Project name: GGGHKGF12

Chain sequence(s)	A: GGGHKGF; C: GGGHKGF; B: GGGHKGF; E: GGGHKGF; D: GGGHKGF; G: GGGHKGF; F: GGGHKGF; I: GGGHKGF; H: GGGHKGF; K: GGGHKGF; J: GGGHKGF; L: GGGHKGF
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                                          (00:03:14)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:17)

• Minimal score value: -3.4687
• Maximal score value: 2.3815
• Average score: -1.4144
• Total score value: -118.8067

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	-1.7065
2	G	A	-2.1929
3	G	A	-2.9682
4	H	A	-3.0569
5	K	A	-2.1518
6	G	A	-0.3419
7	F	A	1.7556
1	G	B	-1.4023
2	G	B	-1.7483
3	G	B	-2.7345
4	H	B	-3.4687
5	K	B	-3.3891
6	G	B	-1.4804
7	F	B	0.5764
1	G	C	-1.5540
2	G	C	-1.5382
3	G	C	-2.1887
4	H	C	-2.8991
5	K	C	-2.4101
6	G	C	-0.8616
7	F	C	1.0991
1	G	D	-1.5625
2	G	D	-1.9445
3	G	D	-2.3781
4	H	D	-2.5160
5	K	D	-2.0704
6	G	D	-0.8263
7	F	D	1.2503
1	G	E	-1.6521
2	G	E	-2.1958
3	G	E	-2.5742
4	H	E	-2.8804
5	K	E	-2.7885
6	G	E	-1.4230
7	F	E	1.1256
1	G	F	-1.5803
2	G	F	-2.3293
3	G	F	-2.5966
4	H	F	-2.7090
5	K	F	-2.4144
6	G	F	-0.3057
7	F	F	1.8552
1	G	G	-1.5208
2	G	G	-1.7160
3	G	G	-2.2923
4	H	G	-2.1994
5	K	G	-1.1539
6	G	G	0.1838
7	F	G	2.3815
1	G	H	-1.3600
2	G	H	-1.6736
3	G	H	-2.1752
4	H	H	-2.5229
5	K	H	-1.7370
6	G	H	-0.0755
7	F	H	2.1066
1	G	I	-1.9869
2	G	I	-1.7861
3	G	I	-2.0722
4	H	I	-2.1947
5	K	I	-2.0025
6	G	I	-0.4747
7	F	I	1.6372
1	G	J	0.0000
2	G	J	-1.9664
3	G	J	-2.5073
4	H	J	-2.5085
5	K	J	-2.3935
6	G	J	-0.8905
7	F	J	1.4099
1	G	K	-1.4894
2	G	K	-1.9305
3	G	K	-2.6800
4	H	K	-3.0207
5	K	K	-2.0671
6	G	K	-0.5130
7	F	K	1.8871
1	G	L	-1.5988
2	G	L	-2.4063
3	G	L	-2.4257
4	H	L	-2.5412
5	K	L	-2.1628
6	G	L	-0.6725
7	F	L	1.4832