Project name: 993888814d945f2

Chain sequence(s)	A: GSGHKFF; C: GSGHKFF; B: GSGHKFF; E: GSGHKFF; D: GSGHKFF; G: GSGHKFF; F: GSGHKFF; I: GSGHKFF; H: GSGHKFF; K: GSGHKFF; J: GSGHKFF; L: GSGHKFF
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                                          (00:02:10)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:13)

• Minimal score value: -1.4653
• Maximal score value: 3.5634
• Average score: -0.0862
• Total score value: -7.2423

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	-1.0843
2	S	A	-0.9678
3	G	A	-1.2464
4	H	A	0.0000
5	K	A	-0.4657
6	F	A	0.0000
7	F	A	3.2420
1	G	B	-1.0866
2	S	B	-0.8383
3	G	B	-1.0010
4	H	B	0.0000
5	K	B	-0.3529
6	F	B	0.0000
7	F	B	3.3820
1	G	C	-1.0612
2	S	C	-0.8233
3	G	C	-0.9637
4	H	C	0.0000
5	K	C	-0.3042
6	F	C	0.0000
7	F	C	3.4175
1	G	D	-1.0666
2	S	D	-0.9092
3	G	D	-1.2624
4	H	D	0.0000
5	K	D	-0.4016
6	F	D	0.0000
7	F	D	3.2161
1	G	E	-0.9191
2	S	E	-0.8514
3	G	E	-1.4437
4	H	E	-1.4653
5	K	E	-1.1997
6	F	E	0.9706
7	F	E	2.6412
1	G	F	-0.9703
2	S	F	-0.8987
3	G	F	-1.4223
4	H	F	-1.3812
5	K	F	-1.3810
6	F	F	0.5085
7	F	F	2.2775
1	G	G	-1.1083
2	S	G	-0.9636
3	G	G	-1.2920
4	H	G	0.0000
5	K	G	-0.6193
6	F	G	0.0000
7	F	G	2.5655
1	G	H	-1.0312
2	S	H	-0.8652
3	G	H	-0.9534
4	H	H	0.0000
5	K	H	-0.3186
6	F	H	0.0000
7	F	H	3.2589
1	G	I	-1.0875
2	S	I	-0.8605
3	G	I	-0.9377
4	H	I	0.0000
5	K	I	-0.2285
6	F	I	0.0000
7	F	I	3.4122
1	G	J	-1.0359
2	S	J	-0.9859
3	G	J	-1.2325
4	H	J	0.0000
5	K	J	-0.0608
6	F	J	0.0000
7	F	J	3.5634
1	G	K	-0.8818
2	S	K	-0.9548
3	G	K	-1.2400
4	H	K	-1.0404
5	K	K	-0.4013
6	F	K	2.0580
7	F	K	3.2230
1	G	L	-0.8823
2	S	L	-0.9355
3	G	L	-1.2075
4	H	L	-1.0875
5	K	L	-0.7987
6	F	L	1.0727
7	F	L	2.7272