Project name: 84354cc561b7a84

Chain sequence(s)	A: MIGSEKQVNWAKSIIEKEVEAWEAIGVDVREVAAFLRSISDARVIIDNRNLIHFQSSGISYSLESSPLNSPIFLRRFSACSVGFEEIPTALQRIRSVYTAKLLED; C: MIGSEKQVNWAKSIIEKEVEAWEAIGVDVREVAAFLRSISDARVIIDNRNLIHFQSSGISYSLESSPLNSPIFLRRFSACSVGFEEIPTALQRIRSVYTAKLLED; B: MIGSEKQVNWAKSIIEKEVEAWEAIGVDVREVAAFLRSISDARVIIDNRNLIHFQSSGISYSLESSPLNSPIFLRRFSACSVGFEEIPTALQRIRSVYTAKLLED
Selected Chain(s)	A,C,B
Distance of aggregation	10 Å
FoldX usage	No
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]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:03)

• Minimal score value: -3.3815
• Maximal score value: 1.6275
• Average score: -0.7807
• Total score value: -245.9054

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	M	A	0.2303
2	I	A	0.1005
3	G	A	-1.1636
4	S	A	0.0000
5	E	A	-2.8107
6	K	A	-2.8651
7	Q	A	-2.1141
8	V	A	-1.8170
9	N	A	-2.5017
10	W	A	-1.8430
11	A	A	0.0000
12	K	A	-2.8090
13	S	A	-2.0389
14	I	A	0.0000
15	I	A	0.0000
16	E	A	-3.1816
17	K	A	-3.3815
18	E	A	0.0000
19	V	A	0.0000
20	E	A	-3.3533
21	A	A	-2.3566
22	W	A	0.0000
23	E	A	-3.2847
24	A	A	-1.4326
25	I	A	0.0000
26	G	A	-1.3685
27	V	A	-1.4393
28	D	A	-2.7220
29	V	A	0.0000
30	R	A	-2.9525
31	E	A	-2.2638
32	V	A	0.0000
33	A	A	0.0000
34	A	A	-1.0588
35	F	A	0.0000
36	L	A	0.0000
37	R	A	-2.0445
38	S	A	-0.3006
39	I	A	0.0000
40	S	A	0.0340
41	D	A	0.0000
42	A	A	0.0000
43	R	A	-0.8811
44	V	A	-0.7136
45	I	A	0.0000
46	I	A	0.0000
47	D	A	-1.8441
48	N	A	0.0000
49	R	A	-1.0421
50	N	A	-1.0967
51	L	A	0.4845
52	I	A	0.0000
53	H	A	-1.1005
54	F	A	0.0000
55	Q	A	-1.3249
56	S	A	-1.1401
57	S	A	-0.5936
58	G	A	-0.2219
59	I	A	-0.1468
60	S	A	-0.0675
61	Y	A	0.3079
62	S	A	-0.5080
63	L	A	0.0000
64	E	A	-1.7103
65	S	A	-0.7111
66	S	A	0.0000
67	P	A	0.0773
68	L	A	0.0000
69	N	A	-0.6645
70	S	A	0.1215
71	P	A	-0.4461
72	I	A	1.1255
73	F	A	0.2913
74	L	A	0.0000
75	R	A	-1.9179
76	R	A	-1.5352
77	F	A	0.0000
78	S	A	-0.9186
79	A	A	-0.9441
80	C	A	-0.1300
81	S	A	0.4499
82	V	A	1.0351
83	G	A	-0.4256
84	F	A	-1.3727
85	E	A	-2.6960
86	E	A	-2.6296
87	I	A	0.0000
88	P	A	-1.5825
89	T	A	-1.7945
90	A	A	0.0000
91	L	A	0.0000
92	Q	A	-2.1692
93	R	A	-1.9438
94	I	A	0.0000
95	R	A	-1.2579
96	S	A	-0.7693
97	V	A	0.1205
98	Y	A	0.0110
99	T	A	0.0493
100	A	A	-0.2748
101	K	A	-1.2829
102	L	A	0.1075
103	L	A	0.0477
104	E	A	-2.1066
105	D	A	-2.1191
1	M	B	0.6248
2	I	B	1.3301
3	G	B	-0.7209
4	S	B	-1.6605
5	E	B	-2.6926
6	K	B	-2.9084
7	Q	B	-2.1186
8	V	B	-1.5543
9	N	B	-1.7853
10	W	B	-1.2084
11	A	B	0.0000
12	K	B	-1.5803
13	S	B	-1.3737
14	I	B	0.0000
15	I	B	0.0000
16	E	B	-1.8540
17	K	B	-2.8757
18	E	B	0.0000
19	V	B	0.0000
20	E	B	-2.7818
21	A	B	-2.0835
22	W	B	0.0000
23	E	B	-3.1717
24	A	B	-1.3422
25	I	B	0.0000
26	G	B	-1.3894
27	V	B	-1.4799
28	D	B	-2.7456
29	V	B	0.0000
30	R	B	-2.9795
31	E	B	-2.2526
32	V	B	0.0000
33	A	B	0.0000
34	A	B	-0.8663
35	F	B	0.0000
36	L	B	0.0000
37	R	B	-0.5381
38	S	B	0.2548
39	I	B	0.0000
40	S	B	0.3091
41	D	B	-0.0736
42	A	B	0.0000
43	R	B	-2.1365
44	V	B	-1.4024
45	I	B	0.0000
46	I	B	0.0000
47	D	B	-2.3783
48	N	B	0.0000
49	R	B	-1.6133
50	N	B	-1.3470
51	L	B	0.2775
52	I	B	0.0000
53	H	B	-1.2577
54	F	B	0.0000
55	Q	B	-1.3170
56	S	B	-0.9422
57	S	B	-0.5679
58	G	B	-0.1901
59	I	B	-0.0972
60	S	B	-0.0266
61	Y	B	0.3195
62	S	B	0.0000
63	L	B	0.0000
64	E	B	-1.6980
65	S	B	-0.7030
66	S	B	0.0000
67	P	B	0.0247
68	L	B	0.0000
69	N	B	-0.6786
70	S	B	0.0580
71	P	B	-0.5165
72	I	B	1.0168
73	F	B	0.0000
74	L	B	0.0000
75	R	B	-1.9730
76	R	B	-1.5800
77	F	B	0.0000
78	S	B	-0.8966
79	A	B	-0.1978
80	C	B	0.3110
81	S	B	0.6005
82	V	B	1.1897
83	G	B	-0.4623
84	F	B	-1.3146
85	E	B	-2.7081
86	E	B	-2.6495
87	I	B	0.0000
88	P	B	-1.6033
89	T	B	-1.7769
90	A	B	0.0000
91	L	B	0.0000
92	Q	B	-2.2231
93	R	B	-2.0734
94	I	B	0.0000
95	R	B	-1.3388
96	S	B	-0.8921
97	V	B	0.1180
98	Y	B	0.0000
99	T	B	0.0269
100	A	B	-0.2800
101	K	B	-1.2653
102	L	B	0.2183
103	L	B	0.2189
104	E	B	-2.0784
105	D	B	-2.1041
1	M	C	1.0350
2	I	C	1.6275
3	G	C	-0.5294
4	S	C	-1.6789
5	E	C	-2.6717
6	K	C	-2.9916
7	Q	C	-2.2304
8	V	C	-1.5944
9	N	C	-2.1451
10	W	C	-1.4277
11	A	C	0.0000
12	K	C	-1.7458
13	S	C	-1.0908
14	I	C	0.0000
15	I	C	0.0000
16	E	C	-1.5618
17	K	C	-2.0792
18	E	C	0.0000
19	V	C	0.0000
20	E	C	-1.7950
21	A	C	-1.4796
22	W	C	0.0000
23	E	C	-2.2670
24	A	C	-1.0488
25	I	C	0.0000
26	G	C	-1.2343
27	V	C	-1.3270
28	D	C	-2.6448
29	V	C	0.0000
30	R	C	-2.9374
31	E	C	-2.2188
32	V	C	0.0000
33	A	C	0.0000
34	A	C	-0.8790
35	F	C	0.0000
36	L	C	0.0000
37	R	C	-0.6163
38	S	C	0.2669
39	I	C	0.0000
40	S	C	0.5297
41	D	C	0.0000
42	A	C	0.0000
43	R	C	-1.9939
44	V	C	-1.2786
45	I	C	0.0000
46	I	C	0.0000
47	D	C	-2.3788
48	N	C	0.0000
49	R	C	-1.6640
50	N	C	-1.3177
51	L	C	0.3148
52	I	C	0.0000
53	H	C	-1.1020
54	F	C	0.0000
55	Q	C	-1.3309
56	S	C	-0.9849
57	S	C	-0.6415
58	G	C	-0.2723
59	I	C	-0.1254
60	S	C	0.1352
61	Y	C	0.3335
62	S	C	-0.4927
63	L	C	0.0000
64	E	C	-1.7129
65	S	C	-0.7106
66	S	C	0.0000
67	P	C	0.0103
68	L	C	0.0000
69	N	C	-0.8974
70	S	C	0.0374
71	P	C	-0.5078
72	I	C	1.0237
73	F	C	0.0000
74	L	C	0.0000
75	R	C	-1.9534
76	R	C	-1.5162
77	F	C	0.0000
78	S	C	-0.9536
79	A	C	-0.2148
80	C	C	0.0000
81	S	C	0.4350
82	V	C	1.1691
83	G	C	-0.4689
84	F	C	-1.3181
85	E	C	-2.7162
86	E	C	-2.6718
87	I	C	0.0000
88	P	C	-1.6073
89	T	C	-1.7542
90	A	C	0.0000
91	L	C	0.0000
92	Q	C	-2.1488
93	R	C	-1.8732
94	I	C	0.0000
95	R	C	-1.2120
96	S	C	-0.6604
97	V	C	0.2250
98	Y	C	0.1495
99	T	C	0.2096
100	A	C	-0.1592
101	K	C	-1.0300
102	L	C	0.3639
103	L	C	0.1818
104	E	C	-2.0256
105	D	C	-2.0427