Project name: BCAB

Status: done

submitted: 2018-10-30 09:57:39, status changed: 2018-10-30 10:11:42
Settings
Chain sequence(s) A: SHHWGYGKHNGPEHWHKDFPIANGERQSPVDIDTKAVVQDPALKPLALVYGEATSRRMVNNGHSFNVEYDDSQDKAVLKDGPLTGTYRLVQFHFHWGSSDDQGSEHTVDRKKYAAELHLVHWNTKYGDFGTAAQQPDGLAVVGVFLKVGDANPALQKVLDALDSIKTKGKSTDFPNFDPGSLLPNVLDYWTYPGSLTTPPLLESVTWIVLKEPISVSSQQMLKFRTLNFNAEGEPELLMLANWRPAQPLKNRQVRGFPK
B: SHHWGYGKHNGPEHWHKDFPIANGERQSPVDIDTKAVVQDPALKPLALVYGEATSRRMVNNGHSFNVEYDDSQDKAVLKDGPLTGTYRLVQFHFHWGSSDDQGSEHTVDRKKYAAELHLVHWNTKYGDFGTAAQQPDGLAVVGVFLKVGDANPALQKVLDALDSIKTKGKSTDFPNFDPGSLLPNVLDYWTYPGSLTTPPLLESVTWIVLKEPISVSSQQMLKFRTLNFNAEGEPELLMLANWRPAQPLKNRQVRGFPK
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-3.4953
Maximal score value
1.3347
Average score
-0.896
Total score value
-464.1421

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 S A -0.5238
2 H A -0.7448
3 H A -1.3636
4 W A -1.0388
5 G A -0.7163
6 Y A -0.7655
7 G A -1.5474
8 K A -2.7447
9 H A -2.4403
10 N A -2.1040
11 G A 0.0000
12 P A -1.5302
13 E A -2.9488
14 H A -2.7041
15 W A 0.0000
16 H A -2.4797
17 K A -3.1604
18 D A -2.7586
19 F A -1.4294
20 P A -1.3596
21 I A -0.7892
22 A A 0.0000
23 N A -2.0977
24 G A -1.7084
25 E A -2.8147
26 R A -1.9172
27 Q A 0.0000
28 S A 0.0000
29 P A 0.0000
30 V A 0.0000
31 D A -1.7385
32 I A 0.0000
33 D A -2.4044
34 T A -1.6916
35 K A -1.9857
36 A A -1.2349
37 V A -1.2388
38 V A -1.0663
39 Q A -1.8603
40 D A -1.5010
41 P A -1.1254
42 A A -0.7639
43 L A 0.0000
44 K A -2.2544
45 P A -1.3575
46 L A 0.0000
47 A A -0.4149
48 L A 0.4316
49 V A 0.3746
50 Y A 0.0000
51 G A -1.3851
52 E A -2.6570
53 A A -2.1780
54 T A -2.0324
55 S A 0.0000
56 R A -2.7767
57 R A -2.5408
58 M A 0.0000
59 V A -1.1596
60 N A 0.0000
61 N A -0.6922
62 G A 0.0000
63 H A -0.1260
64 S A 0.0000
65 F A 0.0000
66 N A -0.5716
67 V A 0.0000
68 E A -1.9542
69 Y A 0.0000
70 D A -1.9038
71 D A -1.8644
72 S A -1.7786
73 Q A -2.5924
74 D A -2.9894
75 K A -2.5309
76 A A 0.0000
77 V A 0.0000
78 L A 0.0000
79 K A -1.3518
80 D A -2.1150
81 G A 0.0000
82 P A -0.9917
83 L A -0.9601
84 T A -0.7568
85 G A -1.2484
86 T A -1.2871
87 Y A 0.0000
88 R A -1.1709
89 L A 0.0000
90 V A -0.4620
91 Q A -0.8761
92 F A 0.0000
93 H A 0.0000
94 F A 0.0000
95 H A 0.0000
96 W A 0.0000
97 G A 0.0000
98 S A -0.0919
99 S A -0.7646
100 D A -1.6129
101 D A -2.6509
102 Q A -2.0187
103 G A 0.0000
104 S A 0.0000
105 E A 0.0000
106 H A 0.0000
107 T A 0.0000
108 V A 0.0000
109 D A -3.0689
110 R A -3.4826
111 K A -3.4953
112 K A -3.1006
113 Y A 0.0000
114 A A 0.0000
115 A A 0.0000
116 E A 0.0000
117 L A 0.0000
118 H A 0.0000
119 L A 0.0000
120 V A 0.0000
121 H A 0.0000
122 W A 0.0000
123 N A 0.0000
124 T A -1.6508
125 K A -2.0513
126 Y A -1.4055
127 G A -1.3040
128 D A -1.3865
129 F A -0.4008
130 G A -0.7337
131 T A -1.0532
132 A A 0.0000
133 A A 0.0000
134 Q A -1.5698
135 Q A -1.4851
136 P A -1.1618
137 D A -1.3209
138 G A 0.0000
139 L A 0.0000
140 A A 0.0000
141 V A 0.0000
142 V A 0.0000
143 G A 0.0000
144 V A 0.0000
145 F A 0.0000
146 L A 0.0000
147 K A -2.0074
148 V A -1.1698
149 G A -1.5666
150 D A -2.2896
151 A A -1.5508
152 N A -1.0164
153 P A -1.2027
154 A A -1.1287
155 L A 0.0000
156 Q A -2.4771
157 K A -2.7605
158 V A 0.0000
159 L A 0.0000
160 D A -3.1005
161 A A 0.0000
162 L A 0.0000
163 D A -2.4585
164 S A -1.7813
165 I A 0.0000
166 K A -1.5185
167 T A -1.8226
168 K A -1.6805
169 G A -1.5581
170 K A -1.8921
171 S A -1.3856
172 T A -1.7484
173 D A -2.5570
174 F A 0.0000
175 P A -2.1608
176 N A -2.3520
177 F A 0.0000
178 D A -2.5298
179 P A 0.0000
180 G A -0.7371
181 S A -0.8484
182 L A 0.0000
183 L A -0.2696
184 P A -0.5481
185 N A -0.8854
186 V A 0.2071
187 L A 0.1388
188 D A -0.6114
189 Y A 0.0000
190 W A 0.0000
191 T A 0.0000
192 Y A 0.0000
193 P A -0.8277
194 G A 0.0000
195 S A 0.0000
196 L A 0.1534
197 T A 0.0000
198 T A 0.1379
199 P A 0.0000
200 P A -0.1297
201 L A 0.0000
202 L A -0.0616
203 E A -0.8132
204 S A 0.0000
205 V A 0.0000
206 T A -0.2236
207 W A 0.0000
208 I A 0.0000
209 V A 0.0000
210 L A 0.0000
211 K A -0.6172
212 E A -1.2572
213 P A -0.8784
214 I A 0.0000
215 S A -1.2255
216 V A 0.0000
217 S A -1.2447
218 S A -1.0170
219 Q A -1.2719
220 Q A 0.0000
221 M A 0.0000
222 L A 0.2627
223 K A -0.8905
224 F A 0.0000
225 R A 0.0000
226 T A 0.1756
227 L A 0.0000
228 N A 0.0000
229 F A -0.0157
230 N A 0.0000
231 A A -2.1744
232 E A -3.2986
233 G A -2.5766
234 E A -3.0213
235 P A -1.9057
236 E A -1.7787
237 L A 0.8737
238 L A 1.3347
239 M A 0.0000
240 L A 1.2138
241 A A 0.3428
242 N A 0.0000
243 W A 0.1474
244 R A 0.0000
245 P A -0.4318
246 A A -0.4637
247 Q A -0.9283
248 P A -1.4046
249 L A -1.4811
250 K A -2.6844
251 N A -2.6345
252 R A -2.1788
253 Q A -1.7296
254 V A 0.0000
255 R A -1.4331
256 G A 0.0000
257 F A -1.4023
258 P A -1.5730
259 K A -2.2110
1 S B -0.6720
2 H B -0.9120
3 H B -1.4771
4 W B 0.0000
5 G B 0.0000
6 Y B -0.8110
7 G B -1.5724
8 K B -2.7226
9 H B -2.3667
10 N B -2.1672
11 G B 0.0000
12 P B -1.5219
13 E B -2.8869
14 H B -2.6367
15 W B 0.0000
16 H B -2.4455
17 K B -3.1422
18 D B -2.7600
19 F B -1.3771
20 P B -1.3534
21 I B -0.8338
22 A B 0.0000
23 N B -2.1260
24 G B -1.7950
25 E B -2.8856
26 R B -1.9447
27 Q B 0.0000
28 S B 0.0000
29 P B 0.0000
30 V B 0.0000
31 D B -1.7449
32 I B 0.0000
33 D B -2.6470
34 T B -1.7917
35 K B -2.0644
36 A B -1.3460
37 V B -1.2957
38 V B -1.0617
39 Q B -1.8447
40 D B -1.4633
41 P B -1.1333
42 A B -0.7023
43 L B 0.0000
44 K B -1.9680
45 P B -1.1899
46 L B 0.0000
47 A B -0.3240
48 L B 0.4909
49 V B 0.4542
50 Y B 0.0000
51 G B -1.3439
52 E B -2.6071
53 A B -2.1129
54 T B -1.9542
55 S B 0.0000
56 R B -2.4595
57 R B -2.5204
58 M B 0.0000
59 V B -1.0990
60 N B 0.0000
61 N B -0.7554
62 G B 0.0000
63 H B -0.2982
64 S B 0.0000
65 F B 0.0000
66 N B -0.4506
67 V B 0.0000
68 E B -1.4818
69 Y B 0.0000
70 D B -1.6637
71 D B -1.7023
72 S B -1.7407
73 Q B -2.5313
74 D B -2.9279
75 K B -2.4349
76 A B 0.0000
77 V B 0.0000
78 L B 0.0000
79 K B -1.2631
80 D B -1.9376
81 G B 0.0000
82 P B -0.9858
83 L B 0.0000
84 T B -0.9510
85 G B -1.2433
86 T B -1.2810
87 Y B 0.0000
88 R B -1.1341
89 L B 0.0000
90 V B -0.4164
91 Q B -0.7108
92 F B 0.0000
93 H B -0.2388
94 F B 0.0000
95 H B 0.0000
96 W B 0.0000
97 G B 0.0000
98 S B -0.1511
99 S B -0.7920
100 D B -1.4344
101 D B -2.5547
102 Q B -1.9874
103 G B 0.0000
104 S B 0.0000
105 E B 0.0000
106 H B 0.0000
107 T B 0.0000
108 V B -1.9936
109 D B -2.9546
110 R B -3.3762
111 K B -3.3311
112 K B -2.8229
113 Y B -1.6271
114 A B 0.0000
115 A B 0.0000
116 E B 0.0000
117 L B 0.0000
118 H B 0.0000
119 L B 0.0000
120 V B 0.0000
121 H B 0.0000
122 W B 0.0000
123 N B 0.0000
124 T B -1.6770
125 K B -2.0567
126 Y B -1.3939
127 G B -1.3127
128 D B -1.4510
129 F B -0.4098
130 G B -0.7325
131 T B -1.0533
132 A B 0.0000
133 A B 0.0000
134 Q B -1.5635
135 Q B -1.4654
136 P B -1.1624
137 D B -1.3630
138 G B 0.0000
139 L B 0.0000
140 A B 0.0000
141 V B 0.0000
142 V B 0.0000
143 G B 0.0000
144 V B 0.0000
145 F B 0.0000
146 L B 0.0000
147 K B -1.5293
148 V B -0.8408
149 G B -1.3936
150 D B -2.2139
151 A B -1.4014
152 N B -0.9919
153 P B -1.1556
154 A B -1.0626
155 L B 0.0000
156 Q B -2.3763
157 K B -2.5525
158 V B 0.0000
159 L B 0.0000
160 D B -3.0507
161 A B -2.2935
162 L B 0.0000
163 D B -2.5407
164 S B -1.8343
165 I B 0.0000
166 K B -1.6809
167 T B -2.0228
168 K B -1.6584
169 G B -1.6020
170 K B -1.8728
171 S B -1.3968
172 T B -1.7502
173 D B -2.6488
174 F B 0.0000
175 P B -2.2975
176 N B -2.6342
177 F B 0.0000
178 D B -2.5485
179 P B 0.0000
180 G B -0.5979
181 S B -0.8461
182 L B 0.0000
183 L B -0.2160
184 P B 0.0000
185 N B -0.9254
186 V B 0.0176
187 L B 0.1669
188 D B -0.5476
189 Y B 0.0000
190 W B 0.0000
191 T B 0.0000
192 Y B 0.0000
193 P B -0.7649
194 G B 0.0000
195 S B 0.0000
196 L B 0.1492
197 T B 0.0000
198 T B 0.0783
199 P B -0.2438
200 P B -0.1708
201 L B 0.0000
202 L B -0.1141
203 E B -0.8349
204 S B 0.0000
205 V B 0.0000
206 T B -0.2528
207 W B 0.0000
208 I B 0.0000
209 V B 0.0000
210 L B 0.0000
211 K B -0.4658
212 E B -0.8700
213 P B -0.5678
214 I B 0.0000
215 S B -0.9927
216 V B 0.0000
217 S B 0.0000
218 S B -0.8837
219 Q B -1.1696
220 Q B -0.8481
221 M B 0.0000
222 L B 0.5799
223 K B -0.9242
224 F B 0.0000
225 R B 0.3631
226 T B 0.0285
227 L B 0.0000
228 N B 0.0000
229 F B -0.3969
230 N B -1.6098
231 A B -2.3983
232 E B -3.3705
233 G B -2.6015
234 E B -3.1220
235 P B -2.1306
236 E B -2.1442
237 L B 0.1805
238 L B 0.7822
239 M B 0.0000
240 L B 1.0192
241 A B 0.2590
242 N B 0.0000
243 W B 0.1523
244 R B 0.0000
245 P B -0.4984
246 A B -0.4649
247 Q B -0.9766
248 P B -1.5339
249 L B -1.6328
250 K B -2.9007
251 N B -2.6925
252 R B -2.2118
253 Q B -1.7587
254 V B 0.0000
255 R B -1.3571
256 G B 0.0000
257 F B -1.2595
258 P B -1.4622
259 K B -2.1619

 

Laboratory of Theory of Biopolymers 2015