Project name: KKGHKGH20

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                                          (00:07:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:07:20)

• Minimal score value: -5.1196
• Maximal score value: 0.0
• Average score: -3.2985
• Total score value: -461.7871

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	-3.4672
2	K	A	-5.1196
3	G	A	-3.8926
4	H	A	-4.1321
5	K	A	-4.6778
6	G	A	-3.1454
7	H	A	-3.7128
1	K	B	-5.0930
2	K	B	-4.7265
3	G	B	-4.4964
4	H	B	-4.5261
5	K	B	-4.2849
6	G	B	0.0000
7	H	B	-3.5216
1	K	C	-3.5673
2	K	C	-4.0222
3	G	C	-3.8707
4	H	C	-3.6755
5	K	C	-3.2883
6	G	C	-2.2294
7	H	C	-2.3214
1	K	D	-3.3961
2	K	D	-3.5732
3	G	D	0.0000
4	H	D	-2.9696
5	K	D	-2.9457
6	G	D	0.0000
7	H	D	-1.6943
1	K	E	-4.3189
2	K	E	-3.8187
3	G	E	0.0000
4	H	E	-3.1351
5	K	E	-2.9621
6	G	E	0.0000
7	H	E	-2.9981
1	K	F	-3.1398
2	K	F	-3.6413
3	G	F	-3.8532
4	H	F	-4.1567
5	K	F	-4.3333
6	G	F	-3.2119
7	H	F	-3.0468
1	K	G	-3.6804
2	K	G	-3.6167
3	G	G	-2.9011
4	H	G	-3.0404
5	K	G	-3.0779
6	G	G	-2.0632
7	H	G	-3.0115
1	K	H	-2.7624
2	K	H	-3.4574
3	G	H	-2.7898
4	H	H	-2.8978
5	K	H	-3.3574
6	G	H	0.0000
7	H	H	-2.9190
1	K	I	-3.1493
2	K	I	-3.7063
3	G	I	-3.1581
4	H	I	-3.6282
5	K	I	-3.7572
6	G	I	-2.6619
7	H	I	-2.6421
1	K	J	-3.3179
2	K	J	-3.6910
3	G	J	-3.6629
4	H	J	-3.7690
5	K	J	-4.1503
6	G	J	0.0000
7	H	J	-3.2148
1	K	K	-3.2290
2	K	K	-4.1952
3	G	K	-3.4573
4	H	K	-3.9145
5	K	K	-3.9357
6	G	K	-2.6767
7	H	K	-2.8880
1	K	L	-3.5997
2	K	L	-3.9537
3	G	L	-3.9363
4	H	L	-3.3984
5	K	L	-3.1765
6	G	L	-2.4130
7	H	L	-2.8860
1	K	M	-3.1910
2	K	M	-4.3345
3	G	M	-3.4236
4	H	M	-3.7688
5	K	M	-4.3800
6	G	M	0.0000
7	H	M	-3.7083
1	K	N	-4.3906
2	K	N	-4.1107
3	G	N	-3.7061
4	H	N	-3.8123
5	K	N	-3.6710
6	G	N	-2.8850
7	H	N	-2.4639
1	K	O	-3.5081
2	K	O	-3.6350
3	G	O	-3.0181
4	H	O	-3.3894
5	K	O	-3.3100
6	G	O	-2.1815
7	H	O	-1.9675
1	K	P	-3.7280
2	K	P	-4.4748
3	G	P	-4.3761
4	H	P	-4.1435
5	K	P	-3.6586
6	G	P	-2.3878
7	H	P	-2.0032
1	K	Q	-3.6361
2	K	Q	-3.8290
3	G	Q	-3.1682
4	H	Q	-3.8060
5	K	Q	-4.2806
6	G	Q	-4.0467
7	H	Q	-4.5008
1	K	R	-2.9936
2	K	R	-3.4376
3	G	R	-3.4865
4	H	R	-3.6122
5	K	R	-3.8101
6	G	R	-3.2163
7	H	R	-2.1601
1	K	S	-3.1784
2	K	S	-4.1962
3	G	S	-4.4214
4	H	S	-4.8013
5	K	S	-4.6370
6	G	S	-3.1473
7	H	S	-2.9872
1	K	T	-4.4711
2	K	T	-4.9937
3	G	T	-4.3349
4	H	T	-3.4156
5	K	T	-3.3608
6	G	T	-1.8184
7	H	T	-1.7030