Project name: e6a2212d092beee

Chain sequence(s)	A: GIVEQCCTSICSLYQLENYCN; C: GIVEQCCTSICSLYQLENYCN; B: FVNQHLCGSHLVEALYLVCGERGFFYTPKT; E: GIVEQCCTSICSLYQLENYCN; D: FVNQHLCGSHLVEALYLVCGERGFFYTPK; G: GIVEQCCTSICSLYQLENYCN; F: FVNQHLCGSHLVEALYLVCGERGFFYTPK; I: GIVEQCCTSICSLYQLENYCN; H: FVNQHLCGSHLVEALYLVCGERGFFYTP; K: GIVEQCCTSICSLYQLENYCN; J: FVNQHLCGSHLVEALYLVCGERGFFYTPKT; L: FVNQHLCGSHLVEALYLVCGERGFFYTPKT
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                                          (00:03:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:19)

• Minimal score value: -3.126
• Maximal score value: 1.8694
• Average score: -0.5242
• Total score value: -156.2131

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	-1.5313
2	I	A	0.0000
3	V	A	-1.6133
4	E	A	-2.4718
5	Q	A	-1.5495
6	C	A	0.0000
7	C	A	-0.7856
8	T	A	-0.5411
9	S	A	0.2945
10	I	A	1.6026
11	C	A	0.9125
12	S	A	0.6901
13	L	A	0.5738
14	Y	A	0.5954
15	Q	A	-0.1618
16	L	A	0.0000
17	E	A	-1.5267
18	N	A	-1.7082
19	Y	A	-0.7407
20	C	A	-1.3881
21	N	A	-1.6570
1	F	B	1.4065
2	V	B	0.0000
3	N	B	-1.3706
4	Q	B	-1.3165
5	H	B	-0.3411
6	L	B	-0.3902
7	C	B	0.0000
8	G	B	0.0000
9	S	B	-0.3604
10	H	B	-0.4969
11	L	B	0.0000
12	V	B	0.0000
13	E	B	-0.5407
14	A	B	0.0000
15	L	B	0.0000
16	Y	B	0.0000
17	L	B	-0.2592
18	V	B	0.0000
19	C	B	0.0000
20	G	B	-1.3907
21	E	B	-2.9350
22	R	B	-2.6104
23	G	B	0.0000
24	F	B	0.0000
25	F	B	1.1239
26	Y	B	0.0000
27	T	B	-0.9495
28	P	B	-1.8092
29	K	B	-2.4960
1	G	C	-1.5351
2	I	C	0.0000
3	V	C	-1.5386
4	E	C	-2.4485
5	Q	C	-1.9501
6	C	C	0.0000
7	C	C	-0.7853
8	T	C	-0.6353
9	S	C	-0.0730
10	I	C	0.4264
11	C	C	-0.0209
12	S	C	0.1874
13	L	C	0.3903
14	Y	C	0.5410
15	Q	C	-0.6498
16	L	C	0.0000
17	E	C	-1.4753
18	N	C	-1.7603
19	Y	C	-0.9961
20	C	C	0.0000
21	N	C	-1.8690
1	F	D	1.8039
2	V	D	0.0000
3	N	D	-0.2882
4	Q	D	-0.3284
5	H	D	0.1278
6	L	D	0.0000
7	C	D	0.0000
8	G	D	0.0000
9	S	D	0.0000
10	H	D	-0.3725
11	L	D	0.0000
12	V	D	0.0000
13	E	D	-0.2336
14	A	D	0.0000
15	L	D	0.0000
16	Y	D	-0.2551
17	L	D	0.0092
18	V	D	-0.0972
19	C	D	0.0000
20	G	D	-1.5786
21	E	D	-2.9497
22	R	D	-2.6168
23	G	D	0.0000
24	F	D	0.0000
25	F	D	0.7164
26	Y	D	0.0000
27	T	D	-1.0563
28	P	D	-1.8747
29	K	D	-2.5027
1	G	E	-1.6726
2	I	E	0.0000
3	V	E	-1.7434
4	E	E	-2.5087
5	Q	E	-1.8484
6	C	E	0.0000
7	C	E	0.0000
8	T	E	-0.2851
9	S	E	0.4506
10	I	E	1.5973
11	C	E	0.7382
12	S	E	0.6173
13	L	E	0.6250
14	Y	E	0.5438
15	Q	E	-0.5106
16	L	E	0.0000
17	E	E	-1.4743
18	N	E	-1.6153
19	Y	E	-0.6875
20	C	E	-1.4655
21	N	E	-1.8600
2	V	F	-0.0190
3	N	F	-1.3098
4	Q	F	-1.4925
5	H	F	-0.6463
6	L	F	0.0000
7	C	F	0.0000
8	G	F	0.0000
9	S	F	-0.5053
10	H	F	-0.4221
11	L	F	0.0000
12	V	F	0.0000
13	E	F	-0.3891
14	A	F	-0.1166
15	L	F	0.0000
16	Y	F	0.0000
17	L	F	-0.1119
18	V	F	-0.2528
19	C	F	0.0000
20	G	F	-1.4329
21	E	F	-2.6808
22	R	F	-2.4964
23	G	F	0.0000
24	F	F	0.0000
25	F	F	0.5589
26	Y	F	0.0000
27	T	F	-1.0680
28	P	F	-1.8824
29	K	F	-2.6065
1	G	G	-1.4595
2	I	G	0.0000
3	V	G	-1.5412
4	E	G	-2.6491
5	Q	G	-2.1032
6	C	G	0.0000
7	C	G	-0.6857
8	T	G	-0.5458
9	S	G	0.2252
10	I	G	1.0287
11	C	G	0.2564
12	S	G	0.3804
13	L	G	0.4560
14	Y	G	0.5464
15	Q	G	-0.6379
16	L	G	0.0000
17	E	G	-1.3811
18	N	G	-1.7448
19	Y	G	-0.9007
20	C	G	-1.5358
21	N	G	-1.9164
1	F	H	1.7780
2	V	H	0.0000
3	N	H	-0.2882
4	Q	H	-0.6482
5	H	H	-0.2756
6	L	H	0.0000
7	C	H	0.0000
8	G	H	0.0000
9	S	H	0.0000
10	H	H	-0.4933
11	L	H	0.0000
12	V	H	0.0000
13	E	H	-0.7103
14	A	H	0.0000
15	L	H	0.0000
16	Y	H	-0.4740
17	L	H	-0.1731
18	V	H	0.0000
19	C	H	0.0000
20	G	H	-1.7683
21	E	H	-3.1260
22	R	H	-2.8570
23	G	H	0.0000
24	F	H	0.0000
25	F	H	0.6080
26	Y	H	0.0000
27	T	H	-0.7278
28	P	H	-1.3570
1	G	I	-1.6249
2	I	I	0.0000
3	V	I	-1.6102
4	E	I	-2.6171
5	Q	I	-1.5897
6	C	I	0.0000
7	C	I	-0.6824
8	T	I	-0.2424
9	S	I	0.4314
10	I	I	1.2526
11	C	I	0.0000
12	S	I	0.5508
13	L	I	0.6900
14	Y	I	0.6419
15	Q	I	-0.3930
16	L	I	0.0000
17	E	I	-1.4725
18	N	I	-1.6523
19	Y	I	-0.9049
20	C	I	-1.2627
21	N	I	-1.5593
1	F	J	0.3770
2	V	J	0.0000
3	N	J	-1.6529
4	Q	J	-1.6887
5	H	J	-0.8911
6	L	J	0.0000
7	C	J	0.0000
8	G	J	0.0000
9	S	J	0.0000
10	H	J	-0.2557
11	L	J	0.0000
12	V	J	0.0000
13	E	J	-0.3328
14	A	J	0.0000
15	L	J	0.0000
16	Y	J	0.0000
17	L	J	-0.0225
18	V	J	0.0000
19	C	J	0.0000
20	G	J	-1.3662
21	E	J	-2.7520
22	R	J	-2.3203
23	G	J	0.0000
24	F	J	0.0000
25	F	J	1.0344
26	Y	J	0.0000
27	T	J	-0.9677
28	P	J	-1.9927
29	K	J	-2.5555
1	G	K	-1.7563
2	I	K	0.0000
3	V	K	-1.6940
4	E	K	-2.8135
5	Q	K	-2.0217
6	C	K	0.0000
7	C	K	-0.7265
8	T	K	-0.2849
9	S	K	0.4535
10	I	K	1.1941
11	C	K	0.3390
12	S	K	0.3952
13	L	K	0.4639
14	Y	K	0.5758
15	Q	K	-0.5139
16	L	K	0.0000
17	E	K	-1.1888
18	N	K	-1.5790
19	Y	K	-0.4373
20	C	K	-1.0702
21	N	K	-1.5199
1	F	L	1.3395
2	V	L	0.1815
3	N	L	-1.1226
4	Q	L	-1.1598
5	H	L	-0.5960
6	L	L	0.0000
7	C	L	0.0000
8	G	L	0.0000
9	S	L	0.0000
10	H	L	-0.3294
11	L	L	0.0000
12	V	L	0.0000
13	E	L	-0.3737
14	A	L	0.0000
15	L	L	0.0000
16	Y	L	-0.3601
17	L	L	-0.0990
18	V	L	0.0000
19	C	L	0.0000
20	G	L	-1.4630
21	E	L	-2.8546
22	R	L	-2.5246
23	G	L	0.0000
24	F	L	0.0000
25	F	L	1.8694
26	Y	L	0.0000
27	T	L	-0.7568
28	P	L	-1.7042
29	K	L	-2.5193