Project name: 54bd26a6c4a537a

Chain sequence(s)	A: KKGHKGH; C: KKGHKGH; B: KKGHKGH; E: KKGHKGH; D: KKGHKGH; G: KKGHKGH; F: KKGHKGH; I: KKGHKGH; H: KKGHKGH; K: KKGHKGH; J: KKGHKGH; M: KKGHKGH; L: KKGHKGH; O: KKGHKGH; N: KKGHKGH; Q: KKGHKGH; P: KKGHKGH; S: KKGHKGH; R: KKGHKGH; T: KKGHKGH
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                                          (00:13:20)
[INFO]       Main:     Simulation completed successfully.                                          (00:13:24)

• Minimal score value: -5.1207
• Maximal score value: 0.0
• Average score: -2.6281
• Total score value: -367.934

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	K	A	-4.4904
2	K	A	-4.3264
3	G	A	-2.6448
4	H	A	0.0000
5	K	A	-1.8806
6	G	A	-1.7334
7	H	A	-2.1525
1	K	B	-4.5835
2	K	B	-4.6611
3	G	B	-2.9239
4	H	B	0.0000
5	K	B	-1.9517
6	G	B	-1.8004
7	H	B	-2.1234
1	K	C	-5.0261
2	K	C	-4.9477
3	G	C	-3.0209
4	H	C	0.0000
5	K	C	-1.9608
6	G	C	-1.8355
7	H	C	-2.2515
1	K	D	-4.6735
2	K	D	-5.0328
3	G	D	-3.1046
4	H	D	0.0000
5	K	D	-1.8719
6	G	D	-1.9217
7	H	D	-2.2569
1	K	E	-3.9169
2	K	E	-4.1848
3	G	E	-2.6086
4	H	E	-2.5339
5	K	E	-2.1551
6	G	E	-1.7683
7	H	E	-1.8249
1	K	F	-3.9930
2	K	F	-4.3171
3	G	F	-2.8505
4	H	F	-3.0382
5	K	F	-2.9382
6	G	F	-2.0936
7	H	F	-1.9760
1	K	G	-4.4868
2	K	G	-4.7253
3	G	G	-3.0566
4	H	G	0.0000
5	K	G	-2.1803
6	G	G	-1.9620
7	H	G	-2.2910
1	K	H	-4.3582
2	K	H	-4.5352
3	G	H	-2.7229
4	H	H	0.0000
5	K	H	0.0000
6	G	H	-1.5676
7	H	H	-2.1429
1	K	I	-4.3582
2	K	I	-4.5540
3	G	I	-2.7649
4	H	I	0.0000
5	K	I	-1.6726
6	G	I	-1.6051
7	H	I	-2.1669
1	K	J	-4.3404
2	K	J	-4.7149
3	G	J	-2.8675
4	H	J	0.0000
5	K	J	-1.8246
6	G	J	-1.6745
7	H	J	-2.1931
1	K	K	-4.1737
2	K	K	-4.5223
3	G	K	-2.8028
4	H	K	0.0000
5	K	K	-1.7708
6	G	K	-1.6182
7	H	K	-2.1525
1	K	L	-4.2979
2	K	L	-4.4388
3	G	L	-2.7736
4	H	L	0.0000
5	K	L	-1.7853
6	G	L	-1.6005
7	H	L	-2.1316
1	K	M	-4.4001
2	K	M	-4.5733
3	G	M	-2.9177
4	H	M	0.0000
5	K	M	-1.7472
6	G	M	-1.6201
7	H	M	-2.0745
1	K	N	-4.6374
2	K	N	-4.8510
3	G	N	-3.2229
4	H	N	0.0000
5	K	N	-1.9908
6	G	N	-1.8372
7	H	N	-2.1288
1	K	O	-4.9289
2	K	O	-5.1207
3	G	O	-3.6627
4	H	O	0.0000
5	K	O	-2.5198
6	G	O	-2.1393
7	H	O	-2.3718
1	K	P	-4.2064
2	K	P	-4.3276
3	G	P	-3.2497
4	H	P	-3.4613
5	K	P	-3.1225
6	G	P	-2.0725
7	H	P	-2.1383
1	K	Q	-3.8941
2	K	Q	-3.7911
3	G	Q	-2.8344
4	H	Q	-2.6898
5	K	Q	-2.3477
6	G	Q	-1.7407
7	H	Q	-2.0516
1	K	R	-4.4664
2	K	R	-4.2967
3	G	R	-3.0705
4	H	R	0.0000
5	K	R	-2.3988
6	G	R	-2.0864
7	H	R	-2.3219
1	K	S	-4.3684
2	K	S	-4.4411
3	G	S	-2.7475
4	H	S	0.0000
5	K	S	-2.0992
6	G	S	-1.9345
7	H	S	-2.1217
1	K	T	-4.1978
2	K	T	-4.3365
3	G	T	-2.6888
4	H	T	0.0000
5	K	T	-1.7333
6	G	T	-1.7196
7	H	T	-2.0244