Project name: 115-3Ms-T2

Status: done

Started: 2025-12-11 09:39:18
Settings
Chain sequence(s) A: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAIGGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
C: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
E: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
G: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
I: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
K: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATFEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:02:36)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (03:12:58)
[INFO]       Main:     Simulation completed successfully.                                          (03:22:51)
Show buried residues

Minimal score value
-3.6776
Maximal score value
3.7852
Average score
-0.4345
Total score value
-2621.5256

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 -0.9632
22 G A -0.7221
23 P A -0.1836
24 I A 0.7977
25 I A 0.8127
26 C A 0.4461
27 A A -0.3825
28 G A -0.9453
29 P A 0.0000
30 I A 0.1105
31 H A -0.6226
32 S A -0.8025
33 N A -1.8237
34 K A -1.7536
35 S A -1.4390
36 A A -1.2789
37 N A -1.5343
38 I A -0.5808
39 P A -0.7790
40 H A -0.7195
41 L A 0.3295
42 L A 1.0226
43 G A 0.0000
44 Y A 0.2735
45 S A 0.0000
46 E A 0.0674
47 K A -0.0524
48 I A 0.0000
49 C A 0.2331
50 Q A 0.0000
51 I A 0.0000
52 D A 0.0000
53 R A -0.6004
54 L A 0.0000
55 I A -0.1745
56 H A -0.1733
57 V A 0.0000
58 S A 0.0000
59 S A -0.8179
60 W A 0.0000
61 L A 0.0000
62 R A -2.0367
63 N A -2.2681
64 H A -1.9599
65 S A -1.6855
66 Q A -2.2508
67 F A 0.0000
68 Q A -2.0074
69 G A 0.0000
70 Y A 0.0000
71 V A 0.0000
72 G A 0.0000
73 Q A -1.1395
74 R A -1.8309
75 G A 0.0000
76 G A 0.0000
77 R A -0.9802
78 S A -1.1397
79 Q A -2.2067
80 V A 0.0000
81 S A -1.0726
82 Y A -0.4537
83 F A -0.2897
84 P A -0.7680
85 A A -0.8295
86 E A -1.9095
87 N A -1.3932
88 S A -1.1312
89 Y A 0.0000
90 S A -1.3055
91 R A -1.8235
92 W A -0.9288
93 S A -0.4229
94 G A -0.3996
95 L A 0.0000
96 L A 0.0000
97 S A -0.1249
98 P A 0.0000
99 C A 0.0000
100 D A 0.0000
101 A A 0.0000
102 D A 0.2564
103 W A 0.0000
104 L A 0.2107
105 G A 0.1408
106 M A 0.3587
107 L A 0.6767
108 V A 1.1998
109 V A -0.1958
110 K A -2.1979
111 K A -2.7685
112 A A -2.1913
113 K A -2.8396
114 G A -1.9163
115 S A -1.4373
116 D A 0.0000
117 M A 0.0000
118 I A 0.0000
119 V A 0.0000
120 P A 0.0000
121 G A -0.5472
122 P A 0.0000
123 S A -0.9227
124 Y A 0.0000
125 K A -2.1559
126 G A -1.7628
127 K A -1.4952
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 -2.1318
137 G A -1.2124
138 Y A -0.6642
139 V A 0.0000
140 G A 0.0000
141 W A 0.0000
142 G A -0.6387
143 C A 0.0000
144 G A -1.4540
145 S A -1.3235
146 G A -1.1949
147 K A -1.4989
148 S A 0.0000
149 R A -1.2191
150 T A -1.6149
151 E A -1.8434
152 S A -1.2560
153 G A 0.0000
154 E A 0.0000
155 L A -1.0474
156 C A -0.8013
157 S A -1.0872
158 S A -1.0135
159 D A -1.2246
160 S A -0.9731
161 G A -0.8380
162 T A 0.0000
163 S A -0.9629
164 S A -0.5824
165 G A 0.0000
166 L A -0.2887
167 L A 0.0000
168 P A -1.3131
169 S A 0.0000
170 D A -2.4437
171 R A -1.7537
172 V A 0.0000
173 L A 0.0000
174 W A 0.0000
175 I A 0.0000
176 G A -0.2590
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 -0.3346
183 M A -0.4065
184 T A -0.4354
185 P A -0.8895
186 I A 0.0000
187 P A -1.6123
188 E A -2.7534
189 E A -2.8294
190 T A -2.0891
191 F A 0.0000
192 L A -0.7991
193 E A -1.9842
194 L A 0.0000
195 K A -0.6453
196 S A -0.5144
197 F A -0.3557
198 S A 0.0000
199 Q A -0.2972
200 S A -0.5010
201 E A -0.3940
202 F A -0.0623
203 P A -0.4959
204 D A -0.4916
205 I A 0.0000
206 C A 0.0000
207 K A -0.2316
208 I A 0.0000
209 D A -0.7105
210 G A -0.3704
211 I A 0.4768
212 V A 1.5207
213 F A 0.0000
214 N A 0.0000
215 Q A -0.8562
216 C A -1.1956
217 E A -2.2572
218 S A -1.7853
219 E A -2.2370
220 S A -0.9657
221 L A -0.3544
222 P A -0.7820
223 Q A -0.5746
224 P A -0.5716
225 F A 0.0000
226 D A -1.1344
227 V A 0.0000
228 A A 0.0000
229 W A 0.0000
230 M A 0.0000
231 D A -1.0838
232 V A 0.0000
233 G A -0.9182
234 H A -1.2186
235 S A -1.2571
236 H A -1.1255
237 K A 0.0000
238 I A 0.0000
239 I A 0.0000
240 M A 0.0000
241 R A -0.6410
242 E A -0.7722
243 H A 0.0000
244 K A -1.0548
245 T A 0.0000
246 K A -0.7084
247 W A 0.0000
248 V A -0.5112
249 Q A -1.2376
250 E A -2.1772
251 S A -1.3770
252 S A -1.4437
253 S A -1.4534
254 K A -2.2286
255 D A -1.3713
256 F A 0.0000
257 V A -0.1569
258 C A 0.0000
259 Y A -0.6485
260 K A -1.8556
261 E A -2.4168
262 G A -1.8074
263 T A -1.3303
264 G A -0.6762
265 P A -0.5000
266 C A 0.0000
267 S A -0.5353
268 E A -1.1608
269 S A -1.2245
270 E A -1.5538
271 E A 0.0000
272 K A -2.3691
273 T A -1.3766
274 C A 0.0000
275 K A -1.3071
276 T A -1.0031
277 S A -0.6536
278 G A -0.8086
279 S A -1.0881
280 C A -1.1940
281 R A -1.4920
282 G A -0.8214
283 D A -0.5233
284 M A -0.2073
285 Q A -0.3520
286 F A 0.0000
287 C A -0.9370
288 K A -1.2190
289 V A -0.7038
290 A A -0.6479
291 G A -0.9180
292 C A -1.5276
293 E A -2.8730
294 H A -3.0411
295 G A -2.8738
296 E A -3.6776
297 E A -3.1325
298 A A -1.9575
299 S A -1.6860
300 E A -2.2231
301 A A -2.0079
302 K A -2.1305
303 C A 0.0000
304 R A -1.2184
305 C A 0.0000
306 S A -0.1678
307 L A -0.2495
308 V A 0.0000
309 H A -0.7920
310 K A -0.7065
311 P A 0.0000
312 G A 0.0000
313 E A -0.6532
314 V A 0.0000
315 V A 0.0000
316 V A 0.0000
317 S A -1.2708
318 Y A 0.0000
319 G A -1.0554
320 G A -1.1709
321 M A -1.3636
322 R A -2.1184
323 V A 0.0000
324 R A -1.1370
325 P A 0.0000
326 K A -0.6602
327 C A 0.0000
328 Y A 0.0000
329 G A 0.0000
330 F A -0.3007
331 S A 0.0000
332 R A -0.6224
333 M A 0.0000
334 M A 0.0000
335 A A 0.0000
336 T A -0.4503
337 F A -0.5399
338 E A -1.3237
339 V A -0.8146
340 N A -1.8135
341 P A -1.7229
342 P A -2.0043
343 E A -3.0706
344 Q A -2.5534
345 R A -2.2246
346 I A -0.4129
347 G A -0.8451
348 Q A -1.2092
349 C A -0.0750
350 T A 0.1930
351 G A 0.3273
352 C A 0.2497
353 H A -1.0513
354 L A -1.4261
355 E A -1.8601
356 C A -0.7090
357 I A -0.8274
358 N A -1.0666
359 G A 0.0000
360 G A 0.0000
361 V A 0.0000
362 R A -1.8298
363 L A 0.0000
364 I A -0.7381
365 T A 0.0000
366 L A 1.1378
367 T A 0.4246
368 S A -0.9035
369 E A -2.0109
370 L A 0.0000
371 K A -2.6358
372 S A -1.3727
373 A A 0.0000
374 T A 0.0000
375 V A 0.0000
376 C A -0.5933
377 A A 0.0000
378 S A -0.4545
379 H A 0.0000
380 F A 0.0000
381 C A 0.0000
382 S A 0.0000
383 S A -0.2439
384 A A -0.5703
385 T A -1.2618
386 S A -1.5333
387 G A -1.9057
388 K A -2.7331
389 K A -1.8141
390 S A -1.3714
391 T A 0.0000
392 E A -1.4919
393 I A 0.0000
394 Q A -0.6978
395 F A 0.0000
396 H A 0.0000
397 S A -0.8812
398 G A -0.4028
399 S A 0.0000
400 L A 0.0000
401 V A -0.7056
402 G A -1.3860
403 K A -1.7178
404 T A -0.5867
405 A A -0.7836
406 I A 0.0000
407 H A -1.8672
408 V A 0.0000
409 K A -1.8755
410 G A 0.0000
411 A A -1.6603
412 L A 0.0000
413 V A -2.1937
414 D A -2.5033
415 G A -1.9338
416 T A -1.2402
417 E A -1.7941
418 F A 0.0000
419 T A -1.3138
420 F A -1.2776
421 E A -2.3783
422 G A -1.5482
423 S A -1.0171
424 C A 0.0000
425 M A -0.0674
426 F A 0.0000
427 P A -1.2791
428 D A -2.1208
429 G A -1.0691
430 C A -0.5470
431 D A 0.0000
432 A A -0.5537
433 V A -0.8891
434 D A -1.8094
435 C A -0.4236
436 T A -0.5621
437 F A -0.1966
438 C A 0.0000
439 R A -2.0020
440 E A -1.1933
441 F A 0.0000
442 L A 0.0000
443 K A 0.0000
444 N A -0.7726
445 P A -0.7576
446 Q A -0.8562
447 C A 0.0623
448 Y A 0.9630
449 P A -0.0610
450 A A 0.0878
451 K A -0.1124
452 K A 0.4621
453 W A 1.4604
454 L A 2.0144
455 F A 2.5463
456 I A 2.3729
457 I A 0.0000
458 I A 3.0554
459 V A 3.0002
460 I A 2.6612
461 L A 2.4411
462 L A 2.6914
463 G A 1.7941
464 Y A 2.1519
465 A A 2.1922
466 G A 2.0222
467 L A 2.8954
468 M A 2.5729
469 L A 2.9738
470 L A 2.9710
471 T A 1.7936
472 N A 1.3904
473 V A 2.8809
474 L A 2.1158
475 K A 0.0680
476 A A 1.0375
477 I A 1.8291
478 G A 1.1213
481 G A 0.9964
482 S A 0.9373
483 W A 1.2319
484 V A 0.5657
485 I A 0.7997
486 A A 0.5405
487 P A 0.7017
488 V A 0.0000
489 K A -0.2177
490 L A 1.3186
491 M A 1.2257
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724 P K 0.0000
725 C K 0.0000
726 A K -0.4197
727 A K -0.5216
728 W K 0.0000
729 V K -0.5699
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 -0.9591
736 L K 0.0000
737 T K -0.9582
738 M K 0.0000
739 P K 0.0000
740 S K -0.8534
741 G K -1.0555
742 E K -1.6320
743 V K -1.0618
744 R K -1.8668
745 T K -1.0233
746 F K 0.0000
747 H K -0.6059
748 P K 0.0000
749 M K -0.0372
750 S K -0.3595
751 G K -0.4494
752 I K 0.0000
753 P K -0.1849
754 T K -0.1710
755 Q K -0.3161
756 V K 0.0565
757 F K -0.2954
758 K K -0.5643
759 G K 0.0000
760 V K 0.0000
761 S K 0.0000
762 V K 0.0000
763 T K 0.0315
764 Y K 0.0000
765 L K 0.0354
766 G K -0.5782
767 S K -1.0011
768 D K -2.2345
769 M K -1.3650
770 E K -1.9740
771 V K -0.8866
772 S K -0.6658
773 G K -0.7026
774 L K 0.0000
775 T K -0.9936
776 D K -1.9731
777 L K -0.9514
778 C K 0.0000
779 E K -0.2305
780 I K 0.0000
781 E K 0.0000
782 E K 0.0000
783 L K -1.1283
784 K K -2.3285
785 S K -2.0672
786 K K -2.4193
787 K K -2.2946
788 L K 0.0000
789 A K 0.0000
790 L K 0.0000
791 A K 0.0000
792 P K 0.0000
793 C K -0.5380
794 N K 0.0000
795 Q K -0.9542
796 A K -0.1305
797 G K 0.3603
798 M K 0.8570
799 G K 0.9858
800 V K 2.2053
801 V K 2.1736
802 G K 0.6167
803 K K -0.3201
804 V K 0.0000
805 G K 0.0000
806 E K -0.5876
807 I K 0.0000
808 Q K 0.0000
809 C K 0.0000
810 S K -0.3075
811 S K 0.0000
812 E K -0.7005
813 E K 0.0000
814 S K -0.6695
815 A K 0.0000
816 R K -2.0043
817 T K -1.6249
818 I K 0.0000
819 K K -1.8172
820 K K -1.7760
821 D K -1.7541
822 G K 0.0000
823 C K 0.0000
824 I K 0.0924
825 W K -0.0943
826 N K -0.5962
827 A K -0.8193
828 D K -2.2009
829 L K 0.0000
830 V K 0.0000
831 G K 0.0000
832 I K 0.0639
833 E K 0.2430
834 L K 0.3129
835 R K -0.4518
836 V K 0.0340
837 D K -0.4725
838 D K -0.1083
839 A K 0.0000
840 V K 0.2631
841 C K 0.0000
842 Y K -0.1466
843 S K -1.1347
844 K K -2.2328
845 I K 0.0000
846 T K -0.8462
847 S K -0.9714
848 V K 0.0000
849 E K -1.4288
850 A K -0.5979
851 V K -0.3267
852 A K -0.5061
853 N K -1.4503
854 Y K -0.6139
855 S K -0.3418
856 A K -0.1688
857 I K -0.2812
858 P K -0.2903
859 T K -0.1273
860 T K -0.3191
861 I K -0.1501
862 G K -0.6025
863 G K -0.6988
864 L K 0.0000
865 R K -0.2620
866 F K 0.0000
867 E K -0.3323
868 R K -0.5393
869 S K 0.0000
870 H K -0.9208
871 D K -0.9773
872 S K -1.0240
873 Q K -1.5399
874 G K -1.0662
875 K K -0.8146
876 I K 0.0000
877 S K 0.0000
878 G K 0.0000
879 S K 0.0000
880 P K -0.2495
881 L K 0.1077
882 D K -1.2557
883 I K -0.1105
884 T K 0.0419
885 A K 0.2134
886 I K 1.3475
887 R K -0.6441
888 G K 0.0000
889 S K 0.0000
890 F K 0.0000
891 S K 0.1854
892 V K 0.0000
893 N K -0.4535
894 Y K -0.4141
895 R K -0.5676
896 G K 0.0000
897 L K 0.0000
898 R K -0.5065
899 L K 0.0000
900 S K -0.6696
901 L K -0.5081
902 S K -0.5664
903 E K -0.9148
904 I K 1.0102
905 T K -0.1215
906 A K -0.1728
907 T K -0.5961
908 C K 0.0000
909 T K -1.4931
910 G K -2.0379
911 E K -2.8130
912 V K 0.0000
913 T K -1.7793
914 N K -2.3135
915 V K 0.0000
916 T K -1.1139
917 G K 0.0000
918 C K 0.0000
919 Y K -0.7302
920 S K -0.8901
921 S K -0.2853
922 M K 0.0000
923 T K -0.1508
924 G K -0.1521
925 A K 0.0000
926 K K -0.8704
927 V K 0.0000
928 S K -1.2877
929 I K 0.0000
930 K K -2.3838
931 L K 0.0000
932 H K -1.3955
933 S K 0.0000
934 S K -0.9875
935 K K -1.9199
936 N K -2.1838
937 S K -1.1934
938 T K -0.6765
939 A K 0.0000
940 H K 0.0000
941 V K 0.0000
942 R K -2.9092
943 C K -2.5866
944 K K -3.0246
945 G K -2.4062
946 D K -2.2864
947 E K -2.2344
948 T K 0.0000
949 A K 0.0000
950 F K 0.0000
951 S K -0.5091
952 V K 0.0000
953 L K -0.6522
954 E K -2.2296
955 G K -0.7702
956 V K 0.3242
957 H K -0.7944
958 S K -1.0324
959 Y K -0.7625
960 T K -1.0786
961 V K 0.0000
962 S K -0.7790
963 L K 0.0000
964 S K -1.1777
965 F K 0.0000
966 D K -2.4610
967 H K -1.9655
968 A K 0.0000
969 V K -0.7547
970 V K 0.0000
971 D K -2.9237
972 E K -2.5303
973 Q K -2.7601
974 C K 0.0000
975 Q K -2.1749
976 L K 0.0000
977 N K -1.8206
978 C K 0.0000
979 G K -1.3055
980 G K -1.0043
981 H K -1.8242
982 E K -2.7020
983 S K -2.0603
984 Q K -2.4712
985 V K 0.0000
986 T K -2.1302
987 L K 0.0000
988 K K -3.0677
989 G K -2.0271
990 N K -1.8471
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 0.0000
997 P K 0.0000
998 K K -0.5595
999 F K 0.0601
1000 V K -0.6070
1001 D K -1.7375
1002 G K -1.0031
1003 S K -0.2778
1004 Y K 0.7853
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 0.1419
1012 V K 0.0587
1013 P K -0.1283
1014 T K -0.1727
1015 G K -0.3738
1016 A K -0.1737
1017 N K 0.3706
1018 I K 1.6913
1019 P K 0.6126
1020 S K 0.1054
1021 P K -0.2208
1022 T K -0.2833
1023 D K -0.6282
1024 W K 0.0000
1025 L K 0.0000
1026 N K -0.4135
1027 A K 0.0030
1028 L K 0.7635
1029 F K 0.0000
1030 G K -0.6961
1031 N K -1.2060
1032 G K -0.4027
1033 L K 0.9883
1034 S K 0.1065
1035 R K -0.9106
1036 W K 0.2210
1037 I K 1.5532
1038 L K 1.6972
1039 G K 0.9190
1040 V K 1.4102
1041 I K 2.0052
1042 G K 1.3209
1043 V K 0.0000
1044 L K 1.8043
1045 L K 1.9050
1046 G K 1.0463
1047 G K 0.0000
1048 L K 1.9781
1049 A K 2.0758
1050 L K 2.5286
1051 F K 0.0000
1052 F K 3.6660
1053 L K 3.6947
1054 I K 3.1447
1055 M K 2.5641
1056 S K 2.3138
1057 L K 2.8858
1058 F K 2.4303
1059 K K -0.0599
1060 L K 1.4211
1061 G K 0.8846
1062 T K 0.3530
1063 K K -0.6835
1064 Q K -0.8929
1065 V K 0.9188
1066 F K 0.7520
1067 R K -1.7836
1068 S K -1.6287
1069 R K -1.8251
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Laboratory of Theory of Biopolymers 2018