Project name: modi_cornRubisco

Status: done

Started: 2026-06-28 09:36:41
Settings
Chain sequence(s) A: VGFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
C: GFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
B: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
E: VGFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
D: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
G: GFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
F: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
I: VGFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
H: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
K: GFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
J: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
M: VGFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
L: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
O: GFKAGVKDYKLTYYTPEYETKDTDILAAFRVTPQLGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVPGDPDQYICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGSTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCTEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVFARELGLPIVMHDYLTGGFTANTTLSHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHSGTVVGKLEGEREITLGFVDLLRDDFIEKDRSRGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIKAACKWSAELAAACEIWKEIKFDGFKAMDTI
N: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
P: MQVWPAYGNKKFETLSYLPPLSTDDLLKQVDYLLRNGWIPCLEFSKVGFVYRENSTSPCYYDGRYWTMWKLPMFGCNDATQVYKELQEAIKSYPDAFHRVIGFDNIKQTQCVSFIAYKPPGS
input PDB
Selected Chain(s) A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,P
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                                        (00:00:25)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (01:38:14)
[INFO]       Main:     Simulation completed successfully.                                          (01:44:01)
Show buried residues

Minimal score value
-3.4355
Maximal score value
1.4862
Average score
-0.3718
Total score value
-1747.6884

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
11 V M 1.3903
12 G M 0.2957
13 F M -0.2959
14 K M -1.2928
15 A M -0.6897
16 G M -0.3992
17 V M -0.4807
18 K M -1.6540
19 D M -1.7101
20 Y M -0.6545
21 K M -0.5793
22 L M 0.5881
23 T M 0.0425
24 Y M 0.0000
25 Y M -0.2153
26 T M -0.7996
27 P M -1.4964
28 E M -2.3587
29 Y M -1.9519
30 E M -2.8042
31 T M -2.3158
32 K M -2.9987
33 D M -3.0342
34 T M -1.4631
35 D M 0.0000
36 I M 0.0000
37 L M 0.0000
38 A M 0.0000
39 A M 0.0000
40 F M 0.0000
41 R M -0.4854
42 V M 0.0000
43 T M -0.5029
44 P M 0.0000
45 Q M 0.0000
46 L M 1.0482
47 G M 0.4047
48 V M 0.2894
49 P M -0.3878
50 P M -0.6990
51 E M -0.8598
52 E M -0.7296
53 A M 0.0000
54 G M 0.0000
55 A M 0.0000
56 A M 0.0000
57 V M 0.0000
58 A M 0.0000
59 A M 0.0000
60 E M 0.0000
61 S M 0.0000
62 S M 0.0000
63 T M 0.0000
64 G M 0.0000
65 T M 0.0976
66 W M 0.0000
67 T M 0.0000
68 T M -0.4680
69 V M 0.0000
70 W M 0.0000
71 T M 0.0000
72 D M -0.3956
73 G M 0.1203
74 L M 0.0000
75 T M 0.0000
76 S M 0.0000
77 L M -0.8022
78 D M -1.8019
79 R M -1.2021
80 Y M 0.0000
81 K M -0.7702
82 G M 0.0000
83 R M 0.0000
84 C M 0.0000
85 Y M 0.0000
86 H M -1.1915
87 I M -0.4764
88 E M -0.6156
89 P M -0.8950
90 V M 0.0000
91 P M -0.9371
92 G M -1.3342
93 D M -1.8421
94 P M -1.4329
95 D M -1.3468
96 Q M 0.0000
97 Y M -0.5903
98 I M 0.0000
99 C M 0.0000
100 Y M -0.1960
101 V M 0.0000
102 A M 0.0000
103 Y M 0.0000
104 P M 0.0000
105 L M 0.0000
106 D M 0.0000
107 L M 0.0000
108 F M 0.0000
109 E M 0.0000
110 E M -0.5092
111 G M -0.3297
112 S M 0.0000
113 V M 0.0000
114 T M 0.0000
115 N M 0.0000
116 M M 0.0000
117 F M 0.0000
118 T M 0.0000
119 S M 0.0000
120 I M 0.0000
121 V M 0.0000
122 G M 0.0000
123 N M -0.1742
124 V M 0.0000
125 F M 0.0000
126 G M 0.0000
127 F M 0.0000
128 K M 0.0000
129 A M -0.0264
130 L M 0.0000
131 R M -0.5019
132 A M 0.0000
133 L M 0.0000
134 R M 0.0000
135 L M 0.0000
136 E M 0.0000
137 D M 0.0000
138 L M 0.0000
139 R M -0.4993
140 I M 0.0000
141 P M 0.0000
142 P M -0.4128
143 A M 0.0000
144 Y M 0.0000
145 S M 0.0000
146 K M 0.0000
147 T M -0.2900
148 F M 0.0000
149 Q M -0.4261
150 G M 0.0000
151 P M 0.0000
152 P M 0.0000
153 H M 0.0000
154 G M 0.0000
155 I M -0.0067
156 Q M -0.3736
157 V M 0.0816
158 E M 0.0000
159 R M 0.0000
160 D M 0.0000
161 K M 0.0000
162 L M 0.0000
163 N M -0.1605
164 K M 0.0000
165 Y M 0.0000
166 G M 0.0000
167 R M 0.0000
168 P M 0.0000
169 L M 0.0000
170 L M 0.0000
171 G M 0.0000
172 S M 0.0000
173 T M 0.0000
174 I M 0.0000
175 K M 0.0000
176 P M 0.0000
177 K M 0.0000
178 L M 0.0000
179 G M 0.0000
180 L M 0.0000
181 S M 0.0000
182 A M 0.0000
183 K M 0.0000
184 N M 0.0000
185 Y M 0.0000
186 G M 0.0000
187 R M 0.0000
188 A M 0.0000
189 C M 0.0000
190 Y M 0.0000
191 E M 0.0000
192 C M 0.0000
193 L M 0.0000
194 R M 0.0000
195 G M 0.0000
196 G M 0.0000
197 L M 0.0000
198 D M 0.0000
199 F M 0.0000
200 T M 0.0000
201 K M 0.0000
202 D M 0.0000
203 D M 0.0000
204 E M 0.0000
205 N M 0.0000
206 V M 0.0000
207 N M 0.0000
208 S M 0.0000
209 Q M 0.0000
210 P M -0.1858
211 F M 0.0000
212 M M 0.0000
213 R M -0.3443
214 W M 0.0000
215 R M 0.0000
216 D M 0.0000
217 R M 0.0000
218 F M 0.0000
219 V M 0.0000
220 F M 0.0000
221 C M 0.0000
222 T M 0.0000
223 E M 0.0000
224 A M 0.0000
225 I M 0.0000
226 Y M 0.0000
227 K M -0.4479
228 A M 0.0000
229 Q M 0.0000
230 A M -0.3937
231 E M -1.0382
232 T M 0.0000
233 G M -0.3897
234 E M 0.0000
235 I M 0.0000
236 K M 0.0000
237 G M 0.0000
238 H M 0.0000
239 Y M 0.0000
240 L M 0.0000
241 N M 0.0000
242 A M 0.0000
243 T M 0.0000
244 A M 0.0000
245 G M 0.0000
246 T M -0.8963
247 C M 0.0000
248 E M -2.2222
249 E M -1.5115
250 M M 0.0000
251 I M -0.4786
252 K M -1.2244
253 R M 0.0000
254 A M 0.0000
255 V M 0.5581
256 F M 0.0000
257 A M 0.0000
258 R M -0.5616
259 E M -1.0148
260 L M 0.0000
261 G M 0.0000
262 L M 0.0000
263 P M 0.0000
264 I M 0.0000
265 V M 0.0000
266 M M 0.0000
267 H M 0.0000
268 D M 0.0000
269 Y M 0.0000
270 L M 0.1681
271 T M 0.0000
272 G M 0.0000
273 G M 0.0000
274 F M 0.0000
275 T M 0.0000
276 A M 0.0000
277 N M 0.0000
278 T M 0.0000
279 T M 0.0000
280 L M 0.0000
281 S M 0.0000
282 H M -0.9507
283 Y M -0.2920
284 C M 0.0000
285 R M -0.9307
286 D M -1.1994
287 N M -0.5411
288 G M 0.0000
289 L M 0.0000
290 L M 0.0000
291 L M 0.0000
292 H M 0.0000
293 I M 0.0000
294 H M 0.0000
295 R M 0.0000
296 A M 0.0000
297 M M 0.0000
298 H M -0.0931
299 A M 0.0000
300 V M 0.0000
301 I M 0.0000
302 D M 0.0000
303 R M 0.0000
304 Q M -1.0600
305 K M -1.4055
306 N M -1.4421
307 H M 0.0000
308 G M 0.0000
309 M M 0.0000
310 H M 0.0000
311 F M 0.0000
312 R M 0.0000
313 V M 0.0000
314 L M 0.0000
315 A M 0.0000
316 K M 0.0000
317 A M 0.0000
318 L M 0.0000
319 R M 0.0000
320 M M 0.0000
321 S M 0.0000
322 G M 0.0000
323 G M 0.0000
324 D M 0.0000
325 H M 0.0000
326 I M 0.0000
327 H M 0.0000
328 S M 0.0000
329 G M 0.0000
330 T M 0.0000
331 V M -0.3128
332 V M -0.4782
333 G M 0.0000
334 K M 0.0000
335 L M 0.1340
336 E M -0.5445
337 G M -0.4961
338 E M -0.9625
339 R M -1.3813
340 E M -1.1351
341 I M 0.0000
342 T M 0.0000
343 L M -0.6071
344 G M 0.0000
345 F M 0.0000
346 V M 0.0000
347 D M -1.3171
348 L M 0.0000
349 L M 0.0000
350 R M -1.3003
351 D M -1.6856
352 D M -0.9352
353 F M -0.1918
354 I M 0.0000
355 E M -2.8315
356 K M -3.3124
357 D M -3.1150
358 R M -2.6252
359 S M -1.4134
360 R M -1.5920
361 G M 0.0000
362 I M 0.0000
363 F M 0.0000
364 F M 0.0000
365 T M -1.5341
366 Q M 0.0000
367 D M -0.5551
368 W M 0.0000
369 V M -0.0575
370 S M -0.2320
371 M M 0.0000
372 P M -0.4488
373 G M -0.8291
374 V M 0.0000
375 I M 0.0000
376 P M 0.0000
377 V M 0.0000
378 A M 0.0000
379 S M -0.0188
380 G M -0.0438
381 G M 0.0000
382 I M 0.0000
383 H M 0.0000
384 V M 0.0000
385 W M -0.9706
386 H M 0.0000
387 M M 0.0000
388 P M 0.0000
389 A M -0.7362
390 L M 0.0000
391 T M 0.0000
392 E M -1.5394
393 I M 0.0000
394 F M 0.0000
395 G M -0.8542
396 D M -0.8056
397 D M -0.7268
398 S M 0.0000
399 V M 0.0000
400 L M 0.0000
401 Q M 0.0000
402 F M 0.0000
403 G M -0.0699
404 G M 0.0000
405 G M 0.0000
406 T M 0.0000
407 L M 0.0000
408 G M 0.0000
409 H M 0.0000
410 P M -0.1213
411 W M 0.2887
412 G M 0.0000
413 N M 0.0000
414 A M 0.0000
415 P M 0.0000
416 G M 0.0000
417 A M 0.0000
418 A M 0.0000
419 A M 0.0000
420 N M 0.0000
421 R M 0.0000
422 V M 0.0000
423 A M 0.0000
424 L M 0.0000
425 E M 0.0000
426 A M 0.0000
427 C M 0.0000
428 V M 0.0000
429 Q M -0.8804
430 A M 0.0000
431 R M -1.3487
432 N M 0.0000
433 E M -1.5439
434 G M -1.4709
435 R M -1.9549
436 D M -2.0380
437 L M 0.0000
438 A M -1.7236
439 R M -2.7569
440 E M -2.6350
441 G M 0.0000
442 N M -2.8407
443 E M -3.2613
444 I M 0.0000
445 I M 0.0000
446 K M -2.4614
447 A M -1.5283
448 A M -0.7722
449 C M -0.9325
450 K M -1.3138
451 W M 0.2594
452 S M 0.0000
453 A M -0.0511
454 E M 0.0000
455 L M 0.0000
456 A M -0.7434
457 A M 0.0000
458 A M 0.0000
459 C M 0.0000
460 E M -2.4319
461 I M -1.1490
462 W M 0.0000
463 K M -3.1888
464 E M -3.0189
465 I M -1.8095
466 K M -2.4888
467 F M -1.2315
468 D M -1.9161
469 G M -1.4668
470 F M -0.9435
471 K M -1.7066
472 A M -1.1149
473 M M -0.4777
474 D M 0.0000
475 T M 0.2314
476 I M 1.3068
11 V A 1.3732
12 G A 0.2549
13 F A -0.3209
14 K A -1.3057
15 A A -0.7010
16 G A -0.4110
17 V A -0.5052
18 K A -1.7019
19 D A -1.7384
20 Y A -0.6682
21 K A -0.5931
22 L A 0.5749
23 T A 0.0307
24 Y A 0.0000
25 Y A -0.2205
26 T A -0.7989
27 P A -1.5041
28 E A -2.3489
29 Y A -1.9201
30 E A -2.7838
31 T A -2.2938
32 K A -2.9877
33 D A -3.0314
34 T A -1.4609
35 D A 0.0000
36 I A 0.0000
37 L A 0.0000
38 A A 0.0000
39 A A 0.0000
40 F A 0.0000
41 R A 0.0000
42 V A 0.0000
43 T A -0.4391
44 P A 0.0000
45 Q A 0.0000
46 L A 1.0499
47 G A 0.4083
48 V A 0.2990
49 P A -0.3742
50 P A -0.7612
51 E A -0.8627
52 E A -0.7227
53 A A 0.0000
54 G A 0.0000
55 A A 0.0000
56 A A 0.0000
57 V A 0.0000
58 A A 0.0000
59 A A 0.0000
60 E A 0.0000
61 S A 0.0000
62 S A 0.0000
63 T A 0.0000
64 G A 0.0000
65 T A 0.0978
66 W A 0.0000
67 T A 0.0000
68 T A -0.4777
69 V A 0.0000
70 W A 0.0000
71 T A 0.0000
72 D A -0.4000
73 G A 0.1188
74 L A 0.0000
75 T A 0.0000
76 S A 0.0000
77 L A -0.8090
78 D A -1.8074
79 R A -1.2064
80 Y A 0.0000
81 K A -0.7822
82 G A 0.0000
83 R A 0.0000
84 C A 0.0000
85 Y A 0.0000
86 H A -1.3056
87 I A -0.6808
88 E A -1.0404
89 P A -1.0280
90 V A -0.8691
91 P A -0.9135
92 G A -1.2721
93 D A -1.7534
94 P A -1.3796
95 D A -1.3064
96 Q A -1.2380
97 Y A -0.6545
98 I A 0.0000
99 C A 0.0000
100 Y A -0.2342
101 V A 0.0000
102 A A 0.0000
103 Y A 0.0000
104 P A 0.0000
105 L A 0.0000
106 D A 0.0000
107 L A 0.0000
108 F A 0.0000
109 E A 0.0000
110 E A -0.4533
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102 I J 0.0000
103 G J 0.0000
104 F J 0.0000
105 D J 0.0000
106 N J 0.0216
107 I J 0.6887
108 K J -0.8706
109 Q J 0.0000
110 T J -0.3043
111 Q J -0.3312
112 C J -0.2693
113 V J 0.0000
114 S J -0.0478
115 F J 0.0000
116 I J 0.0764
117 A J 0.0447
118 Y J -0.4204
119 K J -1.4201
120 P J -1.5165
121 P J -1.1267
122 G J -1.0929
123 S J -1.2419
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6 P L -0.0082
7 A L 0.0540
8 Y L 0.3923
9 G L -0.5955
10 N L -1.2060
11 K L -1.2512
12 K L -0.8123
13 F L -0.1666
14 E L -0.2553
15 T L 0.0000
16 L L 0.0000
17 S L -0.2253
18 Y L 0.0000
19 L L 0.0866
20 P L -0.0676
21 P L -0.1902
22 L L -0.2678
23 S L -0.8683
24 T L -1.0364
25 D L -2.1075
26 D L -1.7758
27 L L 0.0000
28 L L -1.4240
29 K L -2.1588
30 Q L 0.0000
31 V L 0.0000
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33 Y L 0.0000
34 L L 0.0000
35 L L -2.1651
36 R L -2.8924
37 N L -1.6908
38 G L -1.5411
39 W L -0.4567
40 I L 0.0353
41 P L 0.0000
42 C L 0.0000
43 L L 0.0000
44 E L 0.0000
45 F L 0.0000
46 S L -0.6072
47 K L -1.2355
48 V L 0.8650
49 G L 0.3842
50 F L 0.7966
51 V L 0.7342
52 Y L 0.4447
53 R L -0.8994
54 E L -1.8848
55 N L -1.2084
56 S L -0.8510
57 T L -0.6917
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59 P L 0.0000
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61 Y L 0.0000
62 Y L 0.0000
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64 G L 0.3395
65 R L 0.0000
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72 L L 0.0000
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81 T L -1.4267
82 Q L -1.8532
83 V L 0.0000
84 Y L -1.2132
85 K L -2.4177
86 E L -1.9998
87 L L 0.0000
88 Q L -2.1103
89 E L -2.7821
90 A L 0.0000
91 I L -1.7431
92 K L -2.5121
93 S L -1.5104
94 Y L -1.4395
95 P L -1.9312
96 D L -2.4810
97 A L 0.0000
98 F L 0.0000
99 H L 0.0000
100 R L -0.2036
101 V L 0.0000
102 I L 0.0000
103 G L 0.0000
104 F L 0.0000
105 D L -0.3365
106 N L -0.1903
107 I L 0.5537
108 K L -1.0234
109 Q L -0.5748
110 T L -0.4521
111 Q L 0.0000
112 C L -0.2849
113 V L 0.0000
114 S L -0.0353
115 F L 0.0000
116 I L 0.0113
117 A L -0.0420
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119 K L -1.5389
120 P L 0.0000
121 P L -1.1336
122 G L -1.0570
123 S L -1.2667
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7 A N 0.0182
8 Y N 0.4279
9 G N -0.5514
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11 K N -1.3093
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13 F N -0.1663
14 E N -0.2854
15 T N 0.0000
16 L N 0.0000
17 S N -0.1964
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19 L N 0.2460
20 P N 0.1113
21 P N -0.1510
22 L N -0.1925
23 S N -0.8280
24 T N -0.9872
25 D N -2.0757
26 D N -1.6442
27 L N -0.7524
28 L N -1.0407
29 K N -1.7683
30 Q N 0.0000
31 V N 0.0000
32 D N -1.9008
33 Y N -1.4274
34 L N 0.0000
35 L N -1.7999
36 R N -2.6793
37 N N -1.8226
38 G N -1.5303
39 W N -0.2575
40 I N 0.0561
41 P N 0.0000
42 C N 0.0000
43 L N 0.0000
44 E N 0.0000
45 F N 0.0000
46 S N -0.3153
47 K N -0.6201
48 V N 1.2367
49 G N 0.5638
50 F N 0.8941
51 V N 0.7760
52 Y N 0.4805
53 R N -0.8822
54 E N -1.8728
55 N N -1.1939
56 S N -0.8438
57 T N -0.6861
58 S N -0.5802
59 P N 0.0000
60 C N 0.0000
61 Y N 0.0000
62 Y N 0.0000
63 D N 0.0000
64 G N 0.3831
65 R N 0.0000
66 Y N 0.0000
67 W N 0.0000
68 T N 0.0000
69 M N 0.0000
70 W N 0.0000
71 K N -0.0470
72 L N 0.0000
73 P N 0.0000
74 M N -0.0314
75 F N -0.0043
76 G N -0.7343
77 C N -1.0069
78 N N -2.1800
79 D N -1.9905
80 A N -1.4199
81 T N -1.1391
82 Q N -1.6831
83 V N 0.0000
84 Y N -0.9754
85 K N -2.1301
86 E N -1.7886
87 L N 0.0000
88 Q N -1.9816
89 E N -2.5545
90 A N 0.0000
91 I N -1.5723
92 K N -2.4953
93 S N -1.5559
94 Y N 0.0000
95 P N -1.9124
96 D N -2.3776
97 A N 0.0000
98 F N 0.0000
99 H N 0.0000
100 R N -0.1601
101 V N 0.0000
102 I N 0.0000
103 G N 0.0000
104 F N 0.0000
105 D N 0.0000
106 N N 0.0493
107 I N 0.6942
108 K N -0.8560
109 Q N 0.0000
110 T N -0.2537
111 Q N 0.0000
112 C N -0.2251
113 V N 0.0000
114 S N -0.0265
115 F N 0.0000
116 I N 0.0920
117 A N 0.0550
118 Y N -0.4027
119 K N -1.3914
120 P N -1.5082
121 P N -1.1188
122 G N -1.0875
123 S N -1.2059
2 M P 0.6034
3 Q P -0.2145
4 V P 0.0581
5 W P 0.1711
6 P P 0.0021
7 A P 0.0670
8 Y P 0.4180
9 G P -0.5540
10 N P -1.1205
11 K P -1.2072
12 K P -0.7859
13 F P -0.1585
14 E P -0.2556
15 T P 0.0000
16 L P 0.0000
17 S P -0.2177
18 Y P 0.0000
19 L P 0.0770
20 P P -0.0705
21 P P -0.1934
22 L P -0.2652
23 S P -0.8718
24 T P -1.0401
25 D P -2.1226
26 D P -1.7991
27 L P 0.0000
28 L P -1.2385
29 K P -2.1079
30 Q P 0.0000
31 V P 0.0000
32 D P -2.3367
33 Y P -1.8134
34 L P 0.0000
35 L P -1.9417
36 R P -2.8220
37 N P -2.0155
38 G P -1.6596
39 W P -0.5700
40 I P -0.0148
41 P P 0.0000
42 C P 0.0000
43 L P 0.0000
44 E P 0.0000
45 F P 0.0000
46 S P -0.6042
47 K P -1.2321
48 V P 0.8701
49 G P 0.3828
50 F P 0.7899
51 V P 0.7288
52 Y P 0.4395
53 R P -0.9015
54 E P -1.8862
55 N P -1.2098
56 S P -0.8550
57 T P -0.6910
58 S P -0.5878
59 P P 0.0000
60 C P 0.0000
61 Y P 0.0000
62 Y P 0.0000
63 D P 0.0000
64 G P 0.3374
65 R P 0.0000
66 Y P 0.0000
67 W P 0.0000
68 T P 0.0000
69 M P 0.0000
70 W P 0.0000
71 K P -0.1260
72 L P 0.0000
73 P P 0.0000
74 M P 0.1664
75 F P 0.5278
76 G P 0.0803
77 C P -0.6663
78 N P -2.1992
79 D P -1.9883
80 A P -1.3710
81 T P -1.2376
82 Q P -1.7689
83 V P 0.0000
84 Y P -1.1927
85 K P -2.4643
86 E P -2.0646
87 L P 0.0000
88 Q P -2.1970
89 E P -2.9409
90 A P 0.0000
91 I P -1.8012
92 K P -2.5761
93 S P -1.5595
94 Y P -1.4739
95 P P -1.9586
96 D P -2.4838
97 A P 0.0000
98 F P 0.0000
99 H P 0.0000
100 R P -0.2141
101 V P 0.0000
102 I P 0.0000
103 G P 0.0000
104 F P 0.0000
105 D P -0.3884
106 N P -0.1354
107 I P 0.5629
108 K P -1.0115
109 Q P -0.5661
110 T P -0.4437
111 Q P 0.0000
112 C P -0.3293
113 V P 0.0000
114 S P -0.0406
115 F P 0.0000
116 I P -0.0143
117 A P -0.0509
118 Y P -0.4878
119 K P -1.5307
120 P P 0.0000
121 P P -1.1310
122 G P -1.0547
123 S P -1.2529
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Laboratory of Theory of Biopolymers 2018