Project name: 1T91

Status: done

submitted: 2018-02-20 19:12:18, status changed: 2018-02-20 19:26:33
Settings
Chain sequence(s) A: VLLKVIILGDSGVGKTSLMNQYVNKKFSNQYKATIGADFLTKEVMVDDRLVTMQIWDTAGLERFQSLGVAFYRGADCCVLVFDVTAPNTFKTLDSWRDEFLIQASPRDPENFPFVVLGNKIDLENRQVATKRAQAWCYSKNNIPYFETSAKEAINVEQAFQTIARNALKQETEVEL
C: VLLKVIILGDSGVGKTSLMNQYVNKKFSNQYKATIGADFLTKEVMVDDRLVTMQIWDTAGLERFQSLGVAFYRGADCCVLVFDVTAPNTFKTLDSWRDEFLIQASPRDPENFPFVVLGNKIDLENRQVATKRAQAWCYSKNNIPYFETSAKEAINVEQAFQTIARNALKQETEVEL
B: VLLKVIILGDSGVGKTSLMNQYVNKKFSNQYKATIGADFLTKEVMVDDRLVTMQIWDTAGLERFQSLGVAFYRGADCCVLVFDVTAPNTFKTLDSWRDEFLIQASPRDPENFPFVVLGNKIDLENRQVATKRAQAWCYSKNNIPYFETSAKEAINVEQAFQTIARNALKQETEVEL
D: VLLKVIILGDSGVGKTSLMNQYVNKKFSNQYKATIGADFLTKEVMVDDRLVTMQIWDTAGLERFQSLGVAFYRGADCCVLVFDVTAPNTFKTLDSWRDEFLIQASPRDPENFPFVVLGNKIDLENRQVATKRAQAWCYSKNNIPYFETSAKEAINVEQAFQTIARNALKQETEVEL
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-3.8282
Maximal score value
2.2371
Average score
-0.7653
Total score value
-538.7489

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
7 V A 2.2371
8 L A 1.7904
9 L A 0.0000
10 K A 0.0148
11 V A 0.0000
12 I A 0.0000
13 I A 0.0000
14 L A 0.0000
15 G A 0.0000
16 D A -0.8203
17 S A -0.6853
18 G A -0.4505
19 V A 0.0000
20 G A -0.3280
21 K A 0.0000
22 T A -0.2041
23 S A -0.9245
24 L A 0.0000
25 M A 0.0000
26 N A -1.2069
27 Q A 0.0000
28 Y A -1.2604
29 V A -1.2875
30 N A -1.8475
31 K A -2.6358
32 K A -2.5942
33 F A -1.6883
34 S A -1.3971
35 N A -1.8106
36 Q A -1.5391
37 Y A -0.5129
38 K A -1.2895
39 A A -0.0212
40 T A 0.5016
41 I A 1.1535
42 G A 0.2310
43 A A -0.0788
44 D A -0.9354
45 F A 0.1936
46 L A 0.3523
47 T A -0.1056
48 K A -0.9179
49 E A -1.0418
50 V A -0.5303
51 M A -0.3051
52 V A 0.0000
53 D A -2.7170
54 D A -2.4944
55 R A -1.2133
56 L A 0.8718
57 V A 0.0000
58 T A 0.4881
59 M A 0.0000
60 Q A -0.1336
61 I A 0.0000
62 W A 0.0138
63 D A 0.0000
64 T A 0.0000
65 A A 0.0000
66 G A -0.6423
67 L A -1.0578
68 E A -2.5013
69 R A -2.2604
70 F A -0.1767
71 Q A -0.8051
72 S A 0.1431
73 L A 1.2985
74 G A 0.4873
75 V A 0.4911
76 A A -0.0182
77 F A -0.3745
78 Y A 0.0000
79 R A -1.9716
80 G A -1.2053
81 A A 0.0000
82 D A 0.0000
83 C A 0.0000
84 C A 0.0000
85 V A 0.0000
86 L A 0.0000
87 V A 0.0000
88 F A 0.0000
89 D A 0.0000
90 V A 0.0000
91 T A -1.4743
92 A A -1.2692
93 P A -1.4958
94 N A -1.9211
95 T A -1.3324
96 F A 0.0000
97 K A -2.2407
98 T A -1.4839
99 L A 0.0000
100 D A -1.3679
101 S A -1.4710
102 W A -0.6784
103 R A 0.0000
104 D A 0.0000
105 E A -1.4298
106 F A 0.0000
107 L A 0.0000
108 I A 0.0000
109 Q A -0.6570
110 A A 0.0000
111 S A -1.5094
112 P A -2.0542
113 R A -2.9314
114 D A -3.4936
115 P A -2.6863
116 E A -3.1103
117 N A -3.0157
118 F A 0.0000
119 P A -0.9955
120 F A 0.0000
121 V A 0.0000
122 V A 0.0000
123 L A 0.0000
124 G A 0.0000
125 N A 0.0000
126 K A -0.9358
127 I A -0.8419
128 D A -1.3613
129 L A -1.2591
130 E A -2.6233
131 N A -2.6581
132 R A -2.2713
133 Q A -2.0116
134 V A 0.0000
135 A A -1.6780
136 T A -1.8248
137 K A -2.8261
138 R A -2.6919
139 A A 0.0000
140 Q A -1.6817
141 A A -1.1087
142 W A -1.0017
143 C A 0.0000
144 Y A -0.0591
145 S A -0.3471
146 K A -1.3146
147 N A -2.1197
148 N A -1.6540
149 I A 0.0000
150 P A -0.3330
151 Y A 0.0153
152 F A -0.1227
153 E A -0.1121
154 T A 0.0000
155 S A 0.0000
156 A A 0.0000
157 K A -2.1197
158 E A -2.1039
159 A A -1.5473
160 I A -0.6200
161 N A -1.2151
162 V A 0.0000
163 E A -2.0935
164 Q A -2.2190
165 A A 0.0000
166 F A 0.0000
167 Q A -2.2391
168 T A -1.2398
169 I A 0.0000
170 A A 0.0000
171 R A -1.7100
172 N A -1.3125
173 A A 0.0000
174 L A -0.9442
175 K A -2.2868
176 Q A -1.6940
177 E A -0.9265
178 T A -1.1297
179 E A -1.5783
180 V A -0.1593
181 E A -0.8706
182 L A 0.5472
7 V B 2.0378
8 L B 1.8634
9 L B 0.0000
10 K B 0.0712
11 V B 0.0000
12 I B 0.0000
13 I B 0.0000
14 L B 0.0000
15 G B 0.0000
16 D B -0.8132
17 S B -0.6860
18 G B -0.4530
19 V B 0.0000
20 G B -0.3238
21 K B 0.0000
22 T B -0.2283
23 S B -0.8500
24 L B 0.0000
25 M B 0.0000
26 N B -1.4165
27 Q B -2.2905
28 Y B 0.0000
29 V B -1.5750
30 N B -2.1922
31 K B -2.8726
32 K B -2.7709
33 F B -1.8020
34 S B -1.4232
35 N B -1.8139
36 Q B -1.5435
37 Y B -0.5134
38 K B -1.2857
39 A B -0.0370
40 T B 0.4838
41 I B 1.1139
42 G B 0.2134
43 A B -0.0442
44 D B -0.8443
45 F B 0.3885
46 L B 0.4337
47 T B -0.0129
48 K B -0.9003
49 E B -1.1220
50 V B -0.6460
51 M B -0.4085
52 V B 0.0000
53 D B -2.6337
54 D B -2.5695
55 R B -1.5908
56 L B 0.4413
57 V B 0.0000
58 T B 0.4246
59 M B 0.0000
60 Q B -0.0310
61 I B 0.0000
62 W B 0.0939
63 D B 0.0000
64 T B 0.0000
65 A B 0.0000
66 G B -0.6625
67 L B -1.1006
68 E B -2.5284
69 R B -2.3135
70 F B -0.2978
71 Q B -0.8076
72 S B 0.1423
73 L B 1.3115
74 G B 0.5204
75 V B 0.5391
76 A B 0.0021
77 F B -0.3396
78 Y B 0.0000
79 R B -1.7540
80 G B -1.2966
81 A B 0.0000
82 D B 0.0000
83 C B 0.0000
84 C B 0.0000
85 V B 0.0000
86 L B 0.0000
87 V B 0.0000
88 F B 0.0000
89 D B 0.0000
90 V B 0.0000
91 T B -1.4650
92 A B -1.2686
93 P B -1.4964
94 N B -2.0392
95 T B -1.3301
96 F B 0.0000
97 K B -2.3859
98 T B -1.5857
99 L B 0.0000
100 D B -2.1334
101 S B -1.7188
102 W B -1.1188
103 R B 0.0000
104 D B -1.8119
105 E B -0.9565
106 F B 0.0000
107 L B -0.4180
108 I B 1.0391
109 Q B 0.0889
110 A B 0.0000
111 S B -0.8430
112 P B -1.9239
113 R B -3.0957
114 D B -3.7200
115 P B -2.9618
116 E B -3.8282
117 N B -3.4919
118 F B 0.0000
119 P B -1.1320
120 F B 0.0000
121 V B 0.0000
122 V B 0.0000
123 L B 0.0000
124 G B 0.0000
125 N B 0.0000
126 K B -0.9074
127 I B -0.7015
128 D B -1.3460
129 L B -1.2108
130 E B -2.6012
131 N B -2.6400
132 R B -2.2493
133 Q B -2.1771
134 V B 0.0000
135 A B -1.6394
136 T B -1.7427
137 K B -2.7185
138 R B -2.6163
139 A B 0.0000
140 Q B -1.3533
141 A B -0.9581
142 W B -0.9850
143 C B 0.0000
144 Y B -0.0446
145 S B -0.3784
146 K B -1.6014
147 N B -2.5274
148 N B -1.8219
149 I B 0.0000
150 P B -0.3249
151 Y B 0.0791
152 F B -0.0984
153 E B -0.1196
154 T B 0.0000
155 S B 0.0000
156 A B 0.0000
157 K B -2.1275
158 E B -2.1179
159 A B -1.6994
160 I B -0.7413
161 N B -1.3793
162 V B 0.0000
163 E B -2.7246
164 Q B -2.5074
165 A B 0.0000
166 F B 0.0000
167 Q B -2.3104
168 T B -1.3036
169 I B 0.0000
170 A B 0.0000
171 R B -1.5653
172 N B -1.2325
173 A B 0.0000
174 L B -0.8868
175 K B -2.1106
176 Q B -1.7934
177 E B -1.0529
178 T B -1.5911
179 E B -1.9934
180 V B -0.9327
181 E B -1.3824
182 L B -0.0478
7 V C 2.1338
8 L C 1.9565
9 L C 0.0000
10 K C 0.0824
11 V C 0.0000
12 I C 0.0000
13 I C 0.0000
14 L C 0.0000
15 G C 0.0000
16 D C -0.8449
17 S C -0.7038
18 G C -0.4731
19 V C 0.0000
20 G C -0.3805
21 K C 0.0000
22 T C -0.2052
23 S C -0.7571
24 L C 0.0000
25 M C 0.0000
26 N C -1.2585
27 Q C 0.0000
28 Y C 0.0000
29 V C 0.0000
30 N C -2.0213
31 K C -2.3834
32 K C -2.5102
33 F C -1.7299
34 S C -1.4879
35 N C -1.8882
36 Q C -1.5474
37 Y C -0.5188
38 K C -1.2880
39 A C -0.0211
40 T C 0.5042
41 I C 1.1568
42 G C 0.2451
43 A C -0.0329
44 D C -0.8542
45 F C 0.4080
46 L C 0.4358
47 T C 0.2202
48 K C -0.7558
49 E C -0.8041
50 V C -1.2664
51 M C -1.6980
52 V C 0.0000
53 D C -3.2605
54 D C -3.4072
55 R C -2.8074
56 L C -0.8179
57 V C 0.0000
58 T C 0.5682
59 M C 0.0000
60 Q C 0.1176
61 I C 0.0000
62 W C 0.0859
63 D C 0.0000
64 T C 0.0000
65 A C 0.0000
66 G C -0.6606
67 L C -1.0859
68 E C -2.5033
69 R C -2.2592
70 F C -0.1733
71 Q C -0.7683
72 S C 0.1689
73 L C 1.3254
74 G C 0.5245
75 V C 0.5532
76 A C 0.0112
77 F C -0.3385
78 Y C 0.0000
79 R C -1.7479
80 G C -1.2978
81 A C 0.0000
82 D C 0.0000
83 C C 0.0000
84 C C 0.0000
85 V C 0.0000
86 L C 0.0000
87 V C 0.0000
88 F C 0.0000
89 D C 0.0000
90 V C 0.0000
91 T C -1.4393
92 A C -1.2635
93 P C -1.4852
94 N C -2.0367
95 T C -1.3294
96 F C 0.0000
97 K C -2.3606
98 T C -1.6160
99 L C 0.0000
100 D C -1.8832
101 S C -1.5299
102 W C 0.0000
103 R C -1.1401
104 D C -1.1037
105 E C -0.8787
106 F C 0.0000
107 L C -0.2624
108 I C 1.1555
109 Q C 0.1763
110 A C 0.0000
111 S C -0.8667
112 P C -1.9251
113 R C -3.1040
114 D C -3.7252
115 P C -2.8755
116 E C -3.8254
117 N C -3.4866
118 F C 0.0000
119 P C -1.1335
120 F C 0.0000
121 V C 0.0000
122 V C 0.0000
123 L C 0.0000
124 G C 0.0000
125 N C 0.0000
126 K C -0.9394
127 I C -0.6873
128 D C -1.3236
129 L C -1.1524
130 E C -2.5467
131 N C -2.6048
132 R C -2.2126
133 Q C -2.1700
134 V C 0.0000
135 A C -1.5259
136 T C -1.6788
137 K C -2.5987
138 R C -2.2576
139 A C 0.0000
140 Q C -1.4826
141 A C -0.9343
142 W C -0.9311
143 C C 0.0000
144 Y C -0.0590
145 S C -0.3976
146 K C -1.6056
147 N C -2.5047
148 N C -1.8419
149 I C 0.0000
150 P C -0.3577
151 Y C 0.0191
152 F C -0.1178
153 E C -0.1592
154 T C 0.0000
155 S C 0.0000
156 A C 0.0000
157 K C -2.4741
158 E C -2.2927
159 A C -1.7159
160 I C -0.7843
161 N C -1.3947
162 V C 0.0000
163 E C -2.5432
164 Q C -2.0532
165 A C 0.0000
166 F C 0.0000
167 Q C -2.0644
168 T C -1.0640
169 I C 0.0000
170 A C 0.0000
171 R C -1.7216
172 N C -1.1973
173 A C 0.0000
174 L C -0.9535
175 K C -2.2619
176 Q C -1.7613
177 E C -0.9823
178 T C -1.2756
179 E C -1.8667
180 V C -0.8220
181 E C -1.1874
182 L C 0.3186
7 V D 1.9028
8 L D 1.8266
9 L D 0.0000
10 K D 0.0716
11 V D 0.0000
12 I D 0.0000
13 I D 0.0000
14 L D 0.0000
15 G D 0.0000
16 D D -0.8286
17 S D -0.7031
18 G D -0.4968
19 V D 0.0000
20 G D -0.3374
21 K D 0.0000
22 T D -0.2289
23 S D -0.9658
24 L D 0.0000
25 M D 0.0000
26 N D -1.3678
27 Q D 0.0000
28 Y D -1.4928
29 V D 0.0000
30 N D -2.1641
31 K D -2.5795
32 K D -2.6294
33 F D -1.7222
34 S D -1.4367
35 N D -1.9544
36 Q D -2.1308
37 Y D -0.6960
38 K D -1.3064
39 A D -0.1801
40 T D 0.4141
41 I D 1.1469
42 G D 0.1424
43 A D -0.0680
44 D D -0.8442
45 F D 0.4026
46 L D 0.3908
47 T D 0.2116
48 K D -0.4498
49 E D -0.9162
50 V D -1.1292
51 M D -1.2006
52 V D 0.0000
53 D D -2.7046
54 D D -2.6974
55 R D -1.9683
56 L D -0.5289
57 V D 0.0000
58 T D 0.4920
59 M D 0.0000
60 Q D 0.1177
61 I D 0.0000
62 W D 0.0990
63 D D 0.0000
64 T D 0.0000
65 A D 0.0000
66 G D -0.7105
67 L D -1.1594
68 E D -2.6005
69 R D -2.3029
70 F D -0.4248
71 Q D -0.9105
72 S D 0.0863
73 L D 1.2833
74 G D 0.5240
75 V D 0.5212
76 A D -0.0136
77 F D -0.3531
78 Y D 0.0000
79 R D -1.9731
80 G D -1.1936
81 A D 0.0000
82 D D 0.0000
83 C D 0.0000
84 C D 0.0000
85 V D 0.0000
86 L D 0.0000
87 V D 0.0000
88 F D 0.0000
89 D D 0.0000
90 V D 0.0000
91 T D -1.4714
92 A D -1.2772
93 P D -1.5020
94 N D -1.9245
95 T D -1.3430
96 F D 0.0000
97 K D -2.2469
98 T D -1.4779
99 L D 0.0000
100 D D -1.3540
101 S D -1.4391
102 W D -0.6499
103 R D 0.0000
104 D D 0.0000
105 E D -1.3540
106 F D 0.0000
107 L D 0.0000
108 I D 0.0000
109 Q D -0.6497
110 A D 0.0000
111 S D -1.5060
112 P D -2.0663
113 R D -2.9493
114 D D -3.5237
115 P D 0.0000
116 E D -3.2278
117 N D -3.0785
118 F D 0.0000
119 P D -1.0099
120 F D 0.0000
121 V D 0.0000
122 V D 0.0000
123 L D 0.0000
124 G D 0.0000
125 N D 0.0000
126 K D -0.9107
127 I D -0.7062
128 D D -1.3472
129 L D -1.2456
130 E D -2.6234
131 N D -2.6562
132 R D -2.2693
133 Q D -2.0537
134 V D 0.0000
135 A D -1.6388
136 T D -1.7445
137 K D -2.7361
138 R D -2.6328
139 A D 0.0000
140 Q D -1.3901
141 A D -1.0017
142 W D -0.9281
143 C D 0.0000
144 Y D -0.0032
145 S D -0.3344
146 K D -1.3540
147 N D -2.2309
148 N D -1.6715
149 I D 0.0000
150 P D -0.2991
151 Y D 0.0828
152 F D -0.0814
153 E D -0.0985
154 T D 0.0000
155 S D 0.0000
156 A D 0.0000
157 K D -2.0420
158 E D -2.0459
159 A D -1.5346
160 I D -0.6191
161 N D -1.3188
162 V D 0.0000
163 E D -2.6531
164 Q D -2.4507
165 A D 0.0000
166 F D 0.0000
167 Q D -2.4053
168 T D -1.2622
169 I D 0.0000
170 A D 0.0000
171 R D -1.6275
172 N D -1.2534
173 A D 0.0000
174 L D -0.8767
175 K D -2.2179
176 Q D -1.6198
177 E D -0.8235
178 T D -1.1028
179 E D -1.5387
180 V D -0.1176
181 E D -0.8489
182 L D 0.5590

 

Laboratory of Theory of Biopolymers 2015