Project name: 7d487943bf12c6b [mutate: CR279C]

Status: done

Started: 2025-01-30 14:36:58
Settings
Chain sequence(s) A: APDQDEIQRLPGLAKQPSFRQYSGYLKGSGSKHLHYWFVESQKDPENSPVVLWLNGGPGCSSLDGLLTEHGPFLVQPDGVTLEYNPYSWNLIANVLYLESPAGVGFSYSDDKFYATNDTEVAQSNFEALQDFFRLFPEYKNNKLFLTGESYAGIYIPTLAVLVMQDPSMNLQGLAVGNGLSSYEQNDNSLVYFAYYHGLLGNRLWSSLQTHCCSQNKCNFYDNKDLECVTNLQEVARIVGNSGLNIYNLYAPCAGGVPSHFRYEKDTVVVQDLGNIFTCLPLKRMWHQALLRSGDKVR
C: APDQDEIQRLPGLAKQPSFRQYSGYLKGSGSKHLHYWFVESQKDPENSPVVLWLNGGPGCSSLDGLLTEHGPFLVQPDGVTLEYNPYSWNLIANVLYLESPAGVGFSYSDDKFYATNDTEVAQSNFEALQDFFRLFPEYKNNKLFLTGESYAGIYIPTLAVLVMQDPSMNLQGLAVGNGLSSYEQNDNSLVYFAYYHGLLGNRLWSSLQTHCCSQNKCNFYDNKDLECVTNLQEVARIVGNSGLNIYNLYAPCAGGVPSHFRYEKDTVVVQDLGNIFTCLPLKRMWHQALLRSGDKVR
B: MDPPCTNTTAASTYLNNPYVRKALNIPEQLPQWDMCNFLVNLQYRRLYRSMNSQYLKLLSSQKYQILLYNGDVDMACNFMGDEWFVDSLNQKMEVQRRPWLVKYGDSGEQIAGFVKEFSHIAFLTIKGAGHMVPTDKPLAAFTMFSRFLNKQPY
D: MDPPCTNTTAASTYLNNPYVRKALNIPEQLPQWDMCNFLVNLQYRRLYRSMNSQYLKLLSSQKYQILLYNGDVDMACNFMGDEWFVDSLNQKMEVQRRPWLVKYGDSGEQIAGFVKEFSHIAFLTIKGAGHMVPTDKPLAAFTMFSRFLNKQPY
input PDB
Selected Chain(s) A,C,B,D
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
Automated mutations No
Mutated residues CR279C
Energy difference between WT (input) and mutated protein (by FoldX) 0.11781 kcal/mol
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]       FoldX:    Building mutant model                                                       (00:04:38)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:04:57)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:08:59)
[INFO]       Main:     Simulation completed successfully.                                          (00:09:08)
Show buried residues

Minimal score value
-3.7742
Maximal score value
2.0503
Average score
-0.6058
Total score value
-547.6655

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 A A -1.2154
2 P A -1.4918
3 D A -2.6323
4 Q A -2.4264
5 D A 0.0000
6 E A -2.4590
7 I A 0.0000
8 Q A -2.9506
9 R A -2.9489
10 L A 0.0000
11 P A -0.4469
12 G A -0.3290
13 L A -1.0148
14 A A -1.2011
15 K A -2.5800
16 Q A -2.7801
17 P A -1.8362
18 S A -1.3817
19 F A 0.0000
20 R A -2.3860
21 Q A 0.0000
22 Y A 0.0000
23 S A 0.0000
24 G A 0.0000
25 Y A -0.2227
26 L A 0.0000
27 K A -1.4991
28 G A 0.0000
29 S A -1.0688
30 G A -1.2889
31 S A -1.6169
32 K A -1.4180
33 H A -0.9237
34 L A 0.0000
35 H A 0.0000
36 Y A 0.0000
37 W A 0.0000
38 F A 0.0000
39 V A 0.0000
40 E A -1.4919
41 S A 0.0000
42 Q A -1.6486
43 K A -2.9583
44 D A -3.5501
45 P A -2.9469
46 E A -3.7742
47 N A -3.2030
48 S A 0.0000
49 P A -1.5139
50 V A 0.0000
51 V A 0.0000
52 L A 0.0000
53 W A 0.0000
54 L A 0.0000
55 N A 0.0000
56 G A 0.0000
57 G A 0.0000
58 P A 0.0000
59 G A 0.0000
60 C A 0.0000
61 S A 0.0000
62 S A 0.0000
63 L A 0.0000
64 D A 0.0000
65 G A 0.0000
66 L A 0.0000
67 L A 0.0000
68 T A 0.1107
69 E A 0.0000
70 H A 0.0000
71 G A 0.0000
72 P A 0.0000
73 F A 0.0000
74 L A -0.0489
75 V A -0.0770
76 Q A -0.7260
77 P A -1.0220
78 D A -1.4100
79 G A 0.0000
80 V A 1.0150
81 T A 0.0226
82 L A 0.0000
83 E A -1.3967
84 Y A -0.5156
85 N A 0.0000
86 P A -0.0291
87 Y A 0.5131
88 S A 0.0000
89 W A 0.0000
90 N A 0.0000
91 L A -0.1670
92 I A -0.4180
93 A A 0.0000
94 N A 0.0000
95 V A 0.0000
96 L A 0.0000
97 Y A 0.0000
98 L A 0.0000
99 E A 0.0000
100 S A 0.0000
101 P A 0.0000
102 A A 0.0000
103 G A 0.0000
104 V A 0.0000
105 G A -0.4640
106 F A 0.0000
107 S A 0.0000
108 Y A -0.6175
109 S A 0.0000
110 D A -2.9869
111 D A -2.8768
112 K A -2.1003
113 F A 0.3662
114 Y A 0.5413
115 A A 0.1514
116 T A 0.0000
117 N A -1.2142
118 D A 0.0000
119 T A -0.8119
120 E A -1.5169
121 V A 0.0000
122 A A 0.0000
123 Q A -0.9809
124 S A 0.0000
125 N A 0.0000
126 F A -0.5693
127 E A -1.1016
128 A A 0.0000
129 L A 0.0000
130 Q A -1.5931
131 D A 0.0000
132 F A 0.0000
133 F A 0.0000
134 R A -2.3003
135 L A -1.2981
136 F A 0.0000
137 P A -2.0041
138 E A -2.9311
139 Y A 0.0000
140 K A -2.6783
141 N A -2.8565
142 N A -2.5513
143 K A -1.9083
144 L A 0.0000
145 F A 0.0000
146 L A 0.0000
147 T A 0.0000
148 G A 0.0000
149 E A 0.0000
150 S A 0.0000
151 Y A 0.0000
152 A A 0.0000
153 G A 0.0000
154 I A 0.0000
155 Y A 0.0000
156 I A 0.0000
157 P A 0.0000
158 T A 0.0000
159 L A 0.0000
160 A A 0.0000
161 V A -0.0150
162 L A -0.0014
163 V A 0.0000
164 M A -0.7380
165 Q A -1.1280
166 D A -0.9363
167 P A -0.8213
168 S A -1.1040
169 M A 0.0000
170 N A -1.5388
171 L A 0.0000
172 Q A -1.2725
173 G A 0.0000
174 L A 0.0000
175 A A 0.0000
176 V A 0.0000
177 G A 0.0000
178 N A 0.0000
179 G A 0.0000
180 L A 0.0000
181 S A 0.0000
182 S A 0.0000
183 Y A 0.0000
184 E A -1.2101
185 Q A -0.4954
186 N A 0.0000
187 D A 0.0000
188 N A 0.0000
189 S A 0.0000
190 L A 0.0000
191 V A 0.0000
192 Y A 0.1902
193 F A 0.0000
194 A A 0.0000
195 Y A 0.0000
196 Y A 0.0000
197 H A 0.0000
198 G A 0.0000
199 L A 0.0000
200 L A 0.0000
201 G A -0.9013
202 N A -1.0429
203 R A -2.1027
204 L A -0.9547
205 W A -0.6392
206 S A -0.9246
207 S A -1.0149
208 L A 0.0000
209 Q A -1.3212
210 T A -0.7266
211 H A -1.0566
212 C A 0.0000
213 C A -1.3947
214 S A -1.7650
215 Q A -2.9024
216 N A -3.2597
217 K A -2.7877
218 C A -1.5380
219 N A -1.3604
220 F A 0.0000
221 Y A -0.8357
222 D A -1.5938
223 N A -1.6741
224 K A -2.2192
225 D A -1.5692
226 L A -0.1220
227 E A -1.5051
228 C A 0.0000
229 V A -0.7389
230 T A -0.7544
231 N A -0.6000
232 L A 0.0000
233 Q A -0.8545
234 E A -0.7481
235 V A 0.0000
236 A A 0.0000
237 R A -0.4183
238 I A 0.0000
239 V A 0.0000
240 G A 0.0000
241 N A 0.0000
242 S A 0.0000
243 G A 0.0000
244 L A 0.0000
245 N A 0.0000
246 I A 0.0000
247 Y A 0.0000
248 N A -0.1528
249 L A 0.0000
250 Y A 0.0857
251 A A -0.1273
252 P A -0.3291
253 C A 0.0000
254 A A -0.5968
255 G A -0.9087
256 G A 0.0000
257 V A -0.4404
258 P A -0.5347
259 S A -0.7535
260 H A -0.9436
261 F A -0.0326
262 R A -1.2968
263 Y A -0.3125
264 E A -1.4294
265 K A -2.5695
266 D A -2.5683
267 T A -1.5273
268 V A -1.0989
269 V A -0.7059
270 V A 0.0000
271 Q A -0.8499
272 D A 0.0000
273 L A 0.0000
274 G A -0.3185
275 N A 0.0000
276 I A 0.0000
277 F A 0.0000
278 T A -0.1074
279 C A -0.2470
280 L A 0.0000
281 P A -0.6875
282 L A 0.0000
283 K A -1.5754
284 R A -1.8541
285 M A -1.0228
286 W A -0.7765
287 H A -1.4274
288 Q A -1.0969
289 A A -0.2783
290 L A 1.0340
291 L A 0.8215
292 R A -1.2732
293 S A -1.2394
294 G A -1.6775
295 D A -2.8220
296 K A -2.4397
297 V A -0.5467
298 R A -1.7646
1 M B -0.5340
2 D B -1.0276
3 P B 0.0000
4 P B -0.5085
5 C B -0.4374
6 T B -0.7901
7 N B -1.4498
8 T B 0.0000
9 T B -1.0352
10 A B -0.4771
11 A B 0.0000
12 S B 0.0000
13 T B -0.3392
14 Y B 0.0000
15 L B 0.0000
16 N B -0.7233
17 N B -0.3135
18 P B -0.5236
19 Y B 0.2255
20 V B 0.0000
21 R B 0.0000
22 K B -2.0103
23 A B -1.4678
24 L B 0.0000
25 N B -1.5016
26 I B 0.0000
27 P B -1.7059
28 E B -2.9173
29 Q B -2.1987
30 L B -1.3194
31 P B -1.3964
32 Q B -1.8604
33 W B 0.0000
34 D B -0.9184
35 M B 0.0000
36 C B 0.0000
37 N B 0.5575
38 F B 1.2975
39 L B 2.0503
40 V B 0.0000
41 N B 0.7229
42 L B 1.2193
43 Q B -0.2094
44 Y B 0.0000
45 R B -1.9728
46 R B -1.2780
47 L B -0.0998
48 Y B -0.5441
49 R B -1.7526
50 S B -1.0807
51 M B 0.0000
52 N B -0.7741
53 S B -0.4284
54 Q B 0.0000
55 Y B 0.0000
56 L B -0.2101
57 K B -0.9523
58 L B 0.0000
59 L B 0.0000
60 S B -1.0595
61 S B -1.4188
62 Q B -2.3658
63 K B -2.5376
64 Y B 0.0000
65 Q B -1.3558
66 I B 0.0000
67 L B 0.0000
68 L B 0.0000
69 Y B 0.0000
70 N B 0.0000
71 G B 0.0000
72 D B 0.0000
73 V B 0.0000
74 D B 0.0000
75 M B 0.0000
76 A B 0.0000
77 C B 0.0000
78 N B 0.0000
79 F B 0.0000
80 M B 0.0000
81 G B 0.0000
82 D B 0.0000
83 E B 0.0000
84 W B 0.0432
85 F B 0.0000
86 V B 0.0000
87 D B -0.9442
88 S B -0.7052
89 L B 0.0000
90 N B -1.7483
91 Q B -1.8675
92 K B -2.4089
93 M B -1.7709
94 E B -2.2147
95 V B -1.2011
96 Q B -1.7444
97 R B -1.3214
98 R B -0.7205
99 P B -0.2942
100 W B 0.0000
101 L B -0.1932
102 V B 0.0000
103 K B -2.2230
104 Y B -1.3446
105 G B -1.8013
106 D B -2.4339
107 S B -1.6955
108 G B -1.8452
109 E B -2.0166
110 Q B 0.0000
111 I B 0.0000
112 A B 0.0000
113 G B 0.0000
114 F B 0.0000
115 V B 0.0000
116 K B 0.0000
117 E B -1.1393
118 F B 0.0000
119 S B 0.0000
120 H B -1.6306
121 I B 0.0000
122 A B 0.0000
123 F B 0.0000
124 L B 0.0000
125 T B 0.0000
126 I B 0.0000
127 K B -0.2859
128 G B -0.2410
129 A B 0.0000
130 G B 0.0000
131 H B 0.0000
132 M B -0.0779
133 V B 0.0000
134 P B 0.0000
135 T B -0.4016
136 D B -0.8765
137 K B -0.6789
138 P B -0.1660
139 L B 0.0771
140 A B 0.0000
141 A B 0.0000
142 F B 0.4074
143 T B 0.0177
144 M B 0.0000
145 F B 0.0000
146 S B -0.7087
147 R B -1.6543
148 F B 0.0000
149 L B -1.4380
150 N B -2.4795
151 K B -2.9889
152 Q B -2.5526
153 P B -1.3282
154 Y B -0.6015
1 A C -1.2418
2 P C -1.5887
3 D C -2.7795
4 Q C -2.5548
5 D C 0.0000
6 E C -2.7571
7 I C 0.0000
8 Q C -2.9743
9 R C -3.0294
10 L C 0.0000
11 P C -0.5196
12 G C -0.4017
13 L C 0.0000
14 A C -1.2829
15 K C -2.6382
16 Q C -2.7579
17 P C -1.7155
18 S C -1.2064
19 F C 0.0000
20 R C -1.7074
21 Q C 0.0000
22 Y C 0.0000
23 S C 0.0000
24 G C 0.0000
25 Y C -0.2505
26 L C 0.0000
27 K C -1.6688
28 G C 0.0000
29 S C -1.0864
30 G C -1.3075
31 S C -1.6457
32 K C -1.4621
33 H C -0.9798
34 L C 0.0000
35 H C 0.0000
36 Y C 0.0000
37 W C 0.0000
38 F C 0.0000
39 V C 0.0000
40 E C 0.0000
41 S C 0.0000
42 Q C -1.4708
43 K C -2.9103
44 D C -3.5103
45 P C -2.7723
46 E C -3.6655
47 N C -3.1718
48 S C 0.0000
49 P C -1.4600
50 V C 0.0000
51 V C 0.0000
52 L C 0.0000
53 W C 0.0000
54 L C 0.0000
55 N C 0.0000
56 G C 0.0000
57 G C 0.0000
58 P C 0.0000
59 G C 0.0000
60 C C 0.0000
61 S C 0.0000
62 S C 0.0000
63 L C 0.0000
64 D C -0.1287
65 G C 0.0000
66 L C 0.0000
67 L C 0.0000
68 T C 0.0335
69 E C 0.0000
70 H C 0.0000
71 G C 0.0000
72 P C 0.0000
73 F C 0.0000
74 L C -0.1108
75 V C -0.1584
76 Q C -0.8044
77 P C -1.0686
78 D C -1.4409
79 G C 0.0000
80 V C 0.9799
81 T C -0.0395
82 L C 0.0000
83 E C -1.4443
84 Y C -0.5279
85 N C 0.0000
86 P C -0.0179
87 Y C 0.5246
88 S C 0.0000
89 W C 0.0000
90 N C 0.0000
91 L C -0.1063
92 I C -0.3640
93 A C 0.0000
94 N C 0.0000
95 V C 0.0000
96 L C 0.0000
97 Y C 0.0000
98 L C 0.0000
99 E C 0.0000
100 S C 0.0000
101 P C 0.0000
102 A C 0.0000
103 G C 0.0000
104 V C 0.0000
105 G C -0.6513
106 F C 0.0000
107 S C 0.0000
108 Y C -0.6627
109 S C 0.0000
110 D C -2.9887
111 D C -2.8864
112 K C -2.1215
113 F C 0.3391
114 Y C 0.5243
115 A C 0.2748
116 T C 0.0000
117 N C -1.1465
118 D C 0.0000
119 T C -0.7771
120 E C -1.4902
121 V C 0.0000
122 A C 0.0000
123 Q C -0.9524
124 S C 0.0000
125 N C 0.0000
126 F C -0.5801
127 E C -1.1165
128 A C 0.0000
129 L C 0.0000
130 Q C -1.6354
131 D C 0.0000
132 F C 0.0000
133 F C 0.0000
134 R C -2.2841
135 L C -1.2702
136 F C 0.0000
137 P C -1.9049
138 E C -2.6477
139 Y C 0.0000
140 K C -2.6366
141 N C -2.7843
142 N C 0.0000
143 K C -1.9060
144 L C 0.0000
145 F C 0.0000
146 L C 0.0000
147 T C 0.0000
148 G C 0.0000
149 E C 0.0000
150 S C 0.0000
151 Y C 0.0000
152 A C 0.0000
153 G C 0.0000
154 I C 0.0000
155 Y C 0.0000
156 I C 0.0000
157 P C 0.0000
158 T C 0.0000
159 L C 0.0000
160 A C 0.0000
161 V C -0.0936
162 L C -0.0245
163 V C 0.0000
164 M C -0.7507
165 Q C -1.1422
166 D C -0.9561
167 P C -0.8254
168 S C -1.1232
169 M C 0.0000
170 N C -1.5292
171 L C 0.0000
172 Q C -1.2788
173 G C 0.0000
174 L C 0.0000
175 A C 0.0000
176 V C 0.0000
177 G C 0.0000
178 N C 0.0000
179 G C 0.0000
180 L C 0.0000
181 S C 0.0000
182 S C 0.0000
183 Y C 0.0000
184 E C -1.5112
185 Q C -0.5723
186 N C 0.0000
187 D C 0.0000
188 N C 0.0000
189 S C 0.0000
190 L C 0.0000
191 V C 0.0000
192 Y C 0.1882
193 F C 0.0000
194 A C 0.0000
195 Y C 0.0000
196 Y C 0.0000
197 H C 0.0000
198 G C 0.0000
199 L C 0.0000
200 L C 0.0000
201 G C -0.9206
202 N C -1.0627
203 R C -2.1613
204 L C -1.0655
205 W C 0.0000
206 S C -1.0828
207 S C -1.1607
208 L C 0.0000
209 Q C -1.6901
210 T C -0.9033
211 H C -1.1325
212 C C 0.0000
213 C C -1.5021
214 S C -1.8215
215 Q C -2.9519
216 N C -3.2623
217 K C -2.8148
218 C C -1.5922
219 N C -1.3151
220 F C 0.0000
221 Y C 0.0000
222 D C -1.9348
223 N C -1.8158
224 K C -2.3492
225 D C -1.4953
226 L C -0.1031
227 E C -1.4994
228 C C 0.0000
229 V C -0.9100
230 T C -0.7485
231 N C -0.6905
232 L C 0.0000
233 Q C -0.8788
234 E C -0.7418
235 V C 0.0000
236 A C 0.0000
237 R C -0.5460
238 I C 0.0000
239 V C 0.0000
240 G C -0.2407
241 N C 0.0000
242 S C -0.0972
243 G C 0.0000
244 L C 0.0000
245 N C -0.0498
246 I C 0.0000
247 Y C 0.1686
248 N C 0.0000
249 L C 0.0000
250 Y C 0.1342
251 A C -0.0784
252 P C -0.3314
253 C C 0.0000
254 A C -0.6110
255 G C -0.9226
256 G C 0.0000
257 V C -0.5252
258 P C -0.7973
259 S C -0.9571
260 H C -1.2437
261 F C -0.7971
262 R C -2.0480
263 Y C -1.1811
264 E C -2.9783
265 K C -3.2868
266 D C -2.9647
267 T C -1.9452
268 V C -1.3910
269 V C 0.0000
270 V C 0.0000
271 Q C -0.6413
272 D C 0.0000
273 L C 0.0000
274 G C -0.0875
275 N C 0.0000
276 I C 0.0000
277 F C 0.0000
278 T C -1.1383
279 R C -2.3628 mutated: CR279C
280 L C 0.0000
281 P C -1.1361
282 L C 0.0000
283 K C -1.4684
284 R C -0.7744
285 M C -0.5099
286 W C -0.5603
287 H C -1.2888
288 Q C -1.1438
289 A C -0.3087
290 L C 0.8510
291 L C 0.8205
292 R C -1.2667
293 S C -1.3583
294 G C -1.6540
295 D C -2.6509
296 K C -2.4418
297 V C -0.5387
298 R C -1.7609
1 M D -0.8086
2 D D -1.3380
3 P D -0.7457
4 P D -0.6203
5 C D -0.5019
6 T D -0.8605
7 N D -1.5110
8 T D -1.0167
9 T D -1.1641
10 A D -0.5125
11 A D 0.0000
12 S D 0.0000
13 T D -0.4374
14 Y D 0.0000
15 L D 0.0000
16 N D -0.9262
17 N D -0.4127
18 P D -0.6225
19 Y D 0.1482
20 V D 0.0000
21 R D -1.4043
22 K D -2.1041
23 A D -1.5859
24 L D 0.0000
25 N D -1.6013
26 I D 0.0000
27 P D -1.7450
28 E D -2.9577
29 Q D -2.2108
30 L D -1.3740
31 P D -1.4958
32 Q D -2.0519
33 W D 0.0000
34 D D -1.5654
35 M D 0.0000
36 C D 0.0000
37 N D 0.2104
38 F D 0.9799
39 L D 1.7671
40 V D 0.0000
41 N D 0.7303
42 L D 1.4845
43 Q D 0.2490
44 Y D 0.0000
45 R D -1.8187
46 R D -1.2033
47 L D 0.0855
48 Y D -0.5327
49 R D -1.7617
50 S D -1.1113
51 M D 0.0000
52 N D -0.8423
53 S D -0.5204
54 Q D -0.4985
55 Y D 0.0000
56 L D -0.2730
57 K D -1.0323
58 L D 0.0000
59 L D 0.0000
60 S D -1.0721
61 S D -1.4267
62 Q D -2.3808
63 K D -2.5417
64 Y D 0.0000
65 Q D -1.3917
66 I D 0.0000
67 L D 0.0000
68 L D 0.0000
69 Y D 0.0000
70 N D 0.0000
71 G D 0.0000
72 D D 0.0000
73 V D 0.0000
74 D D 0.0000
75 M D 0.0000
76 A D 0.0000
77 C D 0.0000
78 N D 0.0000
79 F D 0.0000
80 M D 0.0000
81 G D 0.0000
82 D D 0.0000
83 E D 0.0000
84 W D 0.0210
85 F D 0.0000
86 V D 0.0000
87 D D -0.9759
88 S D -0.7261
89 L D 0.0000
90 N D -1.7545
91 Q D -1.8748
92 K D -2.4098
93 M D -1.7602
94 E D -2.2141
95 V D -1.2010
96 Q D -1.7439
97 R D -1.3253
98 R D -0.7251
99 P D -0.2927
100 W D 0.0000
101 L D -0.1875
102 V D 0.0000
103 K D -2.2085
104 Y D -1.3403
105 G D -1.7982
106 D D -2.4282
107 S D -1.6944
108 G D -1.8166
109 E D -1.9582
110 Q D 0.0000
111 I D 0.0000
112 A D 0.0000
113 G D 0.0000
114 F D 0.0000
115 V D 0.0000
116 K D 0.0000
117 E D -1.1471
118 F D 0.0000
119 S D -1.3900
120 H D -1.6614
121 I D 0.0000
122 A D 0.0000
123 F D 0.0000
124 L D 0.0000
125 T D 0.0000
126 I D 0.0000
127 K D -0.2752
128 G D -0.2094
129 A D 0.0000
130 G D 0.0000
131 H D 0.0000
132 M D -0.0636
133 V D 0.0000
134 P D 0.0000
135 T D -0.3716
136 D D -0.7976
137 K D -0.6453
138 P D -0.1440
139 L D 0.0954
140 A D 0.0000
141 A D 0.0000
142 F D 0.4196
143 T D 0.0233
144 M D 0.0000
145 F D 0.0000
146 S D -0.6804
147 R D -1.6097
148 F D 0.0000
149 L D 0.0000
150 N D -2.2761
151 K D -2.9039
152 Q D -2.4888
153 P D -1.2948
154 Y D -0.6077
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Laboratory of Theory of Biopolymers 2018