Project name: Fibrinogen

Status: done

Started: 2025-07-27 21:56:47
Settings
Chain sequence(s) A: ACKDSDWPFCSDEDWNYKCPSGCRMKGLIDEVNQDFTNRINKLKNSLFEYQKNNKDSHSLTTNIMEILRGDFSSANNRDNTYNRVSEDLRSRIEVLKRKVIEKVQHIQLLQKNVRAQLVDMKRLEVDIDIKIRSCRGSCSRALAREVDLKDYEDQQKQLEQVIAKDLLPSRDRQ
C: RFGSYCPTTCGIADFLSTYQTKVDKDLQSLEDILHQVENKTSEVKQLIKAIQLTYNPDESSKPNMIDAATLKSRKMLEEIMKYEASILTHDSSIRYLQEIYNSNNQKIVNLKEKVAQLEAQCQEPCKDTVQIHDITGKDCQDIANKGAKQSGLYFIKPLKANQQFLVYCEIDGSGNGWTVFQKRLDGSVDFKKNWIQYKEGFGHLSPTGTTEFWLGNEKIHLISTQSAIPYALRVELEDWNGRTSTADYAMFKVGPEADKYRLTYAYFAGGDAGDAFDGFDFGDDPSDKFFTSHNGMQFSTWDNDNDKFEGNCAEQDGSGWWMNKCHAGHLNGVYYQGGTYSKASTPNGYDNGIIWATWKTRWYSMKKTTMKIIPFNRLTI
B: KAPDAGGCLHADPDLGVLCPTGCQLQEALLQQERPIRNSVDELNNNVEAVSQTSSSSFQYMYLLKDLWQKRQKQVKDNENVVNEYSSELEKHQLYIDETVNSNIPTNLRVLRSILENLRSKIQKLESDVSAQMEYCRTPCTVSCNIPVVSGKECEEIIRKGGETSEMYLIQPDSSVKPYRVYCDMNTENGGWTVIQNRQDGSVDFGRKWDPYKQGFGNVATNTDGKNYCGLPGEYWLGNDKISQLTRMGPTELLIEMEDWKGDKVKAHYGGFTVQNEANKYQISVNKYRGTAGNALMDGASQLMGENRTMTIHNGMFFSTYDRDNDGWLTSDPRKQCSKEDGGGWWYNRCHAANPNGRYYWGGQYTWDMAKHGTDDGVVWMNWKGSWYSMRKMSMKIRPFF
E: KAPDAGGCLHADPDLGVLCPTGCQLQEALLQQERPIRNSVDELNNNVEAVSQTSSSSFQYMYLLKDLWQKRQKQVKDNENVVNEYSSELEKHQLYIDETVNSNIPTNLRVLRSILENLRSKIQKLESDVSAQMEYCRTPCTVSCNIPVVSGKECEEIIRKGGETSEMYLIQPDSSVKPYRVYCDMNTENGGWTVIQNRQDGSVDFGRKWDPYKQGFGNVATNTDGKNYCGLPGEYWLGNDKISQLTRMGPTELLIEMEDWKGDKVKAHYGGFTVQNEANKYQISVNKYRGTAGNALMDGASQLMGENRTMTIHNGMFFSTYDRDNDGWLTSDPRKQCSKEDGGGWWYNRCHAANPNGRYYWGGQYTWDMAKHGTDDGVVWMNWKGSWYSMRKMSMKIRPFF
D: ACKDSDWPFCSDEDWNYKCPSGCRMKGLIDEVNQDFTNRINKLKNSLFEYQKNNKDSHSLTTNIMEILRGDFSSANNRDNTYNRVSEDLRSRIEVLKRKVIEKVQHIQLLQKNVRAQLVDMKRLEVDIDIKIRSCRGSCSRALAREVDLKDYEDQQKQLEQVIAKDLLPSRDRQ
G: ACKDSDWPFCSDEDWNYKCPSGCRMKGLIDEVNQDFTNRINKLKNSLFEYQKNNKDSHSLTTNIMEILRGDFSSANNRDNTYNRVSEDLRSRIEVLKRKVIEKVQHIQLLQKNVRAQLVDMKRLEVDIDIKIRSCRGSCSRALAREVDLKDYEDQQKQLEQVIAKDLLPSRDRQ
F: RFGSYCPTTCGIADFLSTYQTKVDKDLQSLEDILHQVENKTSEVKQLIKAIQLTYNPDESSKPNMIDAATLKSRKMLEEIMKYEASILTHDSSIRYLQEIYNSNNQKIVNLKEKVAQLEAQCQEPCKDTVQIHDITGKDCQDIANKGAKQSGLYFIKPLKANQQFLVYCEIDGSGNGWTVFQKRLDGSVDFKKNWIQYKEGFGHLSPTGTTEFWLGNEKIHLISTQSAIPYALRVELEDWNGRTSTADYAMFKVGPEADKYRLTYAYFAGGDAGDAFDGFDFGDDPSDKFFTSHNGMQFSTWDNDNDKFEGNCAEQDGSGWWMNKCHAGHLNGVYYQGGTYSKASTPNGYDNGIIWATWKTRWYSMKKTTMKIIPFNRLTIG
I: VATRDNCCILDERFGSYCPTTCGIADFLSTYQTKVDKDLQSLEDILHQVENKTSEVKQLIKAIQLTYNPDESSKPNMIDAATLKSRKMLEEIMKYEASILTHDSSIRYLQEIYNSNNQKIVNLKEKVAQLEAQCQEPCKDTVQIHDITGKDCQDIANKGAKQSGLYFIKPLKANQQFLVYCEIDGSGNGWTVFQKRLDGSVDFKKNWIQYKEGFGHLSPTGTTEFWLGNEKIHLISTQSAIPYALRVELEDWNGRTSTADYAMFKVGPEADKYRLTYAYFAGGDAGDAFDGFDFGDDPSDKFFTSHNGMQFSTWDNDNDKFEGNCAEQDGSGWWMNKCHAGHLNGVYYQGGTYSKASTPNGYDNGIIWATWKTRWYSMKKTTMKIIPFNRLTIG
H: KAPDAGGCLHADPDLGVLCPTGCQLQEALLQQERPIRNSVDELNNNVEAVSQTSSSSFQYMYLLKDLWQKRQKQVKDNENVVNEYSSELEKHQLYIDETVNSNIPTNLRVLRSILENLRSKIQKLESDVSAQMEYCRTPCTVSCNIPVVSGKECEEIIRKGGETSEMYLIQPDSSVKPYRVYCDMNTENGGWTVIQNRQDGSVDFGRKWDPYKQGFGNVATNTDGKNYCGLPGEYWLGNDKISQLTRMGPTELLIEMEDWKGDKVKAHYGGFTVQNEANKYQISVNKYRGTAGNALMDGASQLMGENRTMTIHNGMFFSTYDRDNDGWLTSDPRKQCSKEDGGGWWYNRCHAANPNGRYYWGGQYTWDMAKHGTDDGVVWMNWKGSWYSMRKMSMKIRPFF
K: KAPDAGGCLHADPDLGVLCPTGCQLQEALLQQERPIRNSVDELNNNVEAVSQTSSSSFQYMYLLKDLWQKRQKQVKDNENVVNEYSSELEKHQLYIDETVNSNIPTNLRVLRSILENLRSKIQKLESDVSAQMEYCRTPCTVSCNIPVVSGKECEEIIRKGGETSEMYLIQPDSSVKPYRVYCDMNTENGGWTVIQNRQDGSVDFGRKWDPYKQGFGNVATNTDGKNYCGLPGEYWLGNDKISQLTRMGPTELLIEMEDWKGDKVKAHYGGFTVQNEANKYQISVNKYRGTAGNALMDGASQLMGENRTMTIHNGMFFSTYDRDNDGWLTSDPRKQCSKEDGGGWWYNRCHAANPNGRYYWGGQYTWDMAKHGTDDGVVWMNWKGSWYSMRKMSMKIRPFF
J: ACKDSDWPFCSDEDWNYKCPSGCRMKGLIDEVNQDFTNRINKLKNSLFEYQKNNKDSHSLTTNIMEILRGDFSSANNRDNTYNRVSEDLRSRIEVLKRKVIEKVQHIQLLQKNVRAQLVDMKRLEVDIDIKIRSCRGSCSRALAREVDLKDYEDQQKQLEQVIAKDLLPSRDRQHLPLIKMKPVPD
M: GPRP
L: RDNCCILDERFGSYCPTTCGIADFLSTYQTKVDKDLQSLEDILHQVENKTSEVKQLIKAIQLTYNPDESSKPNMIDAATLKSRKMLEEIMKYEASILTHDSSIRYLQEIYNSNNQKIVNLKEKVAQLEAQCQEPCKDTVQIHDITGKDCQDIANKGAKQSGLYFIKPLKANQQFLVYCEIDGSGNGWTVFQKRLDGSVDFKKNWIQYKEGFGHLSPTGTTEFWLGNEKIHLISTQSAIPYALRVELEDWNGRTSTADYAMFKVGPEADKYRLTYAYFAGGDAGDAFDGFDFGDDPSDKFFTSHNGMQFSTWDNDNDKFEGNCAEQDGSGWWMNKCHAGHLNGVYYQGGTYSKASTPNGYDNGIIWATWKTRWYSMKKTTMKIIPFNRLTIG
O: GHRP
N: GPRP
Q: GPRP
P: GHRP
S: GHRP
R: GPRP
T: GHRP
input PDB
Selected Chain(s) A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T
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                                        (00:00:13)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (01:21:47)
[INFO]       Main:     Simulation completed successfully.                                          (01:24:15)
Show buried residues

Minimal score value
-4.5455
Maximal score value
2.4316
Average score
-0.9675
Total score value
-3765.4004

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
27 A A -1.7466
28 C A -1.8062
29 K A -2.9107
30 D A -3.1014
31 S A -2.1792
32 D A -2.6026
33 W A -0.5399
34 P A 0.5110
35 F A 1.9961
36 C A 0.2264
37 S A -1.2359
38 D A -2.8630
39 E A -2.9164
40 D A -1.6682
41 W A -1.6246
42 N A -1.6656
43 Y A -0.6253
44 K A -0.5854
45 C A 0.0000
46 P A 0.0000
47 S A -0.1593
48 G A 0.0000
49 C A 0.0000
50 R A -1.1971
51 M A 0.0000
52 K A -1.0061
53 G A 0.0000
54 L A -1.2761
55 I A 0.0000
56 D A -1.9813
57 E A -2.7413
58 V A -1.8933
59 N A 0.0000
60 Q A -2.9001
61 D A -3.5120
62 F A 0.0000
63 T A -2.5204
64 N A -3.3362
65 R A -2.8834
66 I A 0.0000
67 N A -3.4438
68 K A -3.4141
69 L A 0.0000
70 K A -2.0045
71 N A -2.2172
72 S A -1.6650
73 L A 0.0000
74 F A 0.0071
75 E A -2.0118
76 Y A -1.6390
77 Q A -1.8171
78 K A -3.1553
79 N A -2.8739
80 N A -2.9685
81 K A -4.0020
82 D A -3.6062
83 S A -2.5143
84 H A -2.3760
85 S A -1.8359
86 L A -1.1559
87 T A -0.8789
88 T A -1.0213
89 N A -1.1683
90 I A -0.4588
91 M A -1.0771
92 E A -2.1476
93 I A -0.6048
94 L A -1.1232
95 R A -2.3887
96 G A -1.7136
97 D A -1.8608
98 F A -1.4365
99 S A -1.6848
100 S A -2.0747
101 A A -1.8863
102 N A -2.9719
103 N A -3.2345
104 R A -3.1296
105 D A -2.9440
106 N A -2.7350
107 T A -2.1069
108 Y A -2.2248
109 N A -3.5328
110 R A -3.6602
111 V A -2.1264
112 S A -2.8666
113 E A -4.0784
114 D A -3.8499
115 L A 0.0000
116 R A -3.0735
117 S A -2.4204
118 R A -2.3600
119 I A -1.8265
120 E A -2.3588
121 V A -1.3093
122 L A 0.0000
123 K A -1.4932
124 R A -2.1711
125 K A -1.9363
126 V A 0.0000
127 I A -0.0326
128 E A -1.6085
129 K A -1.1430
130 V A -0.0054
131 Q A -0.4780
132 H A -0.7956
133 I A 0.0000
134 Q A -0.2717
135 L A -0.0955
136 L A -0.5781
137 Q A 0.0000
138 K A -1.9933
139 N A -1.3668
140 V A 0.0000
141 R A -2.2547
142 A A -1.3554
143 Q A 0.0000
144 L A 0.0000
145 V A -0.6297
146 D A -1.5314
147 M A 0.0000
148 K A 0.0000
149 R A -0.9465
150 L A 0.0000
151 E A 0.0000
152 V A 0.0000
153 D A 0.0000
154 I A 0.0000
155 D A 0.0000
156 I A 0.0160
157 K A -0.5913
158 I A 0.0000
159 R A -0.7891
160 S A 0.0000
161 C A 0.0000
162 R A -1.9766
163 G A 0.0000
164 S A -1.8930
165 C A 0.0000
166 S A -1.6639
167 R A -2.5583
168 A A -1.4351
169 L A -0.7840
170 A A -0.5288
171 R A 0.0000
172 E A -1.9268
173 V A -1.6028
174 D A -2.9743
175 L A -2.4424
176 K A -3.3408
177 D A -3.4170
178 Y A 0.0000
179 E A -3.0974
180 D A -3.7652
181 Q A -2.9458
182 Q A -3.0159
183 K A -3.8296
184 Q A -2.9351
185 L A 0.0000
186 E A -3.5655
187 Q A -2.8195
188 V A -1.7433
189 I A -1.4032
190 A A -1.1939
191 K A -1.7789
192 D A -0.4283
193 L A 1.1041
194 L A 0.2840
195 P A -0.5811
196 S A -1.4335
197 R A -2.9608
198 D A -3.5326
199 R A -3.6075
200 Q A -2.5917
58 K B -2.0454
59 A B -1.6076
60 P B -1.5660
61 D B -1.4801
62 A B -0.7856
63 G B -0.5832
64 G B 0.0000
65 C B 0.0000
66 L B 0.4363
67 H B -0.0974
68 A B -0.3076
69 D B -1.5470
70 P B -1.8149
71 D B -2.4770
72 L B -1.2812
73 G B -1.1202
74 V B -0.1092
75 L B 0.0000
76 C B -0.0504
77 P B 0.0000
78 T B 0.0000
79 G B -0.0383
80 C B -0.3439
81 Q B -0.9334
82 L B 0.0000
83 Q B 0.0000
84 E B -1.7775
85 A B -1.2728
86 L B 0.0000
87 L B -1.3886
88 Q B -2.1817
89 Q B -2.0095
90 E B 0.0000
91 R B -3.0253
92 P B -2.1347
93 I B -1.9147
94 R B -3.1131
95 N B -3.3176
96 S B -2.3582
97 V B -2.7079
98 D B -3.9630
99 E B -3.7903
100 L B 0.0000
101 N B -3.1944
102 N B -3.2312
103 N B -2.7321
104 V B 0.0000
105 E B -2.4885
106 A B -1.7218
107 V B -1.1005
108 S B -1.4483
109 Q B -1.7948
110 T B -0.9188
111 S B -1.0637
112 S B -0.9831
113 S B -0.6863
114 S B -0.4876
115 F B -0.4307
116 Q B 0.0938
117 Y B 1.5236
118 M B 1.4293
119 Y B 1.9057
120 L B 2.2420
121 L B 1.2342
122 K B 0.0879
123 D B -1.3667
124 L B -0.7939
125 W B -1.3673
126 Q B -2.6282
127 K B -3.7652
128 R B -3.4299
129 Q B -3.0754
130 K B -4.1877
131 Q B -3.5991
132 V B -2.3154
133 K B -3.4036
134 D B -2.8023
135 N B -1.5203
136 E B -1.9228
137 N B -1.6346
138 V B 0.7084
139 V B 1.1124
140 N B -0.6451
141 E B -1.5748
142 Y B -0.2765
143 S B -1.3768
144 S B -2.0724
145 E B -2.6720
146 L B -2.0929
147 E B -1.8387
148 K B -2.4703
149 H B 0.0000
150 Q B -1.3482
151 L B -0.8784
152 Y B -0.7050
153 I B 0.0000
154 D B -1.6451
155 E B -2.4263
156 T B 0.0000
157 V B 0.0000
158 N B -2.2138
159 S B -1.7519
160 N B -1.8900
161 I B 0.0000
162 P B -1.3761
163 T B -1.2726
164 N B -1.0256
165 L B 0.0000
166 R B -2.2493
167 V B -1.1811
168 L B 0.0000
169 R B -2.1954
170 S B -1.7296
171 I B 0.0000
172 L B 0.0000
173 E B -2.5684
174 N B -2.0096
175 L B 0.0000
176 R B -2.4388
177 S B -2.1578
178 K B -2.1293
179 I B 0.0000
180 Q B -2.7316
181 K B -2.7503
182 L B 0.0000
183 E B -2.2859
184 S B -1.4917
185 D B -0.9947
186 V B 0.0000
187 S B -0.8800
188 A B -0.6037
189 Q B 0.0000
190 M B -1.4648
191 E B -2.2168
192 Y B -1.7203
193 C B -2.0517
194 R B -2.6473
195 T B -1.5607
196 P B -1.7274
197 C B -1.1551
198 T B -0.9515
199 V B -0.5482
200 S B -0.7838
201 C B 0.0000
202 N B -0.5060
203 I B 0.0000
204 P B 0.0000
205 V B 0.0000
206 V B 0.0000
207 S B -0.4769
208 G B 0.0000
209 K B -1.0730
210 E B 0.0000
211 C B 0.0000
212 E B -1.2801
213 E B -1.3736
214 I B 0.0000
215 I B -1.5588
216 R B -2.1470
217 K B -1.2830
218 G B -1.2257
219 G B -1.3003
220 E B -2.4399
221 T B -1.2315
222 S B -0.6392
223 E B 0.0000
224 M B 0.0000
225 Y B 0.0000
226 L B 0.0000
227 I B 0.0000
228 Q B 0.0000
229 P B 0.0000
230 D B -0.8846
231 S B -1.0169
232 S B -0.4867
233 V B -0.5319
234 K B -1.5179
235 P B 0.0000
236 Y B -0.6995
237 R B -0.7932
238 V B 0.0000
239 Y B 0.0000
240 C B 0.0000
241 D B -1.1785
242 M B 0.0000
243 N B -2.4518
244 T B -1.8514
245 E B -2.5780
246 N B -2.6257
247 G B 0.0000
248 G B 0.0000
249 W B 0.0000
250 T B 0.0000
251 V B 0.0000
252 I B 0.0000
253 Q B 0.0000
254 N B 0.0000
255 R B 0.0000
256 Q B -1.0182
257 D B -0.8530
258 G B 0.0000
259 S B -0.9198
260 V B 0.0000
261 D B -0.9572
262 F B 0.0000
263 G B -0.7612
264 R B -1.4871
265 K B -2.6680
266 W B 0.0000
267 D B -2.9753
268 P B -1.9737
269 Y B 0.0000
270 K B -2.3271
271 Q B -2.1537
272 G B -1.2352
273 F B 0.0000
274 G B -0.6188
275 N B -0.5894
276 V B 0.0677
277 A B 0.0000
278 T B -0.1572
279 N B -1.0738
280 T B -1.3615
281 D B -2.4001
282 G B -2.0316
283 K B -2.1864
284 N B -1.3561
285 Y B -0.5283
286 C B 0.0000
287 G B 0.1718
288 L B 0.7553
289 P B 0.3425
290 G B 0.0517
291 E B 0.0000
292 Y B 0.0000
293 W B 0.0000
294 L B 0.0000
295 G B 0.0000
296 N B 0.0000
297 D B -1.9222
298 K B -1.4106
299 I B 0.0000
300 S B 0.0000
301 Q B -1.3453
302 L B 0.0000
303 T B 0.0000
304 R B -1.0153
305 M B -0.3488
306 G B -0.0857
307 P B 0.1339
308 T B 0.0000
309 E B 0.0000
310 L B 0.0000
311 L B 0.0000
312 I B 0.0000
313 E B -1.2294
314 M B 0.0000
315 E B -2.7384
316 D B 0.0000
317 W B -1.8498
318 K B -2.6659
319 G B -2.6854
320 D B -3.4523
321 K B -3.3197
322 V B -1.5581
323 K B -1.5252
324 A B 0.0000
325 H B -1.4240
326 Y B 0.0000
327 G B -1.2018
328 G B -0.8957
329 F B 0.0000
330 T B -0.6449
331 V B 0.0000
332 Q B -1.5674
333 N B -1.9780
334 E B -1.5835
335 A B -1.1532
336 N B -1.5465
337 K B -1.5991
338 Y B 0.0000
339 Q B -0.9086
340 I B 0.0000
341 S B -0.4935
342 V B 0.0000
343 N B -2.1061
344 K B -2.5337
345 Y B -2.1457
346 R B -2.6010
347 G B -1.5066
348 T B -1.0593
349 A B 0.0000
350 G B -0.8697
351 N B -1.2159
352 A B 0.0000
353 L B 0.0000
354 M B -1.1060
355 D B -1.8028
356 G B 0.0000
357 A B 0.0000
358 S B -1.0907
359 Q B -1.1831
360 L B -0.7083
361 M B -0.1475
362 G B -1.0824
363 E B -2.1013
364 N B -1.6601
365 R B -1.6142
366 T B -1.2242
367 M B -1.1265
368 T B 0.0000
369 I B -0.4269
370 H B 0.0000
371 N B -0.5374
372 G B -0.0866
373 M B 0.0232
374 F B -0.2723
375 F B 0.0000
376 S B 0.0000
377 T B 0.0000
378 Y B -2.1364
379 D B -3.1414
380 R B -3.0546
381 D B -2.6348
382 N B -1.3153
383 D B -0.8041
384 G B -0.2836
385 W B -0.0934
386 L B 0.8979
387 T B 0.0286
388 S B -0.4901
389 D B -1.2310
390 P B -1.9765
391 R B -2.7858
392 K B -2.3309
393 Q B -2.0679
394 C B 0.0000
395 S B 0.0000
396 K B -2.2026
397 E B 0.0000
398 D B 0.0000
399 G B -0.7062
400 G B 0.0000
401 G B 0.0000
402 W B 0.0000
403 W B 0.0000
404 Y B 0.0000
405 N B -0.2743
406 R B -0.7504
407 C B 0.0000
408 H B 0.0000
409 A B 0.0000
410 A B 0.0000
411 N B 0.0000
412 P B 0.0000
413 N B 0.0000
414 G B 0.0000
415 R B -0.1957
416 Y B 0.0000
417 Y B 0.0000
418 W B 0.0740
419 G B -0.5682
420 G B 0.0000
421 Q B -1.1085
422 Y B 0.0000
423 T B 0.3896
424 W B 0.8400
425 D B 0.0000
426 M B 0.0000
427 A B 0.0000
428 K B -1.9254
429 H B -1.9559
430 G B -0.6120
431 T B -0.3091
432 D B 0.0000
433 D B 0.0000
434 G B 0.0000
435 V B 0.0000
436 V B 0.0000
437 W B 0.0000
438 M B 0.0000
439 N B -0.9540
440 W B -0.4438
441 K B -0.7873
442 G B -0.5692
443 S B -0.1929
444 W B 0.1276
445 Y B 0.0000
446 S B 0.0000
447 M B 0.0000
448 R B -1.7723
449 K B -1.8767
450 M B 0.0000
451 S B -0.4821
452 M B 0.0000
453 K B 0.0000
454 I B 0.0000
455 R B -0.0685
456 P B 0.4374
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35 K L -2.7818
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46 I L -1.0432
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49 Q L -2.3366
50 V L -1.5166
51 E L -1.9000
52 N L -2.6950
53 K L -2.4567
54 T L -1.8915
55 S L -1.9161
56 E L -2.2612
57 V L -1.7590
58 K L -2.4012
59 Q L -2.3335
60 L L -1.3086
61 I L 0.0000
62 K L -1.8819
63 A L -0.6005
64 I L -0.0396
65 Q L -0.2758
66 L L 0.7152
67 T L 0.2374
68 Y L -0.0944
69 N L -1.4776
70 P L -1.9354
71 D L -3.1811
72 E L -3.1432
73 S L -2.1947
74 S L -1.6187
75 K L -1.6982
76 P L -1.2725
77 N L -2.0246
78 M L -0.8660
79 I L -1.0505
80 D L -1.3169
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87 R L -2.5955
88 K L -3.2763
89 M L -1.9852
90 L L -2.0062
91 E L -3.1926
92 E L -2.9196
93 I L -1.1963
94 M L -0.5309
95 K L -1.7242
96 Y L -0.5037
97 E L -0.0538
98 A L 0.1624
99 S L 0.2245
100 I L 0.6992
101 L L 1.4721
102 T L 0.5606
103 H L 0.1140
104 D L -0.5588
105 S L -0.1620
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108 R L -2.0193
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149 T L -1.0292
150 G L -1.2470
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277 T L -0.5000
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280 Y L 1.1969
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388 P L -0.0650
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390 N L -0.6708
391 R L -0.3980
392 L L 0.3293
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394 I L 1.4758
395 G L 0.2238
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2 P M -0.9222
3 R M -1.6372
4 P M -1.3103
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4 P N -0.8079
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4 P O -0.7678
1 G P 0.0000
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3 R P -0.9220
4 P P -0.8212
1 G Q 0.0000
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1 G R 0.0000
2 P R 0.0000
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4 P R -0.6855
1 G S 0.0000
2 H S -0.7658
3 R S -0.6800
4 P S -0.7406
1 G T 0.0000
2 H T -0.9371
3 R T -0.8226
4 P T -0.7926
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Laboratory of Theory of Biopolymers 2018