Project name: WT_ECD_TRIMER

Status: done

Started: 2026-04-28 01:17:15
Settings
Chain sequence(s) A: APPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPL
C: APPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPL
B: APPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPL
input PDB
Selected Chain(s) A,B,C
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:24)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (01:53:56)
[INFO]       Main:     Simulation completed successfully.                                          (02:01:40)
Show buried residues

Minimal score value
-3.9173
Maximal score value
2.3203
Average score
-0.7745
Total score value
-3726.8738

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 -0.1252
2 P A -0.5606
3 P A -0.8657
4 C A -0.3945
5 L A 0.4705
6 D A -1.3276
7 G A -0.9560
8 S A -0.8665
9 P A -1.1705
10 C A 0.0000
11 A A -1.3990
12 N A -1.5625
13 G A -1.3418
14 G A 0.0000
15 R A -1.0869
16 C A 0.0000
17 T A 0.0000
18 Q A -1.1081
19 L A 0.0000
20 P A -1.2113
21 S A -1.8520
22 R A -2.8357
23 E A -2.7294
24 A A -1.8302
25 A A -1.2998
26 C A -1.3203
27 L A 0.0000
28 C A 0.0000
29 P A -0.3927
30 P A -0.8452
31 G A -1.0950
32 W A -1.5466
33 V A 0.0000
34 G A -1.5306
35 E A -2.5844
36 R A -2.8903
37 C A 0.0000
38 Q A -1.9741
39 L A -1.6258
40 E A -2.2762
41 D A 0.0000
42 P A -1.2919
43 C A -1.1420
44 H A -1.5299
45 S A -1.1010
46 G A -0.9159
47 P A -0.5665
48 C A 0.0000
49 A A -0.2331
50 G A 0.0019
51 R A 0.0000
52 G A -0.7549
53 V A -0.2851
54 C A -0.8585
55 Q A -1.0578
56 S A -0.6942
57 S A -0.0023
58 V A 0.8015
59 V A 1.4473
60 A A 0.5668
61 G A -0.0006
62 T A -0.2509
63 A A 0.0000
64 R A -1.3594
65 F A -0.6557
66 S A -1.0125
67 C A -1.0815
68 R A -1.9786
69 C A -1.1930
70 P A 0.0000
71 R A -1.6780
72 G A -0.3114
73 F A -0.1940
74 R A -0.7064
75 G A -0.5989
76 P A -0.7963
77 D A -0.9415
78 C A 0.0000
79 S A -0.1471
80 L A 0.3034
81 P A -0.1779
82 D A -0.2894
83 P A 0.0476
84 C A 0.1588
85 L A 1.0037
86 S A 0.4442
87 S A 0.2177
88 P A -0.3578
89 C A -1.0661
90 A A -1.3817
91 H A -1.1980
92 G A -0.8667
93 A A -1.4302
94 R A -1.8173
95 C A -0.2913
96 S A -0.3419
97 V A -0.2586
98 G A 0.0000
99 P A -1.2794
100 D A -2.3120
101 G A -1.6593
102 R A -2.1087
103 F A -0.6698
104 L A -0.2673
105 C A -0.7997
106 S A -0.9069
107 C A -1.1553
108 P A -0.7028
109 P A -0.5357
110 G A 0.0000
111 Y A -1.9009
112 Q A -2.3592
113 G A -2.2906
114 R A -2.0456
115 S A -1.5389
116 C A 0.0000
117 R A -2.8756
118 S A -2.4311
119 D A -2.5148
120 V A -1.5072
121 D A -1.4209
122 E A -1.1859
123 C A -1.3164
124 R A -1.8408
125 V A 0.1340
126 G A -1.0819
127 E A -2.3722
128 P A -1.5925
129 C A 0.0000
130 R A -2.7108
131 H A -2.0057
132 G A -1.7459
133 G A -1.5126
134 T A -1.0615
135 C A -0.9699
136 L A -0.0918
137 N A -1.4165
138 T A -0.8252
139 P A -0.8184
140 G A 0.0000
141 S A -0.5667
142 F A -0.4647
143 R A -0.7972
144 C A -1.0617
145 Q A -1.0173
146 C A -0.8914
147 P A -0.5895
148 A A 0.1445
149 G A 0.0337
150 Y A -0.2042
151 T A -0.3725
152 G A -0.5467
153 P A -0.5631
154 L A -1.0137
155 C A 0.0000
156 E A -1.4949
157 N A -0.8839
158 P A -0.3313
159 A A 0.3636
160 V A 0.9558
161 P A -0.1345
162 C A -0.3542
163 A A -0.1799
164 P A -0.7075
165 S A -0.6870
166 P A -1.2993
167 C A 0.0000
168 R A -2.7928
169 N A -2.1158
170 G A -1.1125
171 G A -1.6193
172 T A -1.1328
173 C A -1.9275
174 R A -2.9168
175 Q A -2.4907
176 S A -1.8860
177 G A -1.4487
178 D A -1.4480
179 L A 0.1529
180 T A -0.8111
181 Y A -1.7419
182 D A -2.8180
183 C A -2.2012
184 A A -0.8380
185 C A -0.8305
186 L A 0.3095
187 P A 0.1857
188 G A -0.3916
189 F A -0.9773
190 E A -1.9207
191 G A -1.8012
192 Q A -2.3002
193 N A -2.2451
194 C A 0.0000
195 E A -2.1266
196 V A -1.2211
197 N A -1.4138
198 V A -0.9180
199 D A -2.1000
200 D A -1.9926
201 C A -1.4612
202 P A -1.2289
203 G A -0.9663
204 H A -0.8894
205 R A -0.5651
206 C A -0.3912
207 L A -0.1357
208 N A -0.7639
209 G A -0.8136
210 G A 0.0000
211 T A -0.5082
212 C A -0.6610
213 V A -0.4051
214 D A -1.1040
215 G A -0.4815
216 V A 0.5755
217 N A -0.9060
218 T A -0.7537
219 Y A 0.0000
220 N A -0.9804
221 C A -0.7494
222 Q A -1.1842
223 C A -0.9897
224 P A -0.6245
225 P A -0.5294
226 E A -0.7146
227 W A -0.8717
228 T A -1.2071
229 G A -1.2002
230 Q A -1.0633
231 F A -0.7191
232 C A 0.0000
233 T A -1.1076
234 E A -1.8087
235 D A 0.0000
236 V A -0.2257
237 D A 0.0000
238 E A 0.0000
239 C A -0.5268
240 Q A -0.7113
241 L A 0.2601
242 Q A -1.2411
243 P A -1.4464
244 N A -2.0502
245 A A -1.4776
246 C A 0.0000
247 H A -1.8327
248 N A -1.5000
249 G A -0.6902
250 G A -0.0493
251 T A 0.4998
252 C A -0.0053
253 F A 0.6288
254 N A -0.1182
255 T A 0.5597
256 L A 1.0401
257 G A -0.0977
258 G A -0.0966
259 H A -0.1099
260 S A -0.0795
261 C A 0.5021
262 V A 1.8299
263 C A 0.7731
264 V A 1.1251
265 N A 0.0088
266 G A 0.0000
267 W A -0.1113
268 T A -0.7081
269 G A -1.2388
270 E A -1.9566
271 S A -1.4415
272 C A 0.0000
273 S A -1.5917
274 Q A -1.8651
275 N A -1.1618
276 I A -0.5863
277 D A -1.5024
278 D A -0.6424
279 C A -0.5625
280 A A -0.4004
281 T A -0.2786
282 A A 0.0496
283 V A 0.0000
284 C A 0.0000
285 F A 0.9460
286 H A -0.5575
287 G A -0.6820
288 A A 0.2190
289 T A 0.1055
290 C A -0.0024
291 H A -0.7893
292 D A -1.2420
293 R A -1.2600
294 V A 0.4340
295 A A -0.1436
296 S A -0.3544
297 F A 0.1806
298 Y A 1.1341
299 C A 1.1369
300 A A 0.6308
301 C A 0.7553
302 P A 0.1382
303 M A -0.0814
304 G A 0.0000
305 K A -0.4912
306 T A -0.4270
307 G A 0.2690
308 L A 1.7819
309 L A 1.3966
310 C A 0.0000
311 H A -0.0358
312 L A -0.9688
313 D A -2.2836
314 D A 0.0000
315 A A -1.6180
316 C A 0.0000
317 V A 0.0000
318 S A -0.2435
319 N A -0.1883
320 P A -0.3597
321 C A 0.0000
322 H A -0.8164
323 E A -0.5787
324 D A -0.5330
325 A A 0.0000
326 I A 0.0497
327 C A -0.5652
328 D A -1.6645
329 T A -1.7045
330 N A -1.7347
331 P A -1.1022
332 V A -0.9861
333 N A -2.5139
334 G A 0.0000
335 R A -2.6280
336 A A -1.2843
337 I A -0.1869
338 C A -0.2362
339 T A 0.0715
340 C A 0.1054
341 P A 0.0000
342 P A -0.2214
343 G A -0.4558
344 F A -0.5086
345 T A -0.4880
346 G A -0.7424
347 G A -0.5821
348 A A -0.4580
349 C A 0.0000
350 D A -1.5243
351 Q A -1.2028
352 D A -1.5732
353 V A -0.4910
354 D A -1.2135
355 E A -1.0689
356 C A -0.5417
357 S A -0.3847
358 I A 0.0609
359 G A -0.7531
360 A A -0.9747
361 N A -1.3736
362 P A -0.8451
363 C A 0.0000
364 E A -1.8430
365 H A -1.2966
366 L A -0.1370
367 G A 0.0000
368 R A -1.8968
369 C A 0.0000
370 V A 0.0832
371 N A -0.5098
372 T A -0.4367
373 Q A -1.3793
374 G A -1.2411
375 S A -0.4851
376 F A 0.0042
377 L A 0.7405
378 C A -0.8165
379 Q A -1.5008
380 C A -1.5150
381 G A -1.3320
382 R A -2.0497
383 G A -1.7786
384 Y A -1.6291
385 T A -1.5109
386 G A -1.3671
387 P A -0.9744
388 R A -1.8895
389 C A 0.0000
390 E A -2.5187
391 T A -1.8417
392 D A -2.5225
393 V A -1.3281
394 N A -1.1574
395 E A -1.0898
396 C A -0.1064
397 L A 0.9132
398 S A 0.0726
399 G A -0.3484
400 P A -0.3086
401 C A -0.8102
402 R A -2.1906
403 N A -2.0620
404 Q A -1.6361
405 A A -0.4089
406 T A 0.2553
407 C A 0.4254
408 L A 0.1915
409 D A -1.1304
410 R A -1.8481
411 I A -1.4690
412 G A 0.0000
413 Q A -1.5552
414 F A -0.4620
415 T A 0.2934
416 C A 0.9555
417 I A 1.9944
418 C A 0.9523
419 M A 0.3142
420 A A 0.4502
421 G A -0.1616
422 F A -0.2978
423 T A 0.1189
424 G A -0.0111
425 T A 0.2147
426 Y A 0.1542
427 C A 0.0000
428 E A -1.1033
429 V A -0.1817
430 D A -1.5922
431 I A -0.7109
432 D A -2.4004
433 E A -2.4448
434 C A 0.0000
435 Q A -2.0560
436 S A -1.1376
437 S A -0.6829
438 P A -0.3340
439 C A 0.0000
440 V A 0.5343
441 N A -0.4677
442 G A -0.4300
443 G A 0.1326
444 V A 0.5109
445 C A -0.8412
446 K A -2.4031
447 D A -3.4266
448 R A -2.6349
449 V A -0.1916
450 N A -1.3615
451 G A -1.4116
452 F A -1.3957
453 S A -1.0265
454 C A -0.0910
455 T A 0.0182
456 C A 0.2027
457 P A -0.1922
458 S A -0.8641
459 G A -1.7313
460 F A -0.8299
461 S A -0.5358
462 G A -0.4415
463 S A -0.2951
464 T A -0.0279
465 C A 0.0000
466 Q A -0.8810
467 L A -0.2548
468 D A -2.4262
469 V A -1.7416
470 D A -2.9427
471 E A -3.0176
472 C A -1.8805
473 A A -1.0781
474 S A -0.7627
475 T A -1.0307
476 P A -0.8634
477 C A 0.0000
478 R A -3.1966
479 N A -2.8155
480 G A -2.3138
481 A A -2.9162
482 K A -2.9504
483 C A -2.4154
484 V A -2.1990
485 D A -3.4940
486 Q A -2.9603
487 P A -2.4351
488 D A -2.8627
489 G A -2.2102
490 Y A -2.2085
491 E A -2.3902
492 C A 0.0000
493 R A -3.1810
494 C A -3.0664
495 A A -2.0118
496 E A -2.0024
497 G A -1.3340
498 F A -2.7004
499 E A -3.6563
500 G A -2.5187
501 T A -1.6466
502 L A -2.1345
503 C A 0.0000
504 D A -3.8135
505 R A -3.8571
506 N A -2.4047
507 V A -1.9574
508 D A -1.9793
509 D A -1.1568
510 C A -1.4781
511 S A -1.3267
512 P A -1.0107
513 D A -1.7887
514 P A 0.0000
515 C A 0.0000
516 H A 0.0000
517 H A -0.6296
518 G A -1.0542
519 R A -1.9092
520 C A -1.0301
521 V A -0.2969
522 D A -1.4731
523 G A -0.0134
524 I A 0.9252
525 A A -0.2140
526 S A -0.1610
527 F A -0.4083
528 S A -0.3786
529 C A -0.6434
530 A A -0.3466
531 C A -0.5404
532 A A -0.5627
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1417 F C 0.0000
1418 D C 0.0000
1419 C C -0.6998
1420 H C -0.8047
1421 A C 0.0000
1422 G C -1.7217
1423 G C -1.8526
1424 R C -2.8939
1425 E C -2.4487
1426 R C -2.1984
1427 T C -1.7542
1428 C C 0.0000
1429 N C -1.6425
1430 P C -0.2952
1431 V C 1.1266
1432 Y C 0.1730
1433 E C -1.2705
1434 K C -1.8844
1435 Y C -0.7160
1436 C C 0.0000
1437 A C 0.0000
1438 D C -2.3058
1439 H C -1.5241
1440 F C 0.0000
1441 A C -0.7647
1442 D C -1.0085
1443 G C -0.8243
1444 R C -1.0547
1445 C C -0.9623
1446 D C -1.1305
1447 Q C -1.7199
1448 G C -1.1735
1449 C C 0.0000
1450 N C -1.1518
1451 T C -0.8330
1452 E C -0.7646
1453 E C -1.3985
1454 C C 0.0000
1455 G C 0.0000
1456 W C 0.0000
1457 D C 0.0000
1458 G C -0.4768
1459 L C 0.0000
1460 D C 0.0000
1461 C C -0.7836
1462 A C 0.0000
1463 S C -0.9517
1464 E C -1.6346
1465 V C -0.4081
1466 P C -0.1047
1467 A C 0.5683
1468 L C 1.5326
1469 L C 1.0075
1470 A C 0.0000
1471 R C -1.2048
1472 G C -0.8883
1473 V C 0.0000
1474 L C 0.0000
1475 V C 0.0000
1476 L C 0.0000
1477 T C 0.0000
1478 V C 0.0000
1479 L C 0.5088
1480 L C 0.0274
1481 P C -0.4542
1482 P C -1.0760
1483 E C -2.6775
1484 E C -2.5443
1485 L C 0.0000
1486 L C -1.2803
1487 R C -2.5101
1488 S C -1.6096
1489 S C -1.1466
1490 A C -1.1042
1491 D C -1.4377
1492 F C 0.0000
1493 L C 0.0000
1494 Q C 0.0000
1495 R C -0.7319
1496 L C 0.0000
1497 S C 0.0000
1498 A C -0.3595
1499 I C -0.2058
1500 L C 0.0000
1501 R C 0.0000
1502 T C 0.0000
1503 S C 0.0000
1504 L C 0.0000
1505 R C -1.0179
1506 F C 0.0000
1507 R C -0.6132
1508 L C -0.6078
1509 D C -0.9331
1510 A C -0.9588
1511 H C -1.4730
1512 G C -1.3434
1513 Q C -1.5520
1514 A C -0.6256
1515 M C 0.0000
1516 V C 0.0215
1517 F C 0.4389
1518 P C -0.1456
1519 Y C 0.0000
1520 H C -0.9795
1521 R C -1.4463
1522 P C -1.3162
1523 S C -1.1388
1524 P C -0.8498
1525 G C -1.1647
1526 S C -1.3925
1527 E C -1.6671
1528 P C -1.8807
1529 R C -3.0656
1530 A C -2.5435
1531 R C -3.1410
1532 R C -2.7772
1533 E C -2.7204
1534 L C -1.6240
1535 A C -0.7706
1536 P C -1.3746
1537 E C -1.5537
1538 V C -0.2128
1539 I C 0.0237
1540 G C 0.0000
1541 S C 0.0000
1542 V C 0.0000
1543 V C 0.0000
1544 M C 0.0000
1545 L C 0.0000
1546 E C -0.6006
1547 I C 0.0000
1548 D C 0.0000
1549 N C 0.0000
1550 R C 0.7525
1551 L C 0.7301
1552 C C 0.6026
1553 L C 0.4077
1554 Q C -0.8933
1555 S C -1.0816
1556 P C -1.3953
1557 E C -2.2745
1558 N C -1.4984
1559 D C 0.0000
1560 H C 0.0000
1561 C C 0.0000
1562 F C 0.0000
1563 P C 0.1645
1564 D C -0.5530
1565 A C 0.0000
1566 Q C -0.7639
1567 S C -0.5831
1568 A C 0.0000
1569 A C 0.0000
1570 D C 0.0000
1571 Y C 0.0000
1572 L C 0.0000
1573 G C 0.0000
1574 A C 0.0000
1575 L C 0.0000
1576 S C -0.9220
1577 A C 0.0000
1578 V C -1.2679
1579 E C -2.4107
1580 R C -2.1507
1581 L C -1.3719
1582 D C -2.1113
1583 F C -0.8042
1584 P C -0.5855
1585 Y C -0.1907
1586 P C 0.0224
1587 L C 0.0103
1588 R C -0.5543
1589 D C -0.7059
1590 V C 0.0000
1591 R C -0.8520
1592 G C -0.6849
1593 E C 0.0000
1594 P C -1.1174
1595 L C -0.8191
1596 E C -1.9993
1597 P C -1.6290
1598 P C -1.8498
1599 E C -2.2551
1600 P C -0.9095
1601 S C -0.1711
1602 V C 1.2691
1603 P C 0.6268
1604 L C 0.2633
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Laboratory of Theory of Biopolymers 2018