Project name: 2ed85f2f33ca4a5

Status: done

Started: 2026-04-05 05:03:37
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Chain sequence(s) A: ETVLTQSPGTLSLSPGERATLSCRASQSLGSSYLAWYQQKPGQAPRLLIYGASSRAPGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYADSPITFGQGTRLEIK
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
-3.4712
Maximal score value
2.1385
Average score
-0.6493
Total score value
-70.1298

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
3 E A -1.5832
4 T A 0.0000
5 V A 1.0744
6 L A 0.0000
7 T A -0.6035
8 Q A 0.0000
9 S A -1.0345
10 P A -0.6981
11 G A -1.1842
12 T A -1.0042
13 L A -0.4088
14 S A -0.3536
15 L A -0.5143
16 S A -1.0481
17 P A -1.6633
18 G A -2.4110
19 E A -2.8201
20 R A -3.1095
21 A A 0.0000
22 T A -0.5448
23 L A 0.0000
24 S A -0.9455
25 C A 0.0000
26 R A -2.4369
27 A A 0.0000
28 S A -1.1049
29 Q A -1.7878
30 S A -1.4239
31 L A 0.0000
32 G A -0.5822
33 S A -0.3831
34 S A 0.2066
35 Y A 0.7888
36 L A 0.0000
37 A A 0.0000
38 W A 0.0000
39 Y A 0.1523
40 Q A 0.0000
41 Q A -1.3463
42 K A -1.5187
43 P A -1.0582
44 G A -1.3489
45 Q A -2.0009
46 A A -1.2690
47 P A -1.2882
48 R A -1.6545
49 L A -0.2629
50 L A 0.0000
51 I A 0.0000
52 Y A 0.7007
53 G A 0.1909
54 A A 0.0000
55 S A -0.6046
56 S A -0.6836
57 R A -1.6176
58 A A -0.7865
59 P A -0.7533
60 G A -1.0364
61 I A 0.0000
62 P A -1.4206
63 D A -2.4608
64 R A -1.9762
65 F A 0.0000
66 S A -1.0192
67 G A 0.0000
68 S A -0.6716
69 G A -1.1762
70 S A -1.1006
71 G A -1.3388
72 T A -1.8877
73 D A -2.3941
74 F A 0.0000
75 T A -0.8212
76 L A 0.0000
77 T A -0.7919
78 I A 0.0000
79 S A -2.4375
80 R A -3.4712
81 L A 0.0000
82 E A -2.0521
83 P A -1.0949
84 E A -1.7837
85 D A 0.0000
86 F A -0.4812
87 A A 0.0000
88 V A -0.7039
89 Y A 0.0000
90 Y A 0.0951
91 C A 0.0000
92 Q A 0.0000
93 Q A 0.0000
94 Y A 1.1280
95 A A 0.0191
96 D A -1.2057
97 S A -0.6578
98 P A 0.2419
99 I A 1.9158
100 T A 0.0000
101 F A 2.1385
102 G A 0.0000
103 Q A -0.8193
104 G A 0.0000
105 T A 0.0000
106 R A -1.9935
107 L A 0.0000
108 E A -0.2652
109 I A 0.9544
110 K A -0.8363
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Laboratory of Theory of Biopolymers 2018