Project name: 115-5Ms-T5

Status: done

Started: 2025-12-11 08:43:48
Settings
Chain sequence(s) A: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAIGGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
C: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
E: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
G: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
I: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
K: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHTSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
input PDB
Selected Chain(s) A,C,E,G,I,K
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                                        (00:02:39)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (03:01:58)
[INFO]       Main:     Simulation completed successfully.                                          (03:15:35)
Show buried residues

Minimal score value
-3.6324
Maximal score value
4.351
Average score
-0.4417
Total score value
-2664.5386

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
21 T A -1.1210
22 G A -0.6544
23 P A -0.0685
24 I A 0.9632
25 I A 0.7606
26 C A 0.1278
27 A A -0.7286
28 G A 0.0000
29 P A -0.1316
30 I A 0.3725
31 H A -0.6602
32 S A -1.0609
33 N A -2.3039
34 K A -2.7206
35 S A -1.7565
36 A A -1.6996
37 N A -1.9035
38 I A 0.0000
39 P A -0.7736
40 H A -0.7674
41 L A 0.5510
42 L A 1.3891
43 G A 0.0000
44 Y A 0.5919
45 S A 0.0000
46 E A 0.0002
47 K A 0.0412
48 I A 0.0000
49 C A 0.0000
50 Q A 0.0000
51 I A 0.0000
52 D A 0.0000
53 R A -0.6758
54 L A 0.0000
55 I A 0.0000
56 H A -0.2902
57 V A 0.0000
58 S A 0.0000
59 S A -1.1446
60 W A 0.0000
61 L A 0.0000
62 R A -2.4631
63 N A -2.3965
64 H A -1.9310
65 S A -1.7297
66 Q A -2.3627
67 F A 0.0000
68 Q A -2.0196
69 G A -1.4350
70 Y A -0.3875
71 V A 0.0000
72 G A 0.0000
73 Q A -0.8966
74 R A -1.9824
75 G A 0.0000
76 G A 0.0000
77 R A -1.0572
78 S A -1.2506
79 Q A -2.1753
80 V A 0.0000
81 S A -0.9766
82 Y A -0.4035
83 F A 0.1279
84 P A -0.5673
85 A A -0.6987
86 E A -1.7573
87 N A 0.0000
88 S A 0.0000
89 Y A 0.0000
90 S A -1.2127
91 R A -1.9592
92 W A -0.9187
93 S A -0.3713
94 G A 0.0000
95 L A 0.0000
96 L A 0.0000
97 S A -0.0929
98 P A 0.0000
99 C A 0.0000
100 D A 0.0000
101 A A 0.0000
102 D A 0.1750
103 W A 0.1949
104 L A 0.4343
105 G A 0.0252
106 M A 0.2652
107 L A 0.0000
108 V A 1.3291
109 V A 0.1735
110 K A -1.4450
111 K A -2.1691
112 A A -2.0935
113 K A -2.5831
114 G A -1.8780
115 S A -1.4305
116 D A 0.0000
117 M A -0.7473
118 I A 0.0000
119 V A 0.0000
120 P A 0.0000
121 G A -0.4302
122 P A 0.0000
123 S A -0.9611
124 Y A 0.0000
125 K A -2.2567
126 G A -1.7762
127 K A -1.4467
128 V A 0.0000
129 F A 0.0000
130 F A 0.0000
131 E A 0.0000
132 R A 0.0000
133 P A 0.0000
134 T A 0.0000
135 F A 0.0000
136 D A -1.5529
137 G A -0.6676
138 Y A 0.0000
139 V A 0.0000
140 G A 0.0000
141 W A 0.0000
142 G A -0.6717
143 C A 0.0000
144 G A -1.5627
145 S A -1.4541
146 G A -1.4239
147 K A -1.5834
148 S A 0.0000
149 R A 0.0000
150 T A -1.8191
151 E A -2.1260
152 S A 0.0000
153 G A 0.0000
154 E A 0.0000
155 L A 0.0000
156 C A -1.1915
157 S A -1.1984
158 S A -1.1136
159 D A -1.3163
160 S A -1.0494
161 G A -1.0569
162 T A 0.0000
163 S A -0.8949
164 S A -0.5013
165 G A -0.7993
166 L A -0.0735
167 L A 0.0000
168 P A -1.3215
169 S A 0.0000
170 D A -2.3495
171 R A -1.6047
172 V A 0.0000
173 L A 0.0000
174 W A 0.0000
175 I A 0.0000
176 G A -0.2108
177 D A 0.0000
178 V A 0.0000
179 A A 0.0000
180 C A 0.0000
181 Q A 0.0000
182 P A -0.3066
183 M A -0.2272
184 T A -0.2803
185 P A -0.6362
186 I A 0.0000
187 P A -1.6533
188 E A -2.5865
189 E A -2.6190
190 T A -2.0000
191 F A -1.2264
192 L A -0.4420
193 E A -1.8326
194 L A 0.0000
195 K A -0.6801
196 S A -0.8975
197 F A -0.5851
198 S A 0.0000
199 Q A -0.6834
200 S A -0.9590
201 E A -0.7161
202 F A 0.0000
203 P A -1.0680
204 D A -1.2338
205 I A 0.0000
206 C A 0.0000
207 K A -0.4205
208 I A 0.0000
209 D A -0.7799
210 G A -0.4358
211 I A 0.4252
212 V A 1.4136
213 F A 0.4431
214 N A -0.5627
215 Q A -1.3046
216 C A -1.9404
217 E A -2.8289
218 S A -2.2653
219 E A -2.4553
220 S A -0.9629
221 L A -0.1592
222 P A -0.6405
223 Q A -0.5614
224 P A -0.6536
225 F A 0.0000
226 D A -1.2630
227 V A 0.0000
228 A A 0.0000
229 W A 0.0000
230 M A 0.0000
231 D A 0.0000
232 V A 0.0000
233 G A -0.8406
234 H A -1.0451
235 S A -1.0920
236 H A -1.2456
237 K A 0.0000
238 I A 0.0000
239 I A 0.0000
240 M A 0.0000
241 R A -0.8175
242 E A -0.7937
243 H A 0.0000
244 K A -0.9089
245 T A 0.0000
246 K A -0.9399
247 W A 0.0000
248 V A -0.6131
249 Q A 0.0000
250 E A -2.1189
251 S A -1.5582
252 S A -1.4697
253 S A -1.5452
254 K A -2.1559
255 D A -1.2620
256 F A 0.0000
257 V A -0.3500
258 C A 0.0000
259 Y A -1.1388
260 K A -2.3770
261 E A -2.9718
262 G A -1.8614
263 T A -1.1845
264 G A -0.7122
265 P A -0.5736
266 C A 0.0000
267 S A -0.6465
268 E A -1.2663
269 S A -1.3619
270 E A -1.7291
271 E A 0.0000
272 K A -2.3623
273 T A -1.3639
274 C A 0.0000
275 K A -1.5122
276 T A -1.0158
277 S A -0.6593
278 G A -0.9398
279 S A -1.0959
280 C A -1.3915
281 R A -1.9034
282 G A -1.4121
283 D A -0.9795
284 M A -0.4371
285 Q A -0.6331
286 F A 0.0000
287 C A -1.3143
288 K A -1.8653
289 V A -1.1290
290 A A -0.9243
291 G A -1.2490
292 C A -1.7450
293 E A -2.8377
294 H A -2.9182
295 G A -2.8180
296 E A -3.6324
297 E A -3.1185
298 A A -1.9853
299 S A -1.7594
300 E A -2.4875
301 A A -2.3062
302 K A -2.7569
303 C A 0.0000
304 R A -2.0689
305 C A 0.0000
306 S A -0.4417
307 L A -0.2669
308 V A -0.1465
309 H A -0.8244
310 K A -0.7278
311 P A -0.3749
312 G A 0.0000
313 E A -0.7142
314 V A 0.0000
315 V A 0.0000
316 V A 0.0000
317 S A -1.3427
318 Y A 0.0000
319 G A -1.1775
320 G A -1.3433
321 M A 0.0000
322 R A -2.1241
323 V A 0.0000
324 R A -0.9100
325 P A 0.0000
326 K A -0.5010
327 C A 0.0000
328 Y A 0.0000
329 G A 0.0000
330 F A 0.0000
331 S A 0.0000
332 R A -0.5326
333 M A 0.0000
334 M A 0.0000
335 A A 0.0000
336 T A 0.0000
337 F A -1.0109
338 E A -2.1483
339 V A -1.3555
340 N A -2.0493
341 P A -1.7259
342 P A -2.0321
343 E A -3.0911
344 Q A -2.5169
345 R A -2.3945
346 I A -0.1463
347 G A -0.7773
348 Q A -1.2463
349 C A -0.0040
350 T A 0.0453
351 G A 0.4342
352 C A 0.0638
353 H A -0.8936
354 L A 0.0000
355 E A -1.0728
356 C A -0.2845
357 I A -0.7241
358 N A -1.2297
359 G A 0.0000
360 G A 0.0000
361 V A 0.0000
362 R A -1.5745
363 L A 0.0000
364 I A -0.7155
365 T A 0.0000
366 L A 1.0219
367 T A 0.3572
368 S A -0.9662
369 E A -2.3331
370 L A 0.0000
371 K A -2.4956
372 S A -1.4058
373 A A 0.0000
374 T A -0.6677
375 V A 0.0000
376 C A -0.3387
377 A A 0.0000
378 S A -0.8034
379 H A -0.4355
380 F A 0.0000
381 C A -0.0370
382 S A 0.0000
383 S A 0.0000
384 A A 0.0000
385 T A -1.2055
386 S A -1.7474
387 G A -2.1012
388 K A -3.2207
389 K A -2.3195
390 S A -1.6659
391 T A 0.0000
392 E A -2.1638
393 I A 0.0000
394 Q A 0.0000
395 F A 0.0000
396 H A 0.0000
397 S A -0.5761
398 G A -0.8038
399 S A 0.0000
400 L A 0.0000
401 V A -1.2545
402 G A -1.7620
403 K A -1.7343
404 T A -0.6083
405 A A -0.7528
406 I A 0.0000
407 H A -1.8212
408 V A 0.0000
409 K A -2.2751
410 G A 0.0000
411 A A -1.7274
412 L A 0.0000
413 V A -1.8829
414 D A -2.4272
415 G A -1.9609
416 T A -1.2806
417 E A -1.5769
418 F A 0.0000
419 T A -1.6059
420 F A 0.0000
421 E A -2.6279
422 G A -1.5705
423 S A -0.8898
424 C A 0.0000
425 M A 0.0320
426 F A 0.0000
427 P A -1.6314
428 D A -2.6047
429 G A -1.8353
430 D A -1.9492
431 D A -1.5690
432 A A -1.1409
433 V A -1.0386
434 D A -1.7511
435 C A -0.3844
436 T A -0.5443
437 F A -0.4746
438 C A 0.0000
439 R A -2.1563
440 E A -1.5471
441 F A 0.0000
442 L A 0.0000
443 K A -0.7657
444 N A -0.3616
445 P A -0.8185
446 Q A -0.0135
447 C A 0.9341
448 Y A 1.3751
449 P A 0.1868
450 A A 0.0000
451 K A -0.5795
452 K A 0.1039
453 W A 1.6200
454 L A 2.0245
455 F A 2.9538
456 I A 2.7644
457 I A 0.0000
458 I A 3.5838
459 V A 3.5708
460 I A 2.7283
461 L A 2.9434
462 L A 2.7981
463 G A 1.7842
464 Y A 2.0880
465 A A 1.7364
466 G A 1.6366
467 L A 2.4241
468 M A 1.6896
469 L A 2.2681
470 L A 2.2971
471 T A 1.1648
472 N A 0.5685
473 V A 2.3488
474 L A 1.9301
475 K A -0.2465
476 A A 0.9289
477 I A 1.9439
478 G A 1.0109
481 G A 0.1175
482 S A 0.6930
483 W A 0.9005
484 V A 0.0000
485 I A -0.3009
486 A A -0.0682
487 P A 0.2384
488 V A 0.0000
489 K A -0.5627
490 L A 1.3052
491 M A 0.9635
492 F A 0.5507
493 A A 0.2306
494 I A 0.5243
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719 I K 0.0000
720 W K 0.0000
721 K K -0.3958
722 V K 0.0000
723 S K 0.0000
724 P K 0.0000
725 C K 0.0000
726 A K -0.2883
727 A K -0.2477
728 W K 0.0000
729 V K -0.1669
730 P K 0.0000
731 S K 0.0000
732 A K 0.0000
733 V K 0.0000
734 I K 0.0000
735 E K -0.6693
736 L K 0.0000
737 T K -0.3618
738 M K 0.0000
739 P K -0.6202
740 S K -0.7205
741 G K -0.6306
742 E K -0.4891
743 V K 0.1839
744 R K -0.7042
745 T K -0.4610
746 F K -0.3420
747 H K 0.0000
748 P K 0.0000
749 M K 0.0000
750 S K -0.2805
751 G K 0.0000
752 I K 0.0000
753 P K 0.0000
754 T K -0.0381
755 Q K -0.2044
756 V K -0.0771
757 F K -0.1344
758 K K -0.4973
759 G K 0.0000
760 V K 0.0000
761 S K 0.0000
762 V K 0.0000
763 T K 0.0863
764 Y K 0.0000
765 L K -0.0892
766 G K -0.3728
767 S K -0.9300
768 D K -1.8977
769 M K -1.1975
770 E K -1.8261
771 V K -0.7734
772 S K -0.7267
773 G K -0.7463
774 L K 0.0000
775 T K -0.7827
776 D K -1.4487
777 L K -0.7765
778 C K 0.0000
779 E K -0.3013
780 I K 0.0000
781 E K 0.0000
782 E K -1.5796
783 L K -1.2627
784 K K -2.3911
785 S K -1.9589
786 K K -2.0677
787 K K -1.9799
788 L K 0.0000
789 A K 0.0000
790 L K 0.0000
791 A K 0.0000
792 P K -0.8907
793 C K 0.0000
794 N K 0.0000
795 Q K -0.8458
796 A K -0.0519
797 G K 0.3020
798 M K 0.8531
799 G K 0.8679
800 V K 2.2274
801 V K 2.1901
802 G K 0.6205
803 K K -0.0951
804 V K 0.0000
805 G K 0.2693
806 E K 0.1613
807 I K 0.0000
808 Q K 0.0000
809 C K 0.0000
810 S K -0.0733
811 S K 0.0000
812 E K 0.0000
813 E K 0.0000
814 S K 0.0000
815 A K 0.0000
816 R K -1.5041
817 T K -1.3404
818 I K 0.0000
819 K K -1.6234
820 K K -1.8243
821 D K -1.1680
822 G K 0.0000
823 C K 0.0000
824 I K 0.3396
825 W K -0.3525
826 N K -0.9426
827 A K -1.1008
828 D K -1.8375
829 L K -0.9849
830 V K 0.0000
831 G K -0.7103
832 I K -0.2038
833 E K -0.2801
834 L K -0.1471
835 R K -0.6453
836 V K 0.0580
837 D K -0.5689
838 D K -0.3909
839 A K 0.0000
840 V K 0.0804
841 C K 0.0000
842 Y K -0.0512
843 S K -0.8165
844 K K -1.7811
845 I K -0.7201
846 T K -0.7327
847 S K -0.5172
848 V K 0.0000
849 E K -1.3888
850 A K -0.6576
851 V K -0.2997
852 A K -0.5013
853 N K -1.2960
854 Y K -0.6875
855 S K -0.4654
856 A K -0.4267
857 I K -0.2428
858 P K -0.3097
859 T K -0.1982
860 T K -0.4242
861 I K -0.3036
862 G K -0.7127
863 G K -0.6074
864 L K 0.0000
865 R K -0.3911
866 F K 0.0000
867 E K -0.4177
868 R K -0.4593
869 S K -0.4912
870 H K -0.8234
871 T K -0.7481
872 S K -0.8534
873 Q K -1.0927
874 G K -1.0343
875 K K -0.8543
876 I K -0.3559
877 S K 0.0000
878 G K 0.0000
879 S K 0.0000
880 P K -0.2903
881 L K -0.0411
882 D K -1.2335
883 I K -0.1668
884 T K 0.0236
885 A K 0.2046
886 I K 1.2852
887 R K -0.4432
888 G K 0.0000
889 S K 0.0000
890 F K 0.0000
891 S K 0.1558
892 V K 0.0000
893 N K 0.0000
894 Y K 0.0000
895 R K -0.5552
896 G K -0.5527
897 L K 0.0000
898 R K -1.1151
899 L K 0.0000
900 S K -0.8627
901 L K -0.5869
902 S K -0.5575
903 E K -0.6906
904 I K 0.9944
905 T K -0.0268
906 A K -0.0151
907 T K -0.4389
908 C K 0.0000
909 T K -1.0518
910 G K 0.0000
911 E K -1.7578
912 V K 0.0000
913 T K -1.4371
914 N K -2.1504
915 V K 0.0000
916 T K -1.3510
917 G K -0.9775
918 C K 0.0000
919 Y K -0.6834
920 S K -0.7061
921 S K -0.1157
922 M K 0.1727
923 T K -0.1117
924 G K -0.1871
925 A K 0.0000
926 K K -0.6637
927 V K 0.0000
928 S K -1.0153
929 I K 0.0000
930 K K -1.3867
931 L K 0.0000
932 H K -0.9715
933 S K 0.0000
934 S K -1.0826
935 K K -1.9879
936 N K -2.3066
937 S K -1.0997
938 T K -0.7199
939 A K 0.0000
940 H K 0.0000
941 V K 0.0000
942 R K -2.6776
943 C K -2.4008
944 K K -2.7713
945 G K -2.0964
946 D K -1.8653
947 E K -1.7271
948 T K 0.0000
949 A K 0.0000
950 F K -0.3586
951 S K -0.3449
952 V K 0.0000
953 L K -0.2276
954 E K -2.0892
955 G K -0.7489
956 V K 0.5760
957 H K -0.6093
958 S K -0.7858
959 Y K 0.0000
960 T K -0.7828
961 V K 0.0000
962 S K -0.6174
963 L K 0.0000
964 S K -1.1385
965 F K 0.0000
966 D K -2.3014
967 H K -2.1095
968 A K 0.0000
969 V K -1.5673
970 V K 0.0000
971 D K -3.2702
972 E K -2.8062
973 Q K -2.9153
974 C K 0.0000
975 Q K -2.3861
976 L K 0.0000
977 N K -1.6999
978 C K 0.0000
979 G K -0.9328
980 G K -1.0904
981 H K -1.4586
982 E K -2.4835
983 S K -1.8947
984 Q K -2.2365
985 V K 0.0000
986 T K -2.1895
987 L K 0.0000
988 K K -3.2434
989 G K -2.2262
990 N K -2.0296
991 L K 0.0000
992 I K 0.0000
993 F K 0.0000
994 L K 0.0000
995 D K 0.0000
996 V K 0.2661
997 P K 0.0000
998 K K -0.3657
999 F K 0.4889
1000 V K 0.1829
1001 D K -1.2785
1002 G K -0.8682
1003 S K 0.0000
1004 Y K 0.6020
1005 M K 0.0000
1006 Q K 0.0426
1007 T K 0.0000
1008 Y K 0.0000
1009 H K 0.0000
1010 S K -0.0300
1011 S K -0.1270
1012 V K 0.2725
1013 P K -0.0384
1014 T K -0.0608
1015 G K -0.3375
1016 A K 0.0932
1017 N K 0.0919
1018 I K 1.5729
1019 P K 0.6514
1020 S K 0.0439
1021 P K 0.4125
1022 T K -0.0641
1023 D K 0.0000
1024 W K 0.1589
1025 L K 0.0000
1026 N K 0.0000
1027 A K -0.0642
1028 L K 0.5539
1029 F K 0.0000
1030 G K -0.2215
1031 N K -0.4982
1032 G K -0.2169
1033 L K 0.9972
1034 S K 0.0920
1035 R K -0.7935
1036 W K 0.5117
1037 I K 1.4513
1038 L K 1.7870
1039 G K 0.9599
1040 V K 1.4689
1041 I K 1.9621
1042 G K 1.2001
1043 V K 1.2991
1044 L K 1.6834
1045 L K 1.9187
1046 G K 0.7754
1047 G K 0.0000
1048 L K 1.7393
1049 A K 1.7072
1050 L K 1.9104
1051 F K 0.0000
1052 F K 3.3954
1053 L K 3.2473
1054 I K 2.7477
1055 M K 2.3964
1056 S K 2.2046
1057 L K 2.9301
1058 F K 2.4378
1059 K K -0.0297
1060 L K 1.4583
1061 G K 0.9674
1062 T K 0.3813
1063 K K -0.9389
1064 Q K -0.8610
1065 V K 0.8583
1066 F K 0.6041
1067 R K -1.7590
1068 S K -1.5083
1069 R K -1.7550
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Laboratory of Theory of Biopolymers 2018