Project name: ef343902ae26338

Chain sequence(s)	A: FGGHKFG; C: FGGHKFG; B: FGGHKFG; E: FGGHKFG; D: FGGHKFG; G: FGGHKFG; F: FGGHKFG; I: FGGHKFG; H: FGGHKFG; K: FGGHKFG; J: FGGHKFG; L: FGGHKFG
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                                          (00:02:13)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:16)

• Minimal score value: -2.5207
• Maximal score value: 1.8316
• Average score: -0.4758
• Total score value: -39.9693

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	1.0571
2	G	A	0.1475
3	G	A	-0.5652
4	H	A	0.0000
5	K	A	-1.7489
6	F	A	0.0000
7	G	A	-1.3021
1	F	B	1.1956
2	G	B	0.2331
3	G	B	-0.8049
4	H	B	0.0000
5	K	B	-2.1238
6	F	B	0.0000
7	G	B	-1.3760
1	F	C	1.8213
2	G	C	0.0919
3	G	C	-0.9189
4	H	C	-1.0788
5	K	C	-2.4093
6	F	C	-0.8842
7	G	C	-0.9455
1	F	D	1.5300
2	G	D	-0.0506
3	G	D	-1.0437
4	H	D	-1.3274
5	K	D	-2.5207
6	F	D	-0.8904
7	G	D	-0.8692
1	F	E	1.0553
2	G	E	-0.0251
3	G	E	-0.9092
4	H	E	0.0000
5	K	E	-2.3384
6	F	E	0.0000
7	G	E	-1.3636
1	F	F	0.7449
2	G	F	-0.0319
3	G	F	-0.7986
4	H	F	0.0000
5	K	F	-2.3575
6	F	F	0.0000
7	G	F	-1.4373
1	F	G	0.8362
2	G	G	0.1070
3	G	G	-0.7579
4	H	G	0.0000
5	K	G	-2.1403
6	F	G	0.0000
7	G	G	-1.4574
1	F	H	1.1361
2	G	H	0.0586
3	G	H	-0.8850
4	H	H	0.0000
5	K	H	-2.2607
6	F	H	0.0000
7	G	H	-1.2889
1	F	I	1.8316
2	G	I	0.0473
3	G	I	-0.9203
4	H	I	-0.9930
5	K	I	-2.1324
6	F	I	-0.4185
7	G	I	-0.6872
1	F	J	1.7872
2	G	J	0.0999
3	G	J	-0.9261
4	H	J	-0.9982
5	K	J	-2.1078
6	F	J	-0.3058
7	G	J	-0.6752
1	F	K	1.2751
2	G	K	0.0826
3	G	K	-0.8218
4	H	K	0.0000
5	K	K	-1.8241
6	F	K	0.0000
7	G	K	-1.1526
1	F	L	1.0855
2	G	L	0.2131
3	G	L	-0.5714
4	H	L	0.0000
5	K	L	-1.7466
6	F	L	0.0000
7	G	L	-1.2138