Project name: GKGHKGH12

Chain sequence(s)	A: GKGHKGH; C: GKGHKGH; B: GKGHKGH; E: GKGHKGH; D: GKGHKGH; G: GKGHKGH; F: GKGHKGH; I: GKGHKGH; H: GKGHKGH; K: GKGHKGH; J: GKGHKGH; L: GKGHKGH
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                                          (00:03:21)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:25)

• Minimal score value: -5.3064
• Maximal score value: 0.0
• Average score: -3.3877
• Total score value: -284.5685

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	-2.7400
2	K	A	-4.0139
3	G	A	-3.8581
4	H	A	-4.3762
5	K	A	-5.3064
6	G	A	-4.5746
7	H	A	-4.3739
1	G	B	-4.0738
2	K	B	-4.3257
3	G	B	0.0000
4	H	B	-4.7201
5	K	B	-4.7145
6	G	B	-4.3762
7	H	B	-4.1498
1	G	C	-3.3009
2	K	C	-3.3723
3	G	C	-3.0723
4	H	C	-3.0559
5	K	C	-3.3991
6	G	C	-2.7209
7	H	C	-3.2980
1	G	D	-2.5811
2	K	D	-3.2372
3	G	D	-3.4606
4	H	D	-3.9868
5	K	D	-3.7468
6	G	D	-3.0935
7	H	D	-3.2028
1	G	E	-2.9120
2	K	E	-3.3262
3	G	E	-3.4990
4	H	E	-3.7782
5	K	E	-4.3190
6	G	E	-3.4597
7	H	E	-4.7502
1	G	F	-2.9593
2	K	F	-3.4032
3	G	F	-3.9344
4	H	F	-4.6678
5	K	F	-4.3885
6	G	F	-3.8219
7	H	F	-3.8584
1	G	G	-3.2273
2	K	G	-3.6546
3	G	G	-3.5108
4	H	G	-3.6289
5	K	G	-3.9078
6	G	G	-3.2201
7	H	G	-3.6180
1	G	H	-2.4941
2	K	H	-3.2947
3	G	H	0.0000
4	H	H	-3.3264
5	K	H	-3.3598
6	G	H	-2.5410
7	H	H	-2.6293
1	G	I	-2.2104
2	K	I	-2.9657
3	G	I	-3.1085
4	H	I	-3.2537
5	K	I	-3.0873
6	G	I	-2.1354
7	H	I	-1.8572
1	G	J	-2.2993
2	K	J	-3.1602
3	G	J	-3.0462
4	H	J	-3.8864
5	K	J	-4.1808
6	G	J	-3.1783
7	H	J	-3.9799
1	G	K	-3.2221
2	K	K	-4.0941
3	G	K	-4.3699
4	H	K	-4.2453
5	K	K	-4.6093
6	G	K	-3.3212
7	H	K	-3.0328
1	G	L	-2.7757
2	K	L	-3.3350
3	G	L	-3.9977
4	H	L	0.0000
5	K	L	-3.4251
6	G	L	-2.4739
7	H	L	-2.6951