Project name: 4b54975718b9178

Chain sequence(s)	A: SKGHKGH; C: SKGHKGH; B: SKGHKGH; E: SKGHKGH; D: SKGHKGH; G: SKGHKGH; F: SKGHKGH; I: SKGHKGH; H: SKGHKGH; K: SKGHKGH; J: SKGHKGH; M: SKGHKGH; L: SKGHKGH; O: SKGHKGH; N: SKGHKGH; Q: SKGHKGH; P: SKGHKGH; S: SKGHKGH; R: SKGHKGH; T: SKGHKGH
Selected Chain(s)	A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T
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                                          (00:08:11)
[INFO]       Main:     Simulation completed successfully.                                          (00:08:15)

• Minimal score value: -3.7162
• Maximal score value: 0.0
• Average score: -1.9725
• Total score value: -276.1495

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	S	A	-2.3722
2	K	A	-3.6787
3	G	A	-2.3953
4	H	A	0.0000
5	K	A	-1.8307
6	G	A	0.0000
7	H	A	-1.6733
1	S	B	-2.4710
2	K	B	-3.7162
3	G	B	-2.4698
4	H	B	0.0000
5	K	B	-1.7854
6	G	B	0.0000
7	H	B	-1.8280
1	S	C	-2.3570
2	K	C	-3.5794
3	G	C	-2.4191
4	H	C	0.0000
5	K	C	-1.7783
6	G	C	0.0000
7	H	C	-1.7110
1	S	D	-2.2921
2	K	D	-3.3631
3	G	D	-2.1871
4	H	D	0.0000
5	K	D	-1.8100
6	G	D	0.0000
7	H	D	-1.8075
1	S	E	-2.2834
2	K	E	-3.4822
3	G	E	-2.1235
4	H	E	0.0000
5	K	E	-1.9988
6	G	E	0.0000
7	H	E	-1.8973
1	S	F	-2.2909
2	K	F	-3.4365
3	G	F	-2.2992
4	H	F	0.0000
5	K	F	-2.0964
6	G	F	0.0000
7	H	F	-2.3295
1	S	G	-2.5281
2	K	G	-3.6377
3	G	G	-2.8611
4	H	G	-3.0497
5	K	G	-2.9899
6	G	G	-2.4380
7	H	G	-2.4064
1	S	H	-2.0754
2	K	H	-3.2886
3	G	H	-2.6943
4	H	H	-3.1126
5	K	H	-3.3596
6	G	H	-2.2827
7	H	H	-2.1480
1	S	I	-2.2838
2	K	I	-3.1388
3	G	I	-2.1723
4	H	I	-2.4453
5	K	I	-2.6902
6	G	I	0.0000
7	H	I	-2.1411
1	S	J	-2.3635
2	K	J	-3.3371
3	G	J	-2.4956
4	H	J	0.0000
5	K	J	-2.4179
6	G	J	0.0000
7	H	J	-2.0541
1	S	K	-2.4733
2	K	K	-3.5770
3	G	K	-2.2494
4	H	K	0.0000
5	K	K	-2.1081
6	G	K	0.0000
7	H	K	-1.8976
1	S	L	-2.5251
2	K	L	-3.6197
3	G	L	-2.3267
4	H	L	0.0000
5	K	L	-1.8822
6	G	L	0.0000
7	H	L	-1.9436
1	S	M	-2.3562
2	K	M	-3.6367
3	G	M	-2.2896
4	H	M	0.0000
5	K	M	-2.0515
6	G	M	0.0000
7	H	M	-1.8352
1	S	N	-2.2258
2	K	N	-3.3550
3	G	N	-2.2398
4	H	N	0.0000
5	K	N	-1.9589
6	G	N	0.0000
7	H	N	-1.7734
1	S	O	-2.4449
2	K	O	-3.6700
3	G	O	-2.5416
4	H	O	0.0000
5	K	O	-2.2930
6	G	O	0.0000
7	H	O	-2.0402
1	S	P	-2.2181
2	K	P	-3.1343
3	G	P	-1.9677
4	H	P	0.0000
5	K	P	-1.7312
6	G	P	0.0000
7	H	P	-1.6447
1	S	Q	-2.4864
2	K	Q	-3.2248
3	G	Q	-2.6039
4	H	Q	-2.6889
5	K	Q	-2.8353
6	G	Q	-2.3081
7	H	Q	-2.1614
1	S	R	-2.2004
2	K	R	-3.0889
3	G	R	-2.0622
4	H	R	0.0000
5	K	R	-1.7288
6	G	R	0.0000
7	H	R	-2.0174
1	S	S	-2.5433
2	K	S	-3.5840
3	G	S	-2.7786
4	H	S	0.0000
5	K	S	-2.7859
6	G	S	-2.6208
7	H	S	-2.3307
1	S	T	-2.2468
2	K	T	-3.3251
3	G	T	-2.9383
4	H	T	-3.3389
5	K	T	-3.4504
6	G	T	-2.5967
7	H	T	-2.0183