Project name: f9e948d8c41fdab

Status: done

Started: 2026-05-28 13:08:35
Settings
Chain sequence(s) A: FTVTVPKDLYVVEYGSNMTIECKFPVEKQLDLAALIVYWEMEDKNIIQFVHGEEDLKVQHSSYRQRARLLKDQLSLGNAALQITDVKLQDAGVYRCMISYGGADYKRITHHHH
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage No
Dynamic mode No
Automated mutations No
Downloads Download all the data
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]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:01)
Show buried residues

Minimal score value
-3.2155
Maximal score value
1.5042
Average score
-0.7223
Total score value
-81.6164

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
residue index residue name chain Aggrescan3D score
mutation
1 F A 0.7227
2 T A 0.1856
3 V A 0.0000
4 T A -1.0264
5 V A -1.2625
6 P A -1.2906
7 K A -2.3119
8 D A -2.2722
9 L A 0.2023
10 Y A 0.7229
11 V A 1.5042
12 V A -0.0542
13 E A -1.6206
14 Y A -0.4261
15 G A -1.2965
16 S A -1.6339
17 N A -2.0561
18 M A 0.0000
19 T A -0.5079
20 I A 0.0000
21 E A -1.0953
22 C A 0.0000
23 K A -0.9856
24 F A 0.0000
25 P A -0.4974
26 V A -1.2472
27 E A -2.7157
28 K A -3.2155
29 Q A -2.3995
30 L A -1.2922
31 D A -1.6204
32 L A -0.5567
33 A A -0.5381
34 A A -0.2120
35 L A 0.0000
36 I A 0.4876
37 V A 0.0000
38 Y A 0.2509
39 W A 0.0000
40 E A -1.9759
41 M A 0.0000
42 E A -2.8777
43 D A -3.1049
44 K A -2.2123
45 N A -1.3189
46 I A 0.0000
47 I A 0.0000
48 Q A -0.5986
49 F A 0.0000
50 V A -0.5757
51 H A -1.3981
52 G A -1.5243
53 E A -2.2827
54 E A -1.6647
55 D A -1.2173
56 L A -0.3987
57 K A -1.1995
58 V A -0.0612
59 Q A -1.0431
60 H A -1.3228
61 S A -1.3779
62 S A -1.3656
63 Y A 0.0000
64 R A -2.6522
65 Q A -2.2120
66 R A 0.0000
67 A A 0.0000
68 R A -1.1092
69 L A 0.0000
70 L A -1.3668
71 K A -2.5727
72 D A -2.4277
73 Q A -1.3584
74 L A 0.0000
75 S A -0.7260
76 L A 0.6126
77 G A 0.0000
78 N A -0.6726
79 A A 0.0000
80 A A 0.0000
81 L A 0.0000
82 Q A -0.6878
83 I A 0.0000
84 T A -1.7698
85 D A -2.3084
86 V A 0.0000
87 K A -1.0232
88 L A 0.3120
89 Q A -0.6739
90 D A 0.0000
91 A A -0.0156
92 G A -0.1010
93 V A -0.1061
94 Y A 0.0000
95 R A -1.5031
96 C A 0.0000
97 M A 0.1662
98 I A 0.0000
99 S A 0.4603
100 Y A 0.1490
101 G A -0.1982
102 G A -0.0638
103 A A 0.3059
104 D A 0.2618
105 Y A 0.0685
106 K A -1.5288
107 R A -2.2937
108 I A 0.0000
109 T A -0.2122
110 H A 0.0000
111 H A 0.1115
112 H A 0.0000
113 H A -0.9028
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Laboratory of Theory of Biopolymers 2018