Project name: GGGHKFF12

Chain sequence(s)	A: GGGHKFF; C: GGGHKFF; B: GGGHKFF; E: GGGHKFF; D: GGGHKFF; G: GGGHKFF; F: GGGHKFF; I: GGGHKFF; H: GGGHKFF; K: GGGHKFF; J: GGGHKFF; L: GGGHKFF
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                                          (00:06:26)
[INFO]       Main:     Simulation completed successfully.                                          (00:06:29)

• Minimal score value: -2.023
• Maximal score value: 3.1487
• Average score: -0.6455
• Total score value: -54.2215

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	-0.9635
2	G	A	-1.3607
3	G	A	-1.4038
4	H	A	-1.6564
5	K	A	-1.3892
6	F	A	0.9452
7	F	A	0.4596
1	G	B	-0.8925
2	G	B	-1.1786
3	G	B	-1.7476
4	H	B	-1.5920
5	K	B	-1.3695
6	F	B	0.0000
7	F	B	1.2049
1	G	C	-0.7262
2	G	C	-0.6452
3	G	C	-0.4671
4	H	C	0.0000
5	K	C	0.0553
6	F	C	0.2815
7	F	C	0.0000
1	G	D	-1.0586
2	G	D	-1.0154
3	G	D	-1.0338
4	H	D	-0.3539
5	K	D	0.0000
6	F	D	0.4363
7	F	D	-0.6687
1	G	E	-1.0882
2	G	E	-1.4476
3	G	E	-1.7609
4	H	E	-1.4222
5	K	E	-0.5422
6	F	E	0.0000
7	F	E	1.5378
1	G	F	-1.0795
2	G	F	-1.6039
3	G	F	-1.7795
4	H	F	-1.4890
5	K	F	-1.0384
6	F	F	0.0000
7	F	F	2.5898
1	G	G	-1.0240
2	G	G	-1.4348
3	G	G	-1.7771
4	H	G	-1.8752
5	K	G	-1.3967
6	F	G	0.0000
7	F	G	1.9401
1	G	H	-1.1242
2	G	H	-1.5486
3	G	H	-1.8825
4	H	H	-1.9619
5	K	H	-1.7948
6	F	H	0.0000
7	F	H	0.0000
1	G	I	-1.2152
2	G	I	-1.5568
3	G	I	-1.6023
4	H	I	-1.6083
5	K	I	-1.4701
6	F	I	0.0000
7	F	I	1.0596
1	G	J	-0.8923
2	G	J	-1.4216
3	G	J	-1.5761
4	H	J	-1.2982
5	K	J	-0.1030
6	F	J	0.0000
7	F	J	3.1487
1	G	K	-1.0214
2	G	K	-1.3958
3	G	K	-2.0230
4	H	K	-1.9007
5	K	K	-1.2782
6	F	K	0.0000
7	F	K	2.4289
1	G	L	-0.9513
2	G	L	-1.4403
3	G	L	-1.4953
4	H	L	-1.4885
5	K	L	-0.9918
6	F	L	1.9816
7	F	L	3.0333