Project name: MUT8

Status: done

Started: 2026-08-16 07:40:57
Chain sequence(s) A: QCISPGTGYNNGYFYSYWNDGRGGVTYCNGPGGQFSVNWSNSGNFVGGKGWQPGTKNKVINFSGSYNPNGNSYLSVYGWTRNPLIEYYIVENFGTYNPSTGATKLGEVTSDGSVYDIYQTQRVNQPSIIGTATFYQYWSVRRNHRSSGTVNTANHFNAWAALGLTLGTMDYQIVAVEGYFSSGSADITVS
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                                          (00:02:25)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:28)
Show buried residues
Minimal score value
-2.5707
Maximal score value
1.9233
Average score
-0.4331
Total score value
-82.2809
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 -0.7496
2 C A 0.3662
3 I A 0.3978
4 S A 0.1034
5 P A -0.2343
6 G A -0.2391
7 T A 0.1221
8 G A 0.4389
9 Y A 0.8374
10 N A -0.4740
11 N A -1.3900
12 G A -0.7341
13 Y A -0.1896
14 F A 0.0000
15 Y A 0.2453
16 S A 0.0000
17 Y A 0.0000
18 W A 0.0095
19 N A -0.8640
20 D A -1.3916
21 G A -1.7982
22 R A -2.5707
23 G A -1.9446
24 G A -1.4233
25 V A -1.0861
26 T A -0.2899
27 Y A 0.0000
28 C A -0.1517
29 N A 0.0000
30 G A -0.8848
31 P A -1.0283
32 G A -1.0316
33 G A 0.0000
34 Q A -0.9119
35 F A 0.0000
36 S A -0.8159
37 V A 0.0000
38 N A -1.5601
39 W A 0.0000
40 S A -1.2251
41 N A -1.3608
42 S A 0.0000
43 G A 0.0000
44 N A -0.1967
45 F A 0.0000
46 V A 0.0000
47 G A 0.0000
48 G A 0.0000
49 K A 0.0000
50 G A 0.0000
51 W A 0.0207
52 Q A -0.2951
53 P A -0.4559
54 G A 0.0000
55 T A -0.9536
56 K A -1.8177
57 N A -1.8903
58 K A -0.7367
59 V A 0.4004
60 I A 0.0000
61 N A -0.6829
62 F A 0.0000
63 S A -0.7648
64 G A -0.7865
65 S A -0.9728
66 Y A -1.0857
67 N A -1.8599
68 P A -1.5929
69 N A -1.7978
70 G A -0.6401
71 N A 0.0968
72 S A 0.0000
73 Y A 0.0868
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 -1.3832
82 N A -1.8407
83 P A -1.1106
84 L A -0.2846
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 -0.8781
93 F A -0.2928
94 G A -0.6049
95 T A -0.1758
96 Y A 0.5405
97 N A -0.1956
98 P A -0.1153
99 S A 0.0000
100 T A -0.4830
101 G A -0.8029
102 A A -0.7927
103 T A -0.9845
104 K A -1.8159
105 L A -0.5860
106 G A -0.9748
107 E A -1.7042
108 V A -0.8202
109 T A -0.4520
110 S A 0.0000
111 D A -0.8858
112 G A -0.8522
113 S A 0.0000
114 V A -0.7808
115 Y A 0.0000
116 D A 0.0000
117 I A 0.0000
118 Y A -0.7911
119 Q A -0.5132
120 T A -0.5755
121 Q A -0.7019
122 R A -0.7218
123 V A 0.4006
124 N A -1.1067
125 Q A -1.1528
126 P A -0.4467
127 S A 0.2545
128 I A 1.2021
129 I A 1.9233
130 G A 0.4268
131 T A -0.2448
132 A A -0.1019
133 T A -0.2385
134 F A 0.0000
135 Y A 0.3619
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 -2.4559
143 N A -2.4971
144 H A -1.9233
145 R A -1.2612
146 S A -0.7707
147 S A -0.6642
148 G A -0.6764
149 T A -0.4055
150 V A 0.0000
151 N A -0.5996
152 T A 0.0000
153 A A -1.3870
154 N A -1.2948
155 H A 0.0000
156 F A 0.0000
157 N A -1.6078
158 A A -0.8802
159 W A 0.0000
160 A A -0.2967
161 A A -0.0722
162 L A 0.2791
163 G A -0.1551
164 L A 0.0000
165 T A -0.3146
166 L A -0.5943
167 G A -0.9596
168 T A -0.8755
169 M A -0.6733
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 0.0695
178 G A 0.0000
179 Y A 1.3777
180 F A 1.0404
181 S A 0.0000
182 S A -1.1172
183 G A -1.5831
184 S A -1.4414
185 A A 0.0000
186 D A -1.3763
187 I A 0.0000
188 T A -0.7586
189 V A 0.0000
190 S A -0.3508
Download PDB file
View in 3Dmol