Project name: FEFEFKFK_12

Chain sequence(s)	A: FEFEFKFK; C: FEFEFKFK; B: FEFEFKFK; E: FEFEFKFK; D: FEFEFKFK; G: FEFEFKFK; F: FEFEFKFK; I: FEFEFKFK; H: FEFEFKFK; K: FEFEFKFK; J: FEFEFKFK; M: FEFEFKFK; L: FEFEFKFK
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,M,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                                          (00:08:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:08:46)

• Minimal score value: -2.7787
• Maximal score value: 1.5197
• Average score: -0.5645
• Total score value: -58.7129

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	0.5747
2	E	A	-1.9257
3	F	A	-1.2294
4	E	A	-2.7787
5	F	A	-0.8676
6	K	A	-1.6246
7	F	A	0.0217
8	K	A	-1.2758
1	F	B	0.8775
2	E	B	-1.2050
3	F	B	-0.3072
4	E	B	-2.0335
5	F	B	-0.8628
6	K	B	-2.4525
7	F	B	-1.0291
8	K	B	-1.6969
1	F	C	1.1487
2	E	C	-0.9713
3	F	C	0.0775
4	E	C	-1.6304
5	F	C	0.2594
6	K	C	-1.2106
7	F	C	0.4484
8	K	C	-1.3807
1	F	D	1.1665
2	E	D	-0.9351
3	F	D	0.6276
4	E	D	-1.1413
5	F	D	1.0892
6	K	D	-0.9207
7	F	D	0.9179
8	K	D	-0.9062
1	F	E	1.2748
2	E	E	-0.8480
3	F	E	0.9207
4	E	E	-0.8091
5	F	E	0.7717
6	K	E	-0.8371
7	F	E	0.6923
8	K	E	-0.9239
1	F	F	0.9258
2	E	F	-1.6339
3	F	F	-1.0001
4	E	F	-2.0787
5	F	F	-1.2647
6	K	F	-2.4863
7	F	F	-0.9539
8	K	F	-1.6339
1	F	G	1.0791
2	E	G	-1.2181
3	F	G	-0.8281
4	E	G	-2.2738
5	F	G	-0.8729
6	K	G	-2.1205
7	F	G	-0.6725
8	K	G	-1.7925
1	F	H	1.1250
2	E	H	-1.6671
3	F	H	-0.6742
4	E	H	-2.2036
5	F	H	-0.8203
6	K	H	-2.2159
7	F	H	-0.3939
8	K	H	-1.2943
1	F	I	0.9939
2	E	I	-1.5148
3	F	I	-1.0218
4	E	I	-2.3900
5	F	I	-1.0674
6	K	I	-2.0853
7	F	I	-0.4207
8	K	I	-1.4597
1	F	J	1.4640
2	E	J	-0.9544
3	F	J	0.2938
4	E	J	-1.2423
5	F	J	0.2732
6	K	J	-1.6351
7	F	J	0.0537
8	K	J	-1.1693
1	F	K	1.1922
2	E	K	-0.8101
3	F	K	1.0305
4	E	K	-0.5614
5	F	K	1.5197
6	K	K	-0.3304
7	F	K	0.8038
8	K	K	-0.8794
1	F	L	1.2003
2	E	L	-1.1451
3	F	L	0.5141
4	E	L	-0.8248
5	F	L	1.4888
6	K	L	-0.3604
7	F	L	1.2772
8	K	L	-0.6799
1	F	M	1.3112
2	E	M	-0.4343
3	F	M	0.7308
4	E	M	-0.7106
5	F	M	0.4371
6	K	M	-1.6417
7	F	M	-0.5431
8	K	M	-1.5113