Project name: 9c81d816c376043

Chain sequence(s)	A: FFGHKGG; C: FFGHKGG; B: FFGHKGG; E: FFGHKGG; D: FFGHKGG; G: FFGHKGG; F: FFGHKGG; I: FFGHKGG; H: FFGHKGG; K: FFGHKGG; J: FFGHKGG; L: FFGHKGG
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                                          (00:03:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:09)

• Minimal score value: -2.9452
• Maximal score value: 2.8767
• Average score: -0.2578
• Total score value: -21.6573

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	0.0000
2	F	A	2.2253
3	G	A	0.4379
4	H	A	0.0000
5	K	A	-2.9452
6	G	A	-2.2214
7	G	A	-1.3427
1	F	B	2.4688
2	F	B	2.8599
3	G	B	0.5260
4	H	B	-0.7919
5	K	B	-2.7597
6	G	B	-1.9753
7	G	B	-1.4355
1	F	C	0.9948
2	F	C	2.2255
3	G	C	0.4162
4	H	C	-0.6626
5	K	C	-2.2767
6	G	C	-0.8172
7	G	C	-0.0191
1	F	D	0.0000
2	F	D	2.3467
3	G	D	0.4962
4	H	D	0.0000
5	K	D	-2.6661
6	G	D	-1.6590
7	G	D	-0.9750
1	F	E	0.0000
2	F	E	1.9443
3	G	E	0.4139
4	H	E	0.0000
5	K	E	-2.3494
6	G	E	-1.8480
7	G	E	-1.2296
1	F	F	0.0000
2	F	F	2.4328
3	G	F	0.5599
4	H	F	0.0000
5	K	F	-2.6464
6	G	F	0.0000
7	G	F	-1.2329
1	F	G	2.3103
2	F	G	2.8226
3	G	G	0.4305
4	H	G	-0.5194
5	K	G	-2.4040
6	G	G	-1.6489
7	G	G	-0.4409
1	F	H	2.6492
2	F	H	2.8767
3	G	H	0.5940
4	H	H	-0.3583
5	K	H	-2.3179
6	G	H	-1.7410
7	G	H	-0.9594
1	F	I	0.0000
2	F	I	2.4604
3	G	I	0.6851
4	H	I	0.0000
5	K	I	-2.2892
6	G	I	-1.7765
7	G	I	-1.1676
1	F	J	0.0000
2	F	J	1.8894
3	G	J	0.4044
4	H	J	0.0000
5	K	J	-2.3865
6	G	J	0.0000
7	G	J	-1.1973
1	F	K	0.0000
2	F	K	1.7587
3	G	K	0.3971
4	H	K	0.0000
5	K	K	-2.5458
6	G	K	-2.0778
7	G	K	-1.4427
1	F	L	0.0000
2	F	L	1.7834
3	G	L	0.1797
4	H	L	0.0000
5	K	L	-2.6273
6	G	L	-2.1265
7	G	L	-1.3663