Project name: query_structure

Status: done

Started: 2026-03-17 00:40:15
Settings
Chain sequence(s) A: SVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS
C: ASVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS
B: ASVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS
E: SSSQVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSAG
D: SVIKPEMKIKLRMEGAVNGHKFVIEGEGIGKPYEGTQTLDLTVEEGAPLPFSYDILTPAFYYYNRAFTKYPEDIPDYFKQAFPEGYSWERSMTYEDQGICIATSDITMEGDCFFYEIRFDGTNFPPNGPVMQKKTLKWEPSTEKMYVEDGVLKGDVEMALLLEGGGHYRCDFKTTYKKAKKDVRLPDAHEVDHRIEILSHDKDYNKVRLYEHAEARYS
G: QVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSA
F: SSSQVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQAPGKEREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVSAG
H: QVQLVESGGGLVQAGGSLRLSCAASGFPVDTQWMHWYRQREWVAAISSTGRSTFYADSVKGRFTISRDNAKNTVYLQMNSLKPEDTAVYYCTVYVGNRYRGQGTQVTVS
input PDB
Selected Chain(s) A,C,B,E,D,G,F,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 all chain(s) selected           (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:27:37)
[INFO]       Main:     Simulation completed successfully.                                          (00:27:58)
Show buried residues

Minimal score value
-3.7881
Maximal score value
1.3931
Average score
-0.9072
Total score value
-1197.4508

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
3 S A -0.3189
4 V A -0.2209
5 I A 0.0000
6 K A -2.6309
7 P A -1.9139
8 E A -2.6879
9 M A 0.0000
10 K A -2.6681
11 I A 0.0000
12 K A -1.7241
13 L A 0.0000
14 R A -1.1909
15 M A 0.0000
16 E A -1.1639
17 G A 0.0000
18 A A 0.0000
19 V A 0.0000
20 N A -0.7991
21 G A -0.8751
22 H A -0.9973
23 K A -1.4820
24 F A 0.0000
25 V A 0.0000
26 I A 0.0000
27 E A -1.8929
28 G A -1.9672
29 E A -2.7718
30 G A -1.7135
31 I A -1.5185
32 G A 0.0000
33 K A -1.6491
34 P A 0.0000
35 Y A -0.5404
36 E A -0.8334
37 G A 0.0000
38 T A 0.0000
39 Q A 0.0000
40 T A 0.0000
41 L A 0.0000
42 D A -2.3337
43 L A 0.0000
44 T A -2.1233
45 V A 0.0000
46 E A -3.0350
47 E A -2.8091
48 G A -1.7070
49 A A -1.4454
50 P A -1.3351
51 L A 0.0000
52 P A -0.8490
53 F A 0.0000
54 S A 0.0000
55 Y A 0.0000
56 D A 0.0000
57 I A 0.0000
58 L A 0.0000
59 T A 0.0000
60 P A -0.0694
61 A A 0.0000
62 F A 0.0000
66 N A -0.1673
67 R A 0.0000
68 A A 0.0000
69 F A 0.0000
70 T A 0.0000
71 K A -1.2773
72 Y A -1.2901
73 P A -1.7656
74 E A -2.8389
75 D A -2.7211
76 I A 0.0000
77 P A -1.6866
78 D A -1.2510
79 Y A 0.0000
80 F A 0.0000
81 K A -0.3070
82 Q A -1.3173
83 A A 0.0000
84 F A 0.0000
85 P A -0.5108
86 E A -0.9724
87 G A 0.0000
88 Y A 0.0000
89 S A -0.5654
90 W A 0.0000
91 E A 0.0000
92 R A 0.0000
93 S A 0.0000
94 M A 0.0000
95 T A -1.9059
96 Y A 0.0000
97 E A -3.2567
98 D A -2.3047
99 Q A -2.1628
100 G A 0.0000
101 I A 0.0000
102 C A 0.0000
103 I A 0.0000
104 A A 0.0000
105 T A -0.2684
106 S A 0.0000
107 D A -0.4720
108 I A 0.0000
109 T A 0.0000
110 M A 0.0000
111 E A 0.0000
112 G A -1.5352
113 D A -2.8064
114 C A 0.0000
115 F A 0.0000
116 F A 0.0000
117 Y A 0.0000
118 E A 0.0000
119 I A 0.0000
120 R A -0.5136
121 F A 0.0000
122 D A 0.0000
123 G A 0.0000
124 T A 0.0000
125 N A -0.8864
126 F A 0.0000
127 P A -1.2546
128 P A -1.3084
129 N A -2.0422
130 G A -1.3973
131 P A -1.6500
132 V A 0.0000
133 M A -1.3222
134 Q A -2.0562
135 K A -2.5531
136 K A -2.5591
137 T A -1.2430
138 L A -0.1462
139 K A -0.2876
140 W A 0.0000
141 E A -0.8678
142 P A -0.9391
143 S A -0.9863
144 T A -1.0652
145 E A 0.0000
146 K A -1.5955
147 M A 0.0000
148 Y A -0.6475
149 V A -0.8945
150 E A -2.0956
151 D A -2.7556
152 G A -1.7698
153 V A -1.1280
154 L A 0.0000
155 K A -1.1873
156 G A 0.0000
157 D A -1.7004
158 V A 0.0000
159 E A -3.0379
160 M A 0.0000
161 A A -1.9515
162 L A 0.0000
163 L A -0.8329
164 L A -1.3564
165 E A -2.4884
166 G A -1.6803
167 G A -1.2599
168 G A -1.3479
169 H A -1.3435
170 Y A 0.0000
171 R A -3.3099
172 C A 0.0000
173 D A -3.1229
174 F A 0.0000
175 K A -1.7466
176 T A 0.0000
177 T A -0.6073
178 Y A 0.0000
179 K A -1.1439
180 A A -1.4534
181 K A -1.9507
182 K A -2.3135
183 D A -2.8117
184 V A 0.0000
185 R A -2.3392
186 L A -1.1514
187 P A 0.0000
188 D A -1.5833
189 A A -0.8468
190 H A 0.0000
191 E A -0.8680
192 V A 0.0000
193 D A -1.1220
194 H A -0.6412
195 R A -0.5468
196 I A -0.1776
197 E A -0.1610
198 I A 0.0191
199 L A 0.0000
200 S A -1.0484
201 H A -2.1830
202 D A -2.7397
203 K A -3.0810
204 D A -2.8291
205 Y A -2.1522
206 N A -2.6283
207 K A -3.1362
208 V A 0.0000
209 R A -1.4489
210 L A 0.0000
211 Y A 0.0000
212 E A 0.0000
213 H A 0.0000
214 A A 0.0000
215 E A -0.9794
216 A A 0.0000
217 R A -1.0650
218 Y A -0.2149
219 S A -0.1514
2 A B 0.0118
3 S B -0.1163
4 V B -0.0006
5 I B 0.0000
6 K B -1.8046
7 P B -1.6911
8 E B -2.8537
9 M B 0.0000
10 K B -2.4707
11 I B 0.0000
12 K B -1.3913
13 L B 0.0000
14 R B -1.5280
15 M B 0.0000
16 E B -1.7330
17 G B 0.0000
18 A B -1.5183
19 V B 0.0000
20 N B -1.4557
21 G B -1.5547
22 H B -1.6418
23 K B -2.5306
24 F B 0.0000
25 V B 0.0000
26 I B 0.0000
27 E B -2.2757
28 G B 0.0000
29 E B -2.4671
30 G B -1.4813
31 I B -1.4414
32 G B 0.0000
33 K B -1.5311
34 P B 0.0000
35 Y B -0.5608
36 E B -1.1762
37 G B 0.0000
38 T B 0.0000
39 Q B 0.0000
40 T B 0.0000
41 L B 0.0000
42 D B -2.2084
43 L B 0.0000
44 T B -2.1495
45 V B 0.0000
46 E B -3.2060
47 E B -3.2326
48 G B -2.0235
49 A B -1.5724
50 P B -1.3201
51 L B -1.0019
52 P B -0.8051
53 F B 0.0000
54 S B 0.0000
55 Y B 0.0000
56 D B 0.0000
57 I B 0.0000
58 L B 0.0000
59 T B 0.0000
60 P B -0.0820
61 A B 0.0000
62 F B 0.0000
66 N B -0.1805
67 R B 0.0000
68 A B 0.0000
69 F B 0.0000
70 T B 0.0000
71 K B -1.7176
72 Y B -1.5174
73 P B -1.8185
74 E B -2.8496
75 D B -2.6924
76 I B 0.0000
77 P B -1.5468
78 D B -1.2960
79 Y B 0.0000
80 F B 0.0000
81 K B -0.3243
82 Q B -1.3684
83 A B 0.0000
84 F B 0.0000
85 P B -0.4534
86 E B -0.9178
87 G B 0.0000
88 Y B 0.0000
89 S B -1.1714
90 W B 0.0000
91 E B -2.1077
92 R B 0.0000
93 S B -0.6592
94 M B 0.0000
95 T B -1.6694
96 Y B 0.0000
97 E B -3.1810
98 D B -2.2915
99 Q B -2.1914
100 G B 0.0000
101 I B -0.4296
102 C B 0.0000
103 I B 0.9665
104 A B 0.0000
105 T B -0.8646
106 S B 0.0000
107 D B -0.9554
108 I B 0.0000
109 T B 0.0000
110 M B -0.3704
111 E B 0.0000
112 G B -1.2493
113 D B -2.6070
114 C B -1.8834
115 F B 0.0000
116 F B 0.0000
117 Y B 0.0000
118 E B -1.1111
119 I B 0.0000
120 R B -0.9900
121 F B 0.0000
122 D B -0.4515
123 G B 0.0000
124 T B -0.9065
125 N B -1.7355
126 F B 0.0000
127 P B -1.3427
128 P B -1.2717
129 N B -1.9145
130 G B 0.0000
131 P B -1.7386
132 V B 0.0000
133 M B -1.4049
134 Q B -2.3257
135 K B -2.7016
136 K B -2.5582
137 T B -1.3669
138 L B -0.4244
139 K B -0.3048
140 W B 0.0000
141 E B -0.9511
142 P B -0.9377
143 S B -1.0376
144 T B -1.3024
145 E B 0.0000
146 K B -1.7641
147 M B 0.0000
148 Y B -0.3706
149 V B 0.0000
150 E B -1.9418
151 D B -2.5765
152 G B -1.9581
153 V B -1.2130
154 L B 0.0000
155 K B -1.3824
156 G B 0.0000
157 D B -2.1138
158 V B 0.0000
159 E B -3.2191
160 M B 0.0000
161 A B -2.0134
162 L B 0.0000
163 L B -1.0178
164 L B -1.4941
165 E B -2.5613
166 G B -1.7386
167 G B -1.3953
168 G B -1.5120
169 H B -1.6463
170 Y B 0.0000
171 R B -3.4007
172 C B 0.0000
173 D B -3.3934
174 F B 0.0000
175 K B -2.7432
176 T B 0.0000
177 T B -1.4262
178 Y B 0.0000
179 K B -1.9987
180 A B -1.7329
181 K B -2.0932
182 K B -2.4690
183 D B -2.9339
184 V B 0.0000
185 R B -2.2393
186 L B -1.0255
187 P B 0.0000
188 D B -1.1622
189 A B -0.6650
190 H B 0.0000
191 E B -1.1230
192 V B 0.0000
193 D B -1.5371
194 H B -0.9305
195 R B -0.7389
196 I B -0.1682
197 E B 0.0000
198 I B 0.1239
199 L B 0.0000
200 S B -1.0337
201 H B -1.9070
202 D B -2.3869
203 K B -3.0236
204 D B -2.9774
205 Y B -1.9618
206 N B -2.4377
207 K B -3.0323
208 V B 0.0000
209 R B -1.4181
210 L B 0.0000
211 Y B 0.0000
212 E B -0.2237
213 H B -0.8288
214 A B 0.0000
215 E B -1.6745
216 A B 0.0000
217 R B -1.1181
218 Y B -0.1863
219 S B -0.1054
2 A C -0.0879
3 S C -0.2564
4 V C -0.1309
5 I C 0.0000
6 K C -2.5955
7 P C -2.2940
8 E C -2.9566
9 M C 0.0000
10 K C -1.7836
11 I C 0.0000
12 K C -1.3603
13 L C 0.0000
14 R C -1.4989
15 M C 0.0000
16 E C -1.3081
17 G C 0.0000
18 A C 0.0000
19 V C 0.0000
20 N C -0.5036
21 G C -0.6662
22 H C -0.7117
23 K C -0.7724
24 F C 0.0000
25 V C -1.2307
26 I C 0.0000
27 E C -1.7882
28 G C -2.1616
29 E C -2.4526
30 G C -1.0347
31 I C -0.4419
32 G C 0.0000
33 K C -2.0316
34 P C 0.0000
35 Y C -1.2741
36 E C -2.3343
37 G C 0.0000
38 T C -1.0951
39 Q C 0.0000
40 T C -0.4155
41 L C 0.0000
42 D C -2.0938
43 L C 0.0000
44 T C -2.0907
45 V C 0.0000
46 E C -2.6157
47 E C -1.9265
48 G C -1.0885
49 A C -1.0890
50 P C -1.0877
51 L C 0.0000
52 P C -0.8499
53 F C 0.0000
54 S C 0.0000
55 Y C 0.0000
56 D C 0.0000
57 I C 0.0000
58 L C 0.0000
59 T C 0.0000
60 P C -0.1886
61 A C 0.0000
62 F C 0.0000
66 N C -0.1714
67 R C 0.0000
68 A C 0.0000
69 F C 0.0000
70 T C 0.0000
71 K C -1.8888
72 Y C -1.5867
73 P C -1.7783
74 E C -2.8309
75 D C -2.8857
76 I C 0.0000
77 P C -1.7465
78 D C -1.2544
79 Y C 0.0000
80 F C 0.0000
81 K C -0.2937
82 Q C -1.1911
83 A C 0.0000
84 F C 0.0000
85 P C -0.5669
86 E C -1.0099
87 G C 0.0000
88 Y C 0.0000
89 S C -0.8933
90 W C 0.0000
91 E C -0.7767
92 R C 0.0000
93 S C 0.0000
94 M C 0.0000
95 T C -1.8070
96 Y C 0.0000
97 E C -3.1080
98 D C -2.1021
99 Q C -1.7679
100 G C 0.0000
101 I C 0.0000
102 C C 0.0000
103 I C 0.0000
104 A C 0.0000
105 T C -0.3903
106 S C 0.0000
107 D C -0.6482
108 I C 0.0000
109 T C 0.0000
110 M C -0.3676
111 E C 0.0000
112 G C -1.2900
113 D C -2.5608
114 C C 0.0000
115 F C 0.0000
116 F C 0.0000
117 Y C 0.0000
118 E C -0.9988
119 I C 0.0000
120 R C -0.5994
121 F C 0.0000
122 D C 0.0000
123 G C 0.0000
124 T C 0.0000
125 N C -0.6478
126 F C 0.0000
127 P C -1.3419
128 P C -1.3704
129 N C -2.1509
130 G C -1.4434
131 P C -1.6067
132 V C 0.0000
133 M C -1.3693
134 Q C -2.3208
135 K C -2.7100
136 K C -2.5321
137 T C -1.3599
138 L C -0.4843
139 K C -1.6406
140 W C 0.0000
141 E C -1.8632
142 P C -1.6732
143 S C -1.3387
144 T C -1.5166
145 E C 0.0000
146 K C -1.6929
147 M C 0.0000
148 Y C -0.6838
149 V C -0.9689
150 E C -2.4096
151 D C -2.8925
152 G C -1.9654
153 V C -1.4581
154 L C 0.0000
155 K C -1.2980
156 G C 0.0000
157 D C -1.8544
158 V C 0.0000
159 E C -3.1607
160 M C 0.0000
161 A C 0.0000
162 L C 0.0000
163 L C -1.0414
164 L C -1.4727
165 E C -2.5454
166 G C -1.7105
167 G C -1.3398
168 G C -1.4264
169 H C -1.4448
170 Y C 0.0000
171 R C -3.3596
172 C C 0.0000
173 D C -3.2097
174 F C 0.0000
175 K C -1.9323
176 T C 0.0000
177 T C 0.0000
178 Y C 0.0000
179 K C -1.8797
180 A C -1.8588
181 K C -2.1809
182 K C -2.4111
183 D C -2.8784
184 V C 0.0000
185 R C -2.3416
186 L C -1.1628
187 P C 0.0000
188 D C -1.7515
189 A C -0.8195
190 H C 0.0000
191 E C -1.1651
192 V C 0.0000
193 D C -1.6171
194 H C -1.7603
195 R C -2.7162
196 I C -1.5939
197 E C -1.8112
198 I C -0.3403
199 L C 0.4006
200 S C -0.9844
201 H C -2.3701
202 D C -2.9775
203 K C -3.3015
204 D C -3.2007
205 Y C -2.3768
206 N C -2.5696
207 K C -3.3102
208 V C 0.0000
209 R C -1.8836
210 L C 0.0000
211 Y C -0.4678
212 E C 0.0000
213 H C -1.6860
214 A C 0.0000
215 E C -1.7933
216 A C 0.0000
217 R C -1.3160
218 Y C -0.3155
219 S C -0.1523
3 S D -0.2982
4 V D -0.2093
5 I D 0.0000
6 K D -2.0629
7 P D -1.9891
8 E D -2.7695
9 M D 0.0000
10 K D -2.1582
11 I D 0.0000
12 K D -1.3743
13 L D 0.0000
14 R D -1.6335
15 M D 0.0000
16 E D -2.7548
17 G D 0.0000
18 A D -1.7585
19 V D 0.0000
20 N D -1.5236
21 G D -1.5665
22 H D -1.6284
23 K D -2.6788
24 F D 0.0000
25 V D 0.0000
26 I D 0.0000
27 E D -2.3258
28 G D -2.1732
29 E D -2.7563
30 G D -1.4079
31 I D -0.6378
32 G D 0.0000
33 K D -2.0398
34 P D 0.0000
35 Y D -1.2147
36 E D -2.3457
37 G D 0.0000
38 T D -1.1785
39 Q D 0.0000
40 T D -0.7535
41 L D 0.0000
42 D D -2.8109
43 L D 0.0000
44 T D -2.2963
45 V D 0.0000
46 E D -3.0692
47 E D -2.9759
48 G D -1.8162
49 A D -1.4643
50 P D -1.3592
51 L D 0.0000
52 P D -0.8934
53 F D 0.0000
54 S D 0.0000
55 Y D 0.0000
56 D D 0.0000
57 I D 0.0000
58 L D 0.0000
59 T D 0.0000
60 P D -0.0337
61 A D 0.0000
62 F D 0.0000
66 N D -0.1964
67 R D 0.0000
68 A D 0.0000
69 F D 0.0000
70 T D 0.0000
71 K D -1.9904
72 Y D -1.5700
73 P D -1.7799
74 E D -2.8467
75 D D -2.7025
76 I D 0.0000
77 P D -1.6583
78 D D -1.2404
79 Y D 0.0000
80 F D 0.0000
81 K D -0.2881
82 Q D -1.1575
83 A D 0.0000
84 F D 0.0000
85 P D -0.6349
86 E D -0.8828
87 G D 0.0000
88 Y D 0.0000
89 S D -0.9533
90 W D 0.0000
91 E D -1.6234
92 R D 0.0000
93 S D -0.1590
94 M D 0.0000
95 T D -0.4382
96 Y D 0.0000
97 E D -1.4249
98 D D -1.6050
99 Q D -1.7045
100 G D 0.0000
101 I D -0.0327
102 C D 0.0000
103 I D 1.3931
104 A D 0.0000
105 T D -0.5663
106 S D 0.0000
107 D D -0.6757
108 I D 0.0000
109 T D 0.0000
110 M D 0.0000
111 E D 0.0000
112 G D -1.1607
113 D D -2.1957
114 C D -1.4636
115 F D 0.0000
116 F D 0.0000
117 Y D 0.0000
118 E D 0.0000
119 I D 0.0000
120 R D -1.0339
121 F D 0.0000
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85 S E -1.3737
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88 P E -1.8681
89 E E -2.2668
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91 T E -0.8647
92 A E 0.0000
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95 Y E 0.0000
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97 T E 0.0000
98 V E 0.0000
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100 V E -0.6045
101 G E -1.1538
102 N E -1.9488
103 R E -1.9318
104 Y E -1.7998
105 R E -2.2471
106 G E 0.0000
107 Q E -1.6158
108 G E -1.0414
109 T E -0.8860
110 Q E -1.1283
111 V E 0.0000
112 T E -0.2632
113 V E 0.0000
114 S E -0.8100
115 A E -1.0089
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4 L F 0.0000
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6 E F 0.0000
7 S F -0.8229
8 G F -1.2476
9 G F -0.8564
10 G F 0.1160
11 L F 1.0337
12 V F -0.0266
13 Q F -1.3753
14 A F -1.6713
15 G F -1.4684
16 G F -0.9286
17 S F -1.3098
18 L F -1.0525
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20 L F 0.0000
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32 Q F -0.5644
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69 T F -1.0156
70 I F 0.0000
71 S F -0.7080
72 R F -1.3343
73 D F -1.9068
74 N F -2.4664
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85 S F -1.2825
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93 V F -0.6494
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95 Y F 0.0000
96 C F 0.0000
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100 V F -0.6626
101 G F -1.1740
102 N F -1.9405
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114 S F -0.9672
115 A F -1.1387
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9 G G -0.7654
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11 L G 1.1629
12 V G 0.2899
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27 F G -0.5526
28 P G -1.1168
29 V G 0.0000
30 D G -1.9416
31 T G -0.9531
32 Q G -0.6154
33 W G 0.0000
34 M G 0.0000
35 H G 0.0000
36 W G 0.0000
37 Y G 0.0000
38 R G 0.0000
39 Q G -1.9585
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42 G G -2.0125
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63 S G -1.7893
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65 K G -2.6001
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67 R G -1.3292
68 F G 0.0000
69 T G -0.9240
70 I G 0.0000
71 S G -0.6776
72 R G -1.3466
73 D G -2.0159
74 N G -2.5811
75 A G -1.8168
76 K G -2.4262
77 N G -2.0008
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81 L G 0.0000
82 Q G -1.5881
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85 S G -1.0598
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91 T G -0.8444
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100 V G -0.4987
101 G G -1.1476
102 N G -1.6840
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107 Q G -1.1221
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114 S G -0.8074
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6 E H 0.0000
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8 G H -1.3723
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10 G H 0.0889
11 L H 1.0169
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35 H H 0.0000
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37 Y H -0.9237
38 R H 0.0000
39 Q H -2.1069
45 R H -2.6194
46 E H -1.9225
47 W H -0.7847
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53 S H -0.8868
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65 K H -2.6183
66 G H -1.8253
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69 T H -0.9256
70 I H 0.0000
71 S H -0.7467
72 R H -1.4577
73 D H -2.3907
74 N H -2.4103
75 A H -1.7934
76 K H -2.4702
77 N H -2.0428
78 T H 0.0000
79 V H 0.0000
80 Y H 0.0000
81 L H 0.0000
82 Q H -1.6844
83 M H 0.0000
84 N H -1.7763
85 S H -1.4066
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87 K H -2.3171
88 P H -1.9199
89 E H -2.3137
90 D H 0.0000
91 T H -1.0464
92 A H -0.9694
93 V H -1.0313
94 Y H 0.0000
95 Y H 0.0000
96 C H 0.0000
97 T H 0.0000
98 V H 0.0000
99 Y H -0.6524
100 V H -0.2996
101 G H -1.0694
102 N H -1.6877
103 R H -1.5501
104 Y H -1.0230
105 R H -1.3578
106 G H -0.9152
107 Q H -1.2790
108 G H -0.8143
109 T H -0.6762
110 Q H -1.1909
111 V H 0.0000
112 T H -0.2817
113 V H 0.0000
114 S H -0.5990
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Laboratory of Theory of Biopolymers 2018