Project name: 65e5547bd8e3354

Chain sequence(s)	A: KCNTATCATQRLANFLVRSSNNLGPVLPPTNVGSNTY; C: KCNTATCATQRLANFLVRSSNNLGPVLPPTNVGSNTY; B: KCNTATCATQRLANFLVRSSNNLGPVLPPTNVGSNTY; D: KCNTATCATQRLANFLVRSSNNLGPVLPPTNVGSNTY
Selected Chain(s)	A,C,B,D
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                                          (00:01:48)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:49)

• Minimal score value: -3.3107
• Maximal score value: 2.289
• Average score: -0.3264
• Total score value: -48.3118

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	-2.7618
2	C	A	-1.7462
3	N	A	-1.9534
4	T	A	-0.8362
5	A	A	-0.1275
6	T	A	0.0000
7	C	A	0.6997
8	A	A	0.0000
9	T	A	-0.5336
10	Q	A	0.0000
11	R	A	-2.4929
12	L	A	-0.8748
13	A	A	-0.0897
14	N	A	1.0079
15	F	A	2.2890
16	L	A	0.0000
17	V	A	-0.2861
18	R	A	-2.6227
19	S	A	-1.8865
20	S	A	-1.3162
21	N	A	-1.3740
22	N	A	0.0792
23	L	A	1.5825
24	G	A	1.2992
25	P	A	1.3637
26	V	A	2.2142
27	L	A	0.9338
28	P	A	0.1782
29	P	A	-0.5101
30	T	A	-0.8134
31	N	A	-1.4444
32	V	A	-0.4122
33	G	A	-0.9475
34	S	A	-0.8206
35	N	A	-1.0431
36	T	A	0.1390
37	Y	A	1.5483
1	K	B	-3.3107
2	C	B	-2.1083
3	N	B	-1.7127
4	T	B	0.0000
5	A	B	-0.0830
6	T	B	0.0000
7	C	B	0.6043
8	A	B	0.0000
9	T	B	-0.7790
10	Q	B	0.0000
11	R	B	-2.9855
12	L	B	0.0000
13	A	B	-0.3897
14	N	B	0.0000
15	F	B	1.7509
16	L	B	0.0000
17	V	B	-0.7666
18	R	B	-3.2431
19	S	B	-2.3283
20	S	B	0.0000
21	N	B	-1.1056
22	N	B	0.0000
23	L	B	1.1805
24	G	B	0.0000
25	P	B	0.0000
26	V	B	1.8018
27	L	B	0.0000
28	P	B	0.3341
29	P	B	-0.5807
30	T	B	0.0000
31	N	B	-1.3913
32	V	B	0.0000
33	G	B	-0.8855
34	S	B	0.0000
35	N	B	-0.4859
36	T	B	0.0000
37	Y	B	1.9677
1	K	C	-3.1387
2	C	C	-1.9742
3	N	C	-1.4925
4	T	C	0.0000
5	A	C	-0.0568
6	T	C	0.0000
7	C	C	0.5196
8	A	C	0.0000
9	T	C	-1.0119
10	Q	C	0.0000
11	R	C	-3.1844
12	L	C	0.0000
13	A	C	0.0000
14	N	C	0.0000
15	F	C	1.8120
16	L	C	0.0000
17	V	C	-0.4799
18	R	C	-3.0226
19	S	C	-2.2245
20	S	C	0.0000
21	N	C	-0.9949
22	N	C	0.0000
23	L	C	1.2250
24	G	C	0.0000
25	P	C	0.0000
26	V	C	1.5606
27	L	C	0.0000
28	P	C	0.3332
29	P	C	-0.5608
30	T	C	0.0000
31	N	C	-1.3575
32	V	C	0.0000
33	G	C	-0.9049
34	S	C	0.0000
35	N	C	-0.3771
36	T	C	0.0000
37	Y	C	1.8782
1	K	D	-2.4044
2	C	D	-1.3064
3	N	D	-1.1013
4	T	D	-0.4238
5	A	D	-0.0549
6	T	D	0.1503
7	C	D	0.4437
8	A	D	-0.0347
9	T	D	-0.9043
10	Q	D	-1.7139
11	R	D	-2.4862
12	L	D	-0.5792
13	A	D	0.0590
14	N	D	0.7811
15	F	D	2.1643
16	L	D	1.0329
17	V	D	0.2563
18	R	D	-2.3182
19	S	D	-1.6129
20	S	D	-1.0669
21	N	D	-1.2389
22	N	D	0.0697
23	L	D	1.4093
24	G	D	1.0202
25	P	D	1.4014
26	V	D	1.9325
27	L	D	1.0599
28	P	D	0.2603
29	P	D	-0.4528
30	T	D	-0.8547
31	N	D	-1.3938
32	V	D	-0.5020
33	G	D	-0.7534
34	S	D	-0.6322
35	N	D	-0.8250
36	T	D	0.3045
37	Y	D	1.5296