Project name: 115-3Ms-T1

Status: done

Started: 2025-12-11 09:34:40
Settings
Chain sequence(s) A: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAIGGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
C: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
E: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
G: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
I: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
K: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGDDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
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                                        (00:02:07)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (03:05:31)
[INFO]       Main:     Simulation completed successfully.                                          (03:16:16)
Show buried residues

Minimal score value
-3.415
Maximal score value
3.7349
Average score
-0.4446
Total score value
-2682.3576

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 -0.9366
22 G A -0.6162
23 P A -0.2009
24 I A -0.0163
25 I A -0.1697
26 C A -0.3428
27 A A -0.6049
28 G A 0.0000
29 P A 0.1780
30 I A 0.9726
31 H A -0.0455
32 S A -0.5629
33 N A -1.7694
34 K A -1.7989
35 S A -1.4310
36 A A -1.4149
37 N A -1.6774
38 I A -0.6344
39 P A -0.6402
40 H A -0.6924
41 L A 0.4005
42 L A 1.2530
43 G A 0.0904
44 Y A 0.1869
45 S A 0.0000
46 E A 0.0000
47 K A 0.0967
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 -0.6639
54 L A 0.0000
55 I A 0.0000
56 H A 0.0000
57 V A 0.0000
58 S A 0.0000
59 S A -0.7066
60 W A 0.0000
61 L A 0.0000
62 R A -1.8711
63 N A -2.0615
64 H A -1.7592
65 S A -1.4867
66 Q A -1.9889
67 F A 0.0000
68 Q A -1.6926
69 G A 0.0000
70 Y A 0.0000
71 V A 0.0000
72 G A 0.0000
73 Q A 0.0000
74 R A -1.7062
75 G A -1.7752
76 G A 0.0000
77 R A -1.0850
78 S A -1.3257
79 Q A -2.0915
80 V A 0.0000
81 S A -1.0712
82 Y A -0.5855
83 F A -0.3285
84 P A -0.7098
85 A A -0.7187
86 E A -1.6787
87 N A -1.2424
88 S A 0.0000
89 Y A 0.0000
90 S A -1.1020
91 R A -1.5875
92 W A -0.9013
93 S A -0.6654
94 G A 0.0000
95 L A -0.2469
96 L A 0.2449
97 S A 0.0380
98 P A 0.0000
99 C A 0.0000
100 D A 0.0000
101 A A 0.0000
102 D A 0.1455
103 W A 0.1348
104 L A 0.4265
105 G A -0.0053
106 M A 0.3394
107 L A 0.0000
108 V A 1.1894
109 V A -0.1617
110 K A -2.0835
111 K A -2.3912
112 A A -2.1754
113 K A -2.8936
114 G A -2.0991
115 S A -1.6575
116 D A -1.5591
117 M A 0.0000
118 I A 0.0000
119 V A 0.0000
120 P A -0.3885
121 G A -0.6065
122 P A -0.7192
123 S A -1.2456
124 Y A 0.0000
125 K A -2.3959
126 G A -1.8169
127 K A -1.4783
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 -1.5554
137 G A -0.7881
138 Y A 0.0000
139 V A 0.0000
140 G A 0.0000
141 W A 0.0000
142 G A -0.6581
143 C A 0.0000
144 G A -1.2589
145 S A -1.1438
146 G A -1.0522
147 K A -1.3525
148 S A 0.0000
149 R A 0.0000
150 T A -1.5603
151 E A -2.0923
152 S A 0.0000
153 G A 0.0000
154 E A 0.0000
155 L A 0.0000
156 C A -1.2370
157 S A -0.9729
158 S A -0.9524
159 D A -1.1438
160 S A -0.9044
161 G A -0.7344
162 T A 0.0000
163 S A -0.7356
164 S A -0.3699
165 G A 0.0000
166 L A 0.1021
167 L A 0.0000
168 P A -1.0565
169 S A 0.0000
170 D A -2.3479
171 R A -1.6585
172 V A 0.0000
173 L A 0.0000
174 W A 0.0000
175 I A 0.0000
176 G A -0.2823
177 D A 0.0000
178 V A 0.0000
179 A A 0.0000
180 C A 0.0270
181 Q A 0.0000
182 P A -0.2623
183 M A -0.1272
184 T A -0.2283
185 P A -0.5816
186 I A -1.1335
187 P A -1.5214
188 E A -2.6992
189 E A -2.7427
190 T A -1.9831
191 F A 0.0000
192 L A -0.5945
193 E A -1.9440
194 L A 0.0000
195 K A -0.5506
196 S A -0.5489
197 F A -0.5163
198 S A 0.0000
199 Q A -0.4533
200 S A -0.6324
201 E A -0.5697
202 F A 0.0000
203 P A -0.7367
204 D A -0.7978
205 I A 0.0000
206 C A 0.0000
207 K A -0.2720
208 I A 0.0000
209 D A -1.0123
210 G A -0.5691
211 I A 0.3700
212 V A 1.3922
213 F A 0.5378
214 N A -0.4922
215 Q A -1.1683
216 C A -1.5599
217 E A -2.5013
218 S A -1.6746
219 E A -1.5330
220 S A -0.5330
221 L A -0.0401
222 P A -0.5597
223 Q A -0.6357
224 P A 0.0000
225 F A 0.0000
226 D A -1.1065
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 -0.8914
234 H A -0.9006
235 S A -0.8724
236 H A -0.9151
237 K A 0.0000
238 I A 0.0000
239 I A 0.0000
240 M A 0.0000
241 R A 0.0000
242 E A -0.5894
243 H A 0.0000
244 K A -1.0874
245 T A -0.8414
246 K A -0.7704
247 W A -0.3187
248 V A -0.1721
249 Q A -0.9702
250 E A -1.8785
251 S A -1.3579
252 S A -1.1947
253 S A -1.3159
254 K A -1.8451
255 D A -1.3945
256 F A 0.0000
257 V A 0.0000
258 C A 0.0000
259 Y A 0.0000
260 K A -2.0467
261 E A -2.6029
262 G A -1.7303
263 T A -1.2840
264 G A 0.0000
265 P A -0.6970
266 C A 0.0000
267 S A -0.8645
268 E A -1.3808
269 S A -1.6808
270 E A -2.1999
271 E A 0.0000
272 K A -2.5486
273 T A -1.6545
274 C A 0.0000
275 K A -1.4236
276 T A -1.0346
277 S A -0.7104
278 G A -0.8598
279 S A -1.0261
280 C A -1.2437
281 R A -1.3761
282 G A -1.0257
283 D A -0.6279
284 M A -0.4314
285 Q A -0.7971
286 F A 0.0000
287 C A -1.1403
288 K A -1.4442
289 V A -0.5041
290 A A -0.5068
291 G A -1.0577
292 C A -1.5037
293 E A -2.3595
294 H A -2.3987
295 G A -2.3071
296 E A -2.7140
297 E A -2.0455
298 A A -1.5983
299 S A -1.5651
300 E A -2.4343
301 A A -2.0590
302 K A -2.3045
303 C A 0.0000
304 R A -1.5290
305 C A 0.0000
306 S A -0.4223
307 L A -0.5061
308 V A 0.0000
309 H A -1.1239
310 K A -0.7724
311 P A 0.0000
312 G A 0.0000
313 E A -0.6057
314 V A 0.0000
315 V A -0.6039
316 V A 0.0000
317 S A -1.2384
318 Y A 0.0000
319 G A -1.1334
320 G A -1.2122
321 M A -1.4125
322 R A -2.0202
323 V A 0.0000
324 R A -0.7863
325 P A 0.0000
326 K A -0.3507
327 C A 0.0000
328 Y A 0.0000
329 G A 0.0000
330 F A -0.3026
331 S A 0.0000
332 R A -0.5900
333 M A 0.0000
334 M A 0.0000
335 A A 0.0000
336 T A 0.0000
337 L A -0.5268
338 E A -1.6687
339 V A -0.8079
340 N A -1.8528
341 P A -1.7349
342 P A -2.0226
343 E A -3.0610
344 Q A -2.5630
345 R A -2.2245
346 I A -0.3151
347 G A -0.7652
348 Q A -0.9965
349 C A 0.1823
350 T A 0.3001
351 G A 0.5217
352 C A 0.4647
353 H A -0.4755
354 L A -0.7154
355 E A -0.6644
356 C A -0.0937
357 I A -0.5344
358 N A -1.2503
359 G A -1.0431
360 G A 0.0000
361 V A 0.0000
362 R A -1.3421
363 L A 0.0000
364 I A -0.5078
365 T A 0.0000
366 L A 1.1307
367 T A 0.3962
368 S A -1.0110
369 E A -2.3704
370 L A 0.0000
371 K A -2.7054
372 S A -1.3820
373 A A 0.0000
374 T A -0.3313
375 V A 0.0000
376 C A -0.3811
377 A A 0.0000
378 S A -0.4837
379 H A -0.4038
380 F A 0.0000
381 C A -0.1919
382 S A 0.0000
383 S A -0.4275
384 A A -0.8655
385 T A -1.4783
386 S A -1.6850
387 G A -2.1044
388 K A -2.9257
389 K A -1.9533
390 S A -1.3805
391 T A 0.0000
392 E A -1.8528
393 I A 0.0000
394 Q A -1.1303
395 F A 0.0000
396 H A 0.0000
397 S A -0.6392
398 G A -0.8109
399 S A -0.2304
400 L A 0.0000
401 V A -0.9569
402 G A -1.4719
403 K A -1.5371
404 T A -0.7167
405 A A -0.8544
406 I A 0.0000
407 H A -1.4141
408 V A 0.0000
409 K A -1.1514
410 G A 0.0000
411 A A 0.0000
412 L A 0.0000
413 V A -1.8611
414 D A -2.0838
415 G A -1.5940
416 T A -1.0105
417 E A -1.1919
418 F A 0.0000
419 T A -0.7901
420 F A -0.9085
421 E A -2.1750
422 G A -1.4251
423 S A -0.9243
424 C A 0.0000
425 M A -0.0786
426 F A 0.0000
427 P A -1.6243
428 D A -2.2112
429 G A -1.3974
430 D A -1.5651
431 D A -1.1600
432 A A -0.7763
433 V A -0.7443
434 D A -1.2357
435 C A -0.0446
436 T A 0.2670
437 F A 1.2719
438 C A 0.0000
439 R A -1.7680
440 E A -1.0814
441 F A -0.0795
442 L A -0.2177
443 K A 0.0000
444 N A 0.0000
445 P A -0.4442
446 Q A 0.2575
447 C A 0.7232
448 Y A 1.4246
449 P A 0.3865
450 A A 0.4212
451 K A -0.0274
452 K A 0.8235
453 W A 1.7825
454 L A 2.1825
455 F A 2.7478
456 I A 0.0000
457 I A 0.0000
458 I A 3.1889
459 V A 3.2077
460 I A 2.3239
461 L A 2.6015
462 L A 2.6730
463 G A 1.6434
464 Y A 1.9920
465 A A 2.0358
466 G A 1.9392
467 L A 2.9318
468 M A 2.5544
469 L A 3.0736
470 L A 3.2644
471 T A 1.8314
472 N A 1.2823
473 V A 2.9466
474 L A 2.1531
475 K A 0.0220
476 A A 1.0289
477 I A 2.1078
478 G A 1.2031
481 G A 1.1782
482 S A 1.1140
483 W A 1.9235
484 V A 1.4526
485 I A 1.1783
486 A A 0.9843
487 P A 0.4416
488 V A 0.0000
489 K A -0.4119
490 L A 1.1176
491 M A 0.0000
492 F A 0.7480
493 A A 0.1362
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727 A K -0.4184
728 W K 0.0000
729 V K -0.4503
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 -0.8733
736 L K 0.0000
737 T K -0.3705
738 M K 0.0000
739 P K 0.0000
740 S K -0.7842
741 G K -0.5633
742 E K -0.2931
743 V K 0.3152
744 R K -0.7670
745 T K -0.6273
746 F K -0.4539
747 H K -0.5979
748 P K 0.0000
749 M K -0.1634
750 S K -0.3361
751 G K -0.4882
752 I K 0.0000
753 P K -0.0999
754 T K -0.0244
755 Q K -0.1938
756 V K 0.0543
757 F K 0.0117
758 K K -0.5796
759 G K 0.0000
760 V K 0.0000
761 S K 0.0000
762 V K 0.0000
763 T K 0.0000
764 Y K 0.0000
765 L K -0.0828
766 G K 0.0000
767 S K -0.6423
768 D K -1.8479
769 M K -1.4127
770 E K -2.0279
771 V K -1.0522
772 S K -0.8343
773 G K -0.8798
774 L K 0.0000
775 T K -1.0693
776 D K -2.1162
777 L K 0.0000
778 C K 0.0000
779 E K -0.3704
780 I K 0.0000
781 E K -0.9447
782 E K 0.0000
783 L K -0.6363
784 K K -1.4669
785 S K -1.4520
786 K K -1.6725
787 K K -1.4588
788 L K -0.6783
789 A K 0.0000
790 L K 0.0000
791 A K 0.0000
792 P K -1.2076
793 C K 0.0000
794 N K 0.0000
795 Q K -0.6546
796 A K 0.1586
797 G K 0.4498
798 M K 0.9430
799 G K 1.0771
800 V K 2.2329
801 V K 2.3082
802 G K 0.5547
803 K K -0.4503
804 V K 0.0000
805 G K -0.2188
806 E K 0.0309
807 I K 0.0000
808 Q K 0.0000
809 C K 0.0000
810 S K -0.2139
811 S K 0.0000
812 E K -1.0959
813 E K -1.1502
814 S K -0.8024
815 A K 0.0000
816 R K -1.9515
817 T K -1.5583
818 I K 0.0000
819 K K 0.0000
820 K K -1.9459
821 D K -1.2549
822 G K -0.6237
823 C K 0.0000
824 I K 0.1049
825 W K -0.3566
826 N K -0.7332
827 A K -0.8751
828 D K -2.1339
829 L K -1.5049
830 V K 0.0000
831 G K -0.8217
832 I K -0.2194
833 E K -0.6035
834 L K 0.0210
835 R K -0.0292
836 V K 0.9915
837 D K -0.0841
838 D K -0.1382
839 A K 0.0000
840 V K -0.0764
841 C K -0.1666
842 Y K -0.4238
843 S K -1.2408
844 K K -2.1419
845 I K 0.0000
846 T K -0.7675
847 S K -0.7385
848 V K 0.0000
849 E K -1.8518
850 A K -0.7046
851 V K -0.4806
852 A K -0.6097
853 N K -1.5264
854 Y K -0.6802
855 S K -0.3348
856 A K -0.1666
857 I K -0.1049
858 P K -0.1582
859 T K -0.1275
860 T K -0.2263
861 I K -0.1543
862 G K -0.6614
863 G K -0.4301
864 L K 0.0000
865 R K -0.0287
866 F K 0.0000
867 E K -0.1839
868 R K 0.0000
869 S K 0.0000
870 H K 0.0000
871 D K -0.8191
872 S K -0.9732
873 Q K -1.6152
874 G K -1.0993
875 K K -0.8801
876 I K 0.0000
877 S K 0.0000
878 G K 0.0000
879 S K 0.0000
880 P K 0.0000
881 L K 1.2267
882 D K -0.0276
883 I K 0.8277
884 T K 0.4587
885 A K 0.6065
886 I K 1.5177
887 R K -0.0272
888 G K 0.0000
889 S K 0.0000
890 F K 0.0000
891 S K 0.3633
892 V K 0.0000
893 N K -0.5007
894 Y K 0.0000
895 R K -0.8476
896 G K -0.5301
897 L K 0.0000
898 R K -1.3194
899 L K 0.0000
900 S K -0.8171
901 L K -0.3982
902 S K -0.1629
903 E K -0.0851
904 I K 1.3686
905 T K 0.0997
906 A K -0.5086
907 T K -0.3555
908 C K 0.0000
909 T K -1.0888
910 G K -1.5463
911 E K -1.9244
912 V K 0.0000
913 T K -1.9822
914 N K -2.3858
915 V K 0.0000
916 T K -1.2540
917 G K -1.0630
918 C K 0.0000
919 Y K -0.7081
920 S K -0.8515
921 S K -0.2405
922 M K 0.0367
923 T K -0.3072
924 G K -0.3643
925 A K 0.0000
926 K K -1.6095
927 V K 0.0000
928 S K -1.2654
929 I K 0.0000
930 K K -2.1337
931 L K 0.0000
932 H K -1.1837
933 S K 0.0000
934 S K -1.2022
935 K K -1.6582
936 N K -1.8331
937 S K -0.8538
938 T K -0.6757
939 A K 0.0000
940 H K 0.0000
941 V K 0.0000
942 R K -2.6074
943 C K -2.3724
944 K K -2.9136
945 G K -2.0405
946 D K -1.7808
947 E K 0.0000
948 T K 0.0000
949 A K 0.0000
950 F K -0.3473
951 S K -0.3002
952 V K 0.0000
953 L K -0.1960
954 E K -1.9439
955 G K -0.6885
956 V K 0.3680
957 H K -0.8251
958 S K -0.9063
959 Y K -0.7986
960 T K -1.0837
961 V K 0.0000
962 S K -1.0631
963 L K 0.0000
964 S K -1.1856
965 F K 0.0000
966 D K -2.3768
967 H K -1.8700
968 A K 0.0000
969 V K -0.7192
970 V K 0.0000
971 D K -3.0292
972 E K -2.6149
973 Q K -2.8979
974 C K 0.0000
975 Q K -2.5053
976 L K 0.0000
977 N K -1.9501
978 C K 0.0000
979 G K -0.8267
980 G K -1.0282
981 H K -1.7925
982 E K -2.7595
983 S K -1.9930
984 Q K -2.2154
985 V K 0.0000
986 T K -2.0175
987 L K 0.0000
988 K K -3.1224
989 G K -1.9875
990 N K -1.7411
991 L K 0.0000
992 I K 0.0000
993 F K 0.0000
994 L K -0.2841
995 D K -0.3694
996 V K -0.0962
997 P K 0.0000
998 K K -1.5134
999 F K -0.4536
1000 V K -0.8455
1001 D K -1.8740
1002 G K -1.1842
1003 S K -0.3001
1004 Y K 0.6303
1005 M K 0.0000
1006 Q K 0.0000
1007 T K 0.0000
1008 Y K 0.0000
1009 H K 0.0000
1010 S K 0.0000
1011 S K 0.1330
1012 V K -0.0679
1013 P K -0.5136
1014 T K -0.4582
1015 G K -0.6348
1016 A K -0.2420
1017 N K -0.4617
1018 I K 1.2510
1019 P K 0.4448
1020 S K -0.1929
1021 P K -0.0931
1022 T K -0.3634
1023 D K 0.0000
1024 W K 0.0666
1025 L K 0.0000
1026 N K 0.0000
1027 A K -0.4450
1028 L K -0.0261
1029 F K 0.0000
1030 G K -0.7352
1031 N K -1.1547
1032 G K -0.3069
1033 L K 1.1181
1034 S K 0.3601
1035 R K -0.6610
1036 W K 0.5094
1037 I K 2.4236
1038 L K 2.1112
1039 G K 0.8482
1040 V K 1.6459
1041 I K 2.2603
1042 G K 1.3469
1043 V K 0.0000
1044 L K 1.7602
1045 L K 1.9303
1046 G K 0.8982
1047 G K 0.0000
1048 L K 1.7842
1049 A K 1.8123
1050 L K 2.1101
1051 F K 0.0000
1052 F K 3.3526
1053 L K 3.2209
1054 I K 2.7208
1055 M K 2.3312
1056 S K 2.2345
1057 L K 2.8874
1058 F K 2.4006
1059 K K 0.0775
1060 L K 1.4330
1061 G K 0.8923
1062 T K 0.2683
1063 K K -1.2359
1064 Q K -1.0871
1065 V K 0.7524
1066 F K 0.5779
1067 R K -1.9299
1068 S K -1.6799
1069 R K -1.9572
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Laboratory of Theory of Biopolymers 2018