4697
7	F	R	0.6671
1	F	S	1.1097
2	Q	S	-1.1508
3	K	S	-2.4125
4	G	S	-1.8259
5	H	S	-1.6084
6	Q	S	-1.3738
7	F	S	0.8845
1	F	T	0.9681
2	Q	T	-1.2010
3	K	T	-2.0462
4	G	T	-1.0321
5	H	T	-0.7916
6	Q	T	-0.2054
7	F	T	1.9742