Project name: 4d4d9bddd6d25fd

Status: done

Started: 2026-05-28 13:59:13
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Chain sequence(s) H: EVQLLESGGGLVQPGGSLRLSCAASGSIFSINAMHWFRQAPGKQRELVAVITSGGSTIYAESVKGRFTISRDNSKNTVYLQMNSLRPEDTAVYYCNAHVGLKVPTIQELSLGFGSWGQGTLVTVSS
input PDB
Selected Chain(s) H
Distance of aggregation 10 Å
FoldX usage Yes
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 H 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                                          (00:00:45)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:46)
Show buried residues

Minimal score value
-2.7021
Maximal score value
2.1875
Average score
-0.3096
Total score value
-39.0135

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 E H -2.2333
2 V H 0.0000
3 Q H -1.2336
4 L H 0.0000
5 L H 1.0329
6 E H 0.0000
7 S H -0.1360
8 G H -0.6023
9 G H 0.2429
11 G H 0.8916
12 L H 1.5116
13 V H 0.0029
14 Q H -1.3432
15 P H -1.7560
16 G H -1.3870
17 G H -0.9083
18 S H -0.9684
19 L H -0.4557
20 R H -1.1777
21 L H 0.0000
22 S H -0.1851
23 C H 0.0000
24 A H -0.2485
25 A H 0.0000
26 S H -0.9808
27 G H -0.9294
28 S H -0.1673
29 I H 0.6348
30 F H 2.1875
35 S H 0.0000
36 I H 0.0000
37 N H 0.2132
38 A H 0.0000
39 M H 0.0000
40 H H 0.3341
41 W H 0.0000
42 F H 0.4057
43 R H 0.0000
44 Q H -1.0433
45 A H -1.1060
46 P H -0.9893
47 G H -1.3365
48 K H -1.9521
49 Q H -2.2649
50 R H -1.8210
51 E H -0.9222
52 L H 0.4886
53 V H 0.0000
54 A H 0.0000
55 V H 0.0000
56 I H 0.0000
57 T H -0.3868
58 S H -0.6602
59 G H -0.8094
63 G H -0.9344
64 S H -0.1338
65 T H 0.6994
66 I H 1.6968
67 Y H 0.2657
68 A H -0.7226
69 E H -2.2506
70 S H -1.7375
71 V H 0.0000
72 K H -2.3049
74 G H -1.6944
75 R H -1.4019
76 F H 0.0000
77 T H -0.4428
78 I H 0.0000
79 S H -0.5143
80 R H -1.3231
81 D H -1.9711
82 N H -2.4621
83 S H -1.9855
84 K H -2.7021
85 N H -2.1085
86 T H -1.2602
87 V H 0.0000
88 Y H -0.3485
89 L H 0.0000
90 Q H -0.7783
91 M H 0.0000
92 N H -1.1333
93 S H -1.1778
94 L H 0.0000
95 R H -2.2808
96 P H -1.8903
97 E H -2.3226
98 D H 0.0000
99 T H -0.4613
100 A H 0.0000
101 V H 0.5961
102 Y H 0.0000
103 Y H 0.5541
104 C H 0.0000
105 N H 0.0000
106 A H 0.0000
107 H H -0.3868
108 V H 0.3718
109 G H 0.0000
110 L H 0.8614
111 K H 0.2262
111A V H 1.3303
111B P H 0.6374
111C T H 0.5962
112D I H 1.2385
112C Q H 0.4184
112B E H 0.5821
112A L H 1.6459
112 S H 1.1423
113 L H 1.7204
114 G H 0.3547
115 F H 1.0339
116 G H -0.0381
117 S H 0.0000
118 W H 0.9665
119 G H 0.1418
120 Q H -0.4215
121 G H 0.2841
122 T H 0.5548
123 L H 1.5718
124 V H 0.0000
125 T H 0.3387
126 V H 0.0000
127 S H -0.7113
128 S H -0.8839
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Laboratory of Theory of Biopolymers 2018