Project name: a8d454056a0e141

Chain sequence(s)	A: GGHKGHK; C: GGHKGHK; B: GGHKGHK; E: GGHKGHK; D: GGHKGHK; G: GGHKGHK; F: GGHKGHK; I: GGHKGHK; H: GGHKGHK; K: GGHKGHK; J: GGHKGHK; M: GGHKGHK; L: GGHKGHK; O: GGHKGHK; N: GGHKGHK; Q: GGHKGHK; P: GGHKGHK; S: GGHKGHK; R: GGHKGHK; T: GGHKGHK
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]                                                (00:00:01)
[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                                          (00:15:48)
[INFO]       Main:     Simulation completed successfully.                                          (00:15:53)

• Minimal score value: -3.6796
• Maximal score value: 0.0
• Average score: -1.6102
• Total score value: -225.4334

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	-1.8160
2	G	A	0.0000
3	H	A	0.0000
4	K	A	0.0000
5	G	A	0.0000
6	H	A	0.0000
7	K	A	-2.5224
1	G	B	-1.5257
2	G	B	-1.2963
3	H	B	-0.9539
4	K	B	0.0000
5	G	B	0.0000
6	H	B	0.0000
7	K	B	-1.8126
1	G	C	-1.8118
2	G	C	-1.5677
3	H	C	0.0000
4	K	C	0.0000
5	G	C	0.0000
6	H	C	0.0000
7	K	C	-1.5899
1	G	D	-1.3641
2	G	D	-1.9271
3	H	D	-2.7861
4	K	D	-3.0439
5	G	D	-3.0122
6	H	D	-3.1093
7	K	D	-3.3383
1	G	E	-1.3230
2	G	E	-1.6760
3	H	E	0.0000
4	K	E	-2.6352
5	G	E	0.0000
6	H	E	-3.3480
7	K	E	-3.6796
1	G	F	-1.2143
2	G	F	-1.2722
3	H	F	0.0000
4	K	F	-1.8207
5	G	F	0.0000
6	H	F	-3.1001
7	K	F	-3.5902
1	G	G	-1.3635
2	G	G	-1.2161
3	H	G	0.0000
4	K	G	-1.5414
5	G	G	0.0000
6	H	G	-2.7280
7	K	G	-3.3957
1	G	H	-1.4661
2	G	H	-1.3930
3	H	H	-1.6215
4	K	H	-1.5668
5	G	H	0.0000
6	H	H	-2.3781
7	K	H	-2.8088
1	G	I	-1.3715
2	G	I	-1.6439
3	H	I	0.0000
4	K	I	-1.8081
5	G	I	0.0000
6	H	I	-2.6613
7	K	I	-3.1917
1	G	J	-1.2397
2	G	J	-1.8204
3	H	J	-2.2287
4	K	J	-2.5764
5	G	J	0.0000
6	H	J	-2.9591
7	K	J	-2.9460
1	G	K	-1.8471
2	G	K	0.0000
3	H	K	0.0000
4	K	K	-0.7014
5	G	K	0.0000
6	H	K	0.0000
7	K	K	-2.1406
1	G	L	-1.2625
2	G	L	-1.9709
3	H	L	-2.1978
4	K	L	-2.4795
5	G	L	-2.1191
6	H	L	-2.8364
7	K	L	-2.8310
1	G	M	-1.5646
2	G	M	-2.1631
3	H	M	-1.7831
4	K	M	0.0000
5	G	M	-1.6361
6	H	M	0.0000
7	K	M	-3.1454
1	G	N	-1.3674
2	G	N	-1.9675
3	H	N	-2.0762
4	K	N	-2.5888
5	G	N	0.0000
6	H	N	-3.1178
7	K	N	-3.0171
1	G	O	-1.5569
2	G	O	-2.0166
3	H	O	0.0000
4	K	O	-2.3388
5	G	O	0.0000
6	H	O	-2.9613
7	K	O	-3.3996
1	G	P	-1.5123
2	G	P	-1.8349
3	H	P	0.0000
4	K	P	-2.1924
5	G	P	0.0000
6	H	P	-3.0303
7	K	P	-3.6320
1	G	Q	-1.4886
2	G	Q	-1.7298
3	H	Q	-1.8234
4	K	Q	-1.9681
5	G	Q	-2.0364
6	H	Q	-2.6917
7	K	Q	-2.8959
1	G	R	-1.5221
2	G	R	-1.8149
3	H	R	0.0000
4	K	R	0.0000
5	G	R	0.0000
6	H	R	0.0000
7	K	R	-2.6319
1	G	S	-1.6497
2	G	S	-1.9900
3	H	S	-2.6213
4	K	S	-2.6645
5	G	S	0.0000
6	H	S	-2.7399
7	K	S	-3.1414
1	G	T	-1.2721
2	G	T	-1.8723
3	H	T	-2.7915
4	K	T	-3.1271
5	G	T	-3.0873
6	H	T	-2.6340
7	K	T	-2.8886