Project name: 65b74bc0d49dcac

Status: done

Started: 2026-04-05 04:47:40
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Chain sequence(s) A: QVQLQESGGGLVQAGGSLRLSCEASGDIESIRAMGWFRQAPGKQREFVGFISIDPRTGETTLNYGDFVKGRFTISRDNAKNTVYLQMSNLKSEDTGVYFCAASHWGTLLLKGIEYWGKGTQVTVSS
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:02)
Show buried residues

Minimal score value
-3.1407
Maximal score value
1.4412
Average score
-0.7657
Total score value
-96.4828

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
2 Q A -1.3341
3 V A -0.5150
4 Q A -1.5497
5 L A 0.0000
6 Q A -2.3142
7 E A 0.0000
8 S A -1.3079
9 G A -1.1533
10 G A -0.6695
11 G A 0.0520
12 L A 1.1580
13 V A 0.0757
14 Q A -1.3336
15 A A -1.5829
16 G A -1.7100
17 G A -1.1231
18 S A -1.3392
19 L A -0.9210
20 R A -2.0607
21 L A 0.0000
22 S A -1.3028
23 C A 0.0000
24 E A -2.8351
25 A A 0.0000
26 S A -1.3288
27 G A -0.7844
28 D A -0.3525
29 I A 1.4412
30 E A 0.0000
31 S A 0.5924
32 I A 1.3603
33 R A 0.4881
34 A A 0.0000
35 M A 0.0000
36 G A 0.0000
37 W A 0.0000
38 F A 0.0000
39 R A -1.3271
40 Q A -2.0308
41 A A -1.8850
42 P A -1.2856
43 G A -1.8218
44 K A -3.1407
45 Q A -3.0616
46 R A -2.6611
47 E A -2.5235
48 F A -0.8079
49 V A 0.0000
50 G A 0.0000
51 F A 0.0000
52 I A 0.0000
53 S A 0.0000
54 I A 0.0000
55 D A -1.2955
56 P A -1.4721
57 R A -2.6009
58 T A -1.7850
59 G A -1.7603
60 E A -2.4128
61 T A -1.4627
62 T A -0.5572
63 L A -0.0283
64 N A -0.4807
65 Y A -0.4313
66 G A -0.7339
67 D A -1.4784
68 F A 0.4101
69 V A 0.0000
70 K A -1.7896
71 G A -1.3687
72 R A -1.2474
73 F A 0.0000
74 T A -0.7391
75 I A 0.0000
76 S A -0.4914
77 R A -1.1587
78 D A -1.7167
79 N A -1.2762
80 A A -1.1554
81 K A -2.3327
82 N A -1.6792
83 T A 0.0000
84 V A 0.0000
85 Y A -0.8599
86 L A 0.0000
87 Q A -1.2536
88 M A 0.0000
89 S A -1.4914
90 N A -2.0687
91 L A 0.0000
92 K A -2.4444
93 S A -1.8575
94 E A -2.0584
95 D A 0.0000
96 T A -0.8338
97 G A 0.0000
98 V A -0.4009
99 Y A 0.0000
100 F A -0.7180
101 C A 0.0000
102 A A 0.0000
103 A A 0.0000
104 S A -0.1786
105 H A -0.4967
106 W A 0.6666
107 G A 0.0000
108 T A 0.5252
109 L A 0.6827
110 L A 0.0000
111 L A 0.4678
112 K A -1.2085
113 G A -0.8683
114 I A 0.0000
115 E A -1.6767
116 Y A -0.2817
117 W A -0.4661
118 G A -1.2450
119 K A -1.9276
120 G A -1.2157
121 T A -1.0089
122 Q A -0.6706
123 V A 0.0000
124 T A -0.1576
125 V A 0.0000
126 S A -0.7066
127 S A -0.7906
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Laboratory of Theory of Biopolymers 2018