Project name: 113aa8e4983a8d9

Chain sequence(s)	A: GGHKGHK; C: GGHKGHK; B: GGHKGHK; E: GGHKGHK; D: GGHKGHK; G: GGHKGHK; F: GGHKGHK; I: GGHKGHK; H: GGHKGHK; K: GGHKGHK; J: GGHKGHK; L: GGHKGHK
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]                                                (00:00:01)
[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                                          (00:10:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:10:20)

• Minimal score value: -3.9299
• Maximal score value: 0.0
• Average score: -1.9994
• Total score value: -167.9497

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	-1.1988
2	G	A	-1.4594
3	H	A	-2.0755
4	K	A	-2.8809
5	G	A	0.0000
6	H	A	-3.2358
7	K	A	-3.6925
1	G	B	-1.0978
2	G	B	-1.4630
3	H	B	-2.2048
4	K	B	-2.7376
5	G	B	-2.6488
6	H	B	-3.2685
7	K	B	-3.3228
1	G	C	-1.0523
2	G	C	-1.4006
3	H	C	-2.1513
4	K	C	-2.4756
5	G	C	0.0000
6	H	C	-2.6152
7	K	C	-2.8254
1	G	D	-1.1808
2	G	D	-1.3334
3	H	D	-1.6927
4	K	D	-2.3571
5	G	D	0.0000
6	H	D	-2.5572
7	K	D	-3.2550
1	G	E	-1.1507
2	G	E	-1.2092
3	H	E	0.0000
4	K	E	-2.2022
5	G	E	0.0000
6	H	E	-2.2849
7	K	E	-3.1152
1	G	F	-1.1707
2	G	F	-1.4800
3	H	F	-1.8980
4	K	F	-2.6353
5	G	F	0.0000
6	H	F	-2.6784
7	K	F	-3.1609
1	G	G	-1.0141
2	G	G	-1.5875
3	H	G	-2.5133
4	K	G	-3.3291
5	G	G	-3.2071
6	H	G	-2.7965
7	K	G	-2.9038
1	G	H	-1.0662
2	G	H	-1.6828
3	H	H	-2.4417
4	K	H	-3.6869
5	G	H	-3.1963
6	H	H	-3.2788
7	K	H	-3.4660
1	G	I	-1.1738
2	G	I	-1.5342
3	H	I	-2.4383
4	K	I	-3.4077
5	G	I	0.0000
6	H	I	-3.5313
7	K	I	-3.9299
1	G	J	-1.0399
2	G	J	-1.1051
3	H	J	-1.4441
4	K	J	-2.2837
5	G	J	0.0000
6	H	J	-3.1032
7	K	J	-3.5094
1	G	K	-1.0651
2	G	K	-1.0407
3	H	K	-1.3512
4	K	K	-2.1155
5	G	K	0.0000
6	H	K	-2.6410
7	K	K	-3.1222
1	G	L	-1.1023
2	G	L	-1.2222
3	H	L	-1.6496
4	K	L	-2.4188
5	G	L	0.0000
6	H	L	-2.9329
7	K	L	-3.4492