Project name: ece74a5d3e7266a

Chain sequence(s)	A: FQFGHGFQF; C: FQFGHGFQF; B: FQFGHGFQF; E: FQFGHGFQF; D: FQFGHGFQF; G: FQFGHGFQF; F: FQFGHGFQF; I: FQFGHGFQF; H: FQFGHGFQF; K: FQFGHGFQF; J: FQFGHGFQF; L: FQFGHGFQF
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]                                                (00:00:00)
[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                                          (00:01:05)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:08)

• Minimal score value: -1.0532
• Maximal score value: 3.2916
• Average score: 1.02
• Total score value: 110.1638

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	1.8629
2	Q	A	0.0000
3	F	A	1.4932
4	G	A	-0.2147
5	H	A	-1.0532
6	G	A	-0.2676
7	F	A	1.6015
8	Q	A	0.0000
9	F	A	2.2278
1	F	B	2.0237
2	Q	B	1.3581
3	F	B	1.6747
4	G	B	0.0571
5	H	B	-0.8890
6	G	B	0.0961
7	F	B	1.9193
8	Q	B	1.9541
9	F	B	2.2114
1	F	C	2.7806
2	Q	C	2.0513
3	F	C	2.1677
4	G	C	0.4508
5	H	C	-0.8471
6	G	C	-0.1948
7	F	C	1.5961
8	Q	C	1.5560
9	F	C	2.5314
1	F	D	2.4159
2	Q	D	0.0000
3	F	D	2.0569
4	G	D	0.3959
5	H	D	-0.4463
6	G	D	-0.1743
7	F	D	1.3486
8	Q	D	1.9453
9	F	D	2.4667
1	F	E	2.0289
2	Q	E	0.0000
3	F	E	1.5960
4	G	E	0.1840
5	H	E	-0.5111
6	G	E	-0.0975
7	F	E	1.2964
8	Q	E	0.0000
9	F	E	1.9449
1	F	F	1.8724
2	Q	F	0.0000
3	F	F	1.4268
4	G	F	0.1520
5	H	F	-0.4883
6	G	F	0.0925
7	F	F	1.0747
8	Q	F	0.0000
9	F	F	1.7935
1	F	G	1.6679
2	Q	G	0.0000
3	F	G	1.2990
4	G	G	0.1204
5	H	G	-0.4950
6	G	G	0.0944
7	F	G	1.0319
8	Q	G	0.0000
9	F	G	1.6533
1	F	H	2.0477
2	Q	H	0.0000
3	F	H	1.4459
4	G	H	0.0749
5	H	H	-0.5287
6	G	H	-0.0939
7	F	H	1.1858
8	Q	H	0.0000
9	F	H	1.7944
1	F	I	2.7364
2	Q	I	0.0000
3	F	I	1.9234
4	G	I	0.3693
5	H	I	-0.2474
6	G	I	0.4289
7	F	I	1.6399
8	Q	I	0.0000
9	F	I	2.2927
1	F	J	3.2916
2	Q	J	2.3149
3	F	J	2.5498
4	G	J	0.7514
5	H	J	-0.3958
6	G	J	0.5504
7	F	J	2.6673
8	Q	J	2.6327
9	F	J	3.1287
1	F	K	2.7289
2	Q	K	1.9288
3	F	K	2.1213
4	G	K	0.4220
5	H	K	-0.6442
6	G	K	0.3920
7	F	K	2.5074
8	Q	K	2.4223
9	F	K	3.1164
1	F	L	1.9611
2	Q	L	0.0000
3	F	L	1.5708
4	G	L	-0.1009
5	H	L	-0.9399
6	G	L	0.0000
7	F	L	1.8559
8	Q	L	0.0000
9	F	L	2.3684