Project name: Mb5-11_LVFIVI

Chain sequence(s)	A: MQANSGSLEVVEASPTSLQLSWDAFHRYHNGFTHPVRYYRVTYGETGGNSPVQEFTVPGSKSTATFSGLKPGVDYTITVYAVTWYPRYGYGESGPVSINYRTELDKPSQ
Selected Chain(s)	A
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 A 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                                          (00:01:05)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:06)

• Minimal score value: -2.7137
• Maximal score value: 1.4658
• Average score: -0.7182
• Total score value: -78.2848

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	0.1962
2	Q	A	-1.0009
3	A	A	0.0000
4	N	A	-1.9529
5	S	A	-1.5649
6	G	A	0.0000
7	S	A	-1.4039
8	L	A	0.0000
9	E	A	-2.0303
10	V	A	-0.8759
11	V	A	-0.3211
12	E	A	-1.6526
13	A	A	-1.2931
14	S	A	-1.4301
15	P	A	-1.6805
16	T	A	-1.0924
17	S	A	-1.1371
18	L	A	0.0000
19	Q	A	-1.1632
20	L	A	0.0000
21	S	A	-1.2940
22	W	A	0.0000
23	D	A	-2.5052
24	A	A	-1.6240
25	F	A	0.0000
26	H	A	-1.2870
27	R	A	0.0000
28	Y	A	0.8378
29	H	A	0.2280
30	N	A	-0.5718
31	G	A	0.1234
32	F	A	1.4658
33	T	A	0.6938
34	H	A	0.0721
35	P	A	-0.3029
36	V	A	-0.8271
37	R	A	-0.9251
38	Y	A	-0.7251
39	Y	A	0.0000
40	R	A	-0.7995
41	V	A	0.0000
42	T	A	0.0000
43	Y	A	-0.3651
44	G	A	-0.5709
45	E	A	-1.2533
46	T	A	-1.0574
47	G	A	-1.1314
48	G	A	-1.2534
49	N	A	-1.4660
50	S	A	-0.8125
51	P	A	-0.3471
52	V	A	0.3440
53	Q	A	-1.2131
54	E	A	-1.8671
55	F	A	-0.7810
56	T	A	-0.2384
57	V	A	-0.4473
58	P	A	-0.9160
59	G	A	-1.1419
60	S	A	-1.2821
61	K	A	-1.9942
62	S	A	-1.3782
63	T	A	-1.0307
64	A	A	0.0000
65	T	A	-0.4569
66	F	A	0.0000
67	S	A	-0.7751
68	G	A	-0.9604
69	L	A	0.0000
70	K	A	-2.2163
71	P	A	-1.8229
72	G	A	-1.0859
73	V	A	-0.9752
74	D	A	-1.9451
75	Y	A	0.0000
76	T	A	-0.6709
77	I	A	0.0000
78	T	A	-0.4817
79	V	A	0.0000
80	Y	A	-0.3878
81	A	A	0.0000
82	V	A	0.0000
83	T	A	0.0000
84	W	A	0.5623
85	Y	A	0.0000
86	P	A	-0.4825
87	R	A	-1.1237
88	Y	A	0.6754
89	G	A	0.6265
90	Y	A	0.9938
91	G	A	0.4006
92	E	A	-0.6637
93	S	A	0.0000
94	G	A	-1.0224
95	P	A	-0.6291
96	V	A	0.0000
97	S	A	-0.5590
98	I	A	-0.5634
99	N	A	-1.6271
100	Y	A	-1.4692
101	R	A	-2.3720
102	T	A	0.0000
103	E	A	-1.9012
104	L	A	-0.9653
105	D	A	-2.5519
106	K	A	-2.7137
107	P	A	-1.7846
108	S	A	-1.6319
109	Q	A	-1.6579