Project name: S80T

Status: done

Started: 2026-08-16 07:23:03
Chain sequence(s) A: QCIQPGTGYNNGYFYSYWNDGHGGVTYCNGPGGQFSVNWSNSGNFVGGKGWQPGTKNKVINFSGSYNPNGNSYLSVYGWTRNPLIEYYIVENFGTYNPSTGATKLGEVTSDGSVYDIYRTQRVNQPSIIGTATFYQYWSVRRNHRSSGSVNTANHFNAWAQQGLTLGTMDYQIVAVEGYFSSGSASITVS
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log 
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:02)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (00:02:21)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:23)
Show buried residues
Minimal score value
-2.4506
Maximal score value
1.9383
Average score
-0.5013
Total score value
-95.2471
Download the table (csv)

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 Q A -0.7999
2 C A 0.1160
3 I A -0.1979
4 Q A -0.9048
5 P A -0.7075
6 G A -0.4712
7 T A -0.0025
8 G A 0.4180
9 Y A 0.7911
10 N A -0.5933
11 N A -1.4668
12 G A -0.7726
13 Y A -0.2423
14 F A 0.0000
15 Y A 0.2251
16 S A 0.2316
17 Y A 0.0000
18 W A -0.1081
19 N A -0.8710
20 D A -1.3710
21 G A -1.4995
22 H A -1.6995
23 G A -1.5718
24 G A -1.2107
25 V A -1.0932
26 T A -0.4935
27 Y A 0.0000
28 C A -0.2631
29 N A 0.0000
30 G A -0.8812
31 P A -1.0983
32 G A -1.1083
33 G A 0.0000
34 Q A -0.9523
35 F A 0.0000
36 S A -0.5573
37 V A 0.0000
38 N A -1.5442
39 W A 0.0000
40 S A -1.1983
41 N A -1.1500
42 S A 0.0000
43 G A 0.0000
44 N A 0.0665
45 F A 0.0000
46 V A 0.3104
47 G A 0.0000
48 G A 0.0000
49 K A 0.0000
50 G A 0.0000
51 W A 0.0201
52 Q A -0.2813
53 P A -0.4484
54 G A 0.0000
55 T A -1.0824
56 K A -1.9633
57 N A -2.1558
58 K A -1.2730
59 V A -0.2950
60 I A 0.0000
61 N A -1.1547
62 F A 0.0000
63 S A -0.7961
64 G A -0.5977
65 S A -0.7318
66 Y A -0.9205
67 N A -1.7931
68 P A -1.5690
69 N A -1.7398
70 G A -0.5926
71 N A 0.1789
72 S A 0.0000
73 Y A 0.1269
74 L A 0.0000
75 S A 0.0000
76 V A 0.0000
77 Y A 0.0000
78 G A 0.0000
79 W A 0.0000
80 T A 0.0000
81 R A -0.9839
82 N A -1.6389
83 P A -0.9874
84 L A -0.1502
85 I A 0.0000
86 E A 0.0000
87 Y A 0.0000
88 Y A 0.0000
89 I A 0.0000
90 V A 0.0000
91 E A 0.0000
92 N A -1.0034
93 F A -0.3313
94 G A -0.6673
95 T A -0.2783
96 Y A 0.3159
97 N A -0.2821
98 P A 0.0000
99 S A 0.0000
100 T A -0.5249
101 G A -0.8605
102 A A -0.9559
103 T A -1.1606
104 K A -1.9991
105 L A -0.9882
106 G A -1.4514
107 E A -1.9814
108 V A -0.9860
109 T A -0.5340
110 S A 0.0000
111 D A -0.8221
112 G A -0.8324
113 S A 0.0000
114 V A -0.8932
115 Y A 0.0000
116 D A -1.3923
117 I A 0.0000
118 Y A 0.0000
119 R A -1.0728
120 T A -0.9394
121 Q A -1.0135
122 R A -0.8823
123 V A 0.3270
124 N A -1.1032
125 Q A -1.1239
126 P A -0.3860
127 S A 0.2372
128 I A 1.1937
129 I A 1.9383
130 G A 0.4138
131 T A -0.2442
132 A A -0.1065
133 T A -0.3247
134 F A 0.0000
135 Y A -0.0699
136 Q A 0.0000
137 Y A 0.0000
138 W A 0.0000
139 S A 0.0000
140 V A 0.0000
141 R A 0.0000
142 R A -2.3200
143 N A -2.4506
144 H A -1.9466
145 R A -1.2842
146 S A -0.7254
147 S A -0.7622
148 G A -0.7852
149 S A -0.6702
150 V A 0.0000
151 N A -0.9852
152 T A 0.0000
153 A A -1.6008
154 N A -1.5085
155 H A 0.0000
156 F A 0.0000
157 N A -2.1367
158 A A -1.6593
159 W A 0.0000
160 A A -1.3146
161 Q A -1.9218
162 Q A -1.5586
163 G A -1.1395
164 L A 0.0000
165 T A -0.6709
166 L A -0.5219
167 G A -0.8160
168 T A -0.7354
169 M A -0.5796
170 D A 0.0000
171 Y A 0.0000
172 Q A 0.0000
173 I A 0.0000
174 V A 0.0000
175 A A 0.0000
176 V A 0.0000
177 E A 0.0000
178 G A 0.0000
179 Y A 1.5284
180 F A 1.5794
181 S A 0.0000
182 S A -1.0571
183 G A -1.6004
184 S A -1.3224
185 A A 0.0000
186 S A -0.7060
187 I A 0.0000
188 T A -0.7391
189 V A 0.0000
190 S A -0.5514
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