Project name: b2a20cfadd6df9d

Status: done

Started: 2026-06-22 08:05:23
Settings
Chain sequence(s) A: GINKVLDHLAPSELIKPVKSCHNKPSVLVLDDRIVDAATKDLYVNGFQQNPTPENLQHMFHQGIEILDSARMINVTHLALWKPSSFKLGNPVDFALDDNYDTFWQSDGGQPHQLDIMFSKRMDICVMAIFFSMIADESYAPSLVKVYAGHSPSDARFYKMLEVRNVNGWVALRFLDNREDDQLLKCQFIRLLFPVNHENGKDTHLRGIRLYVPSAILR
C: EWQLQINITNKIGGINGDIWLSRDGRSVKWCIEDQCLRQFTYNQKIIKAGYIDFEKTPDCFVVVLSDIAHVYMLKNGGSTTVCFPFQIGNAFWYANGVILERETSASKPIEFDLKHKYITLTDPMAPFGLISITNFQLVLFPSDKDKCIAVFLDRNSKVLRFYYSRILSSSKDIVLTEISSLKLPDDIIFTRLSSILSKLKFLSLRFERREGLLIFHEPTHFCKIWLIDLLPDVLDSIPFKIYGNSPQNMIRLENLKLKEPSRIQAMYIHELLESCLILVSEGQNKEEYKACLYDPFVKITSPSKNISEELTKQNSLPSLQKLFPYPETSFTKLCFEAVKYITSPAFNISFIFLWQSAYSILLSRANDDVVGGLKMEHDAFSLVLSLLILPIPSSSAQEYQEYKEIYERDLFQHLKQDSEITSSVLPRIVIGLHLIREEYSLNVLCRNEHALLGQFLRFATAAMGWPDLWQSYYVPKTFFHPLDEPPSITKSLYSITENSSIPLCPFISFSRLVATDTQVELRITPRSFKILGLYELVHSPNFLPDYVLGILSSFKVDKDELQTYPLGILVPLQNILKILEDKLSEVRDNLELLDRADLQRCSAIINSIRSDCKVPLAKNRSSKKPSDIYSILSEIVKSASGRSLKLNAGLIFSEDKRFTHVVSLLAYYRPTKTQFFTTKTEYAQILAQKKYFAKIMALRTCTNGVGWGAVAYATEKPISTQKWVIQPLNLISVFPDDTKITVKAPEDIAHDIVEWGQFHAGVSSGLRISKKATGITGSWIAFNKPKELDAYHGGFLLGLGLNGHLKNLEEWHIYNYLSPRNTHISIGLLLGMSSSMKGSMDSKLIKVISVHLVAFLPSGSSDLNIDLKLQTAGIIGMGMLYLNSRHKRMSDSIFAQLVSLLNVNDEMVADEEYRLAAGISLGLINLGAGQTKQNVMYEDLTTKLLEIVTSTYDVENDWIPENSQIGAVIAIMFLFLKSNNFGISNMLKVDLKEILKANINTRPELLMYREWASNMILWEFIGDDLSFIMKDVDIGVKFSELNTDLLPIYYTMAGRILAMGIRFASTGNLKIRNILLSLVDKFLPLYQYPGKQNLDFRLTISVINVLTNVIVVSLSMVMCASGDLEVLRRVKYLHEVASGPYSDLSDPTAYLEDKKDIDDHYGKFISTNLALGFLFLGSGQYALNTSTLESIAFLSMSVLPTYTTPHPLQELKHFWSMAVEPRCLVIKDISTGDAVNNVPIELVVEEDVEKEEVIREISTPCLLPDFSKIKSIRVKMHGYFPLEVNFTKDYSASDFFSGGTIIYIQRKSESVFENKASFRNVEDIHVALKRKAAESKNYSRGNTTSSQLVESLGIQDLTMVELDTLLSAALTDSESYNLGLLCSDKNSGDILDCQLELWYKSFGPH
E: KQYDYSPFCERNTLRESRIDSFLKAERAAHCLVFHKYRPDIDIMCSMLLESVPGCNKEDLERLSRRERLDDIINHETNALKSFWNDSGLVNSLQSHHLHEEYLLLQEELKNVYKIKCESLRDKCRRHYSN
D: DSQDKIIHDIRIQLRKAATELSRWKLYGSSKWAAEALAGLAEAIPQNGFGLSETEYDLYLLGSTLFDAKEFDRCVFFLKDVTNPYLKFLKLYSKFLSWDKKSQESMENILTTGKFTDQSNISSILKEINTFLESYEIKIDDDEADLGLALLYYLRGVILKQEKNISKAMSSFLKSLSCYSFNWSCWLELMDCLQKVDDALLLNNYLYQNFQFKFSENLGSQRTIEFNIMIKFFKLKVFEELNGQLEDYFEDLEFLLQVFPNFTFLKAYNATISYNNLDYVTAESRFDDIVKQDPYRLNDLETYSNILYVMQKNSKLAYLAQFVSQIDRFRPETCCIIANYYSARQEHEKSIMYFRRALTLDKKTTNAWTLMGHEFVELSNSHAAIECYRRAVDICPRDFKAWFGLGQAYALLDMHLYSLYYFQKACTLKPWDRRIWQVLGECYSKTGNKVEAIKCYKRSIKASQTVDQNTSIYYRLAQLYEELEDLQECKKFMMKCVDVEELLEGIVTDETVKARLWLAIFEIKAGNYQLAYDYAMGVSSGTSQEIEEARMLARECRRHM
G: MIRRAPTTLQLSHDDVTSLIDDLNEQKLKQQLNIE
F: ALSTIIQLQDCIQQAIQQLNYSTAEFLAELLYAECSILDKSSVYWSDAVYLYALSLFLNKSYHTAFQISKEFKEYHLGIAYIFGRCALQLSQGVNEAILTLLSIINVFSSNLNSNLVHIPDLATLNCLLGNLYMKLDHSKEGAFYHSEALAINPYLWESYEAICKMRATVDLKRVFFDTLPEIMYNFALILRSSSQYNSFKAIRLFESQIPSHIKDTMPWCLVQLGKLHFEIINYDMSLKYFNRLKDLQPARVKDMEIFSTLLWHLHDKVKSSNLANGLMDTMPNKPETWCCIGNLLSLQKDHDAAIKAFEKATQLDPNFAYAYTLQGHEHSSNDSSDSAKTCYRKALACDPQHYNAYYGLGTSAMKLGQYEEALLYFEKARSINPVNVVLICCCGGSLEKLGYKEKALQYYELACHLQPTSSLSKYKMGQLLYSMTRYNVALQTFEELVKLVPDDATAHYLLGQTYRIVGRKKDAIKELTVAMNLDPKGNQVIIDELQKCH
I: SSSSYRDSYFQYRHLPAPHHILYAEWNQDILALPDEVANITMAMMTSEQNSNRYWNSFHDEDDWNLFNGMELESNGVVTFAGQETITGSIFDRRITQLAYARNNGWHELAL
H: DDQALSTIIQLQDCIQQAIQQLNYSTAEFLAELLYAECSILDKSSVYWSDAVYLYALSLFLNKSYHTAFQISKEFKEYHLGIAYIFGRCALQLSQGVNEAILTLLSIINVFSMVLNSNLVHIPDLATLNCLLGNLYMKLDHSKEGAFYHSEALAINPYLWESYEAICKMRATVDLKRVFFDTLPEIMYNFALILRSSSQYNSFKAIRLFESQIPSHIKDTMPWCLVQLGKLHFEIINYDMSLKYFNRLKDLQPARVKDMEIFSTLLWHLHDKVKSSNLANGLMDTMPNKPETWCCIGNLLSLQKDHDAAIKAFEKATQLDPNFAYAYTLQGHEHSSNDSSDSAKTCYRKALACDPQHYNAYYGLGTSAMKLGQYEEALLYFEKARSINPVNVVLICCCGGSLEKLGYKEKALQYYELACHLQPTSSLSKYKMGQLLYSMTRYNVALQTFEELVKLVPDDATAHYLLGQTYRIVGRKKDAIKELTVAMNLDPKGNQVIIDELQKCH
K: AIERLRLWRFDALMQHMYRTAEYIADKVYNISNDPDDAFWLGQVYYNNNQYVRAVELITRNNLDGVNILCRYLLGLSFVKLQRFDDALDVIGEYNPFSDGGIKMESSLCFLRGKIYFAQNNFNKARDAFREAILVDIKNFEAFEMLLSKNLLTPQEEWDLFDSLDFKEFGEDKEIMKNLYKINLSKYINTEDITKSNEILAKDYKLADNVDVVRSKVDICYTQCKFNECLELCETVLENDEFNTNILPAYIGCLYELSNKNKLFLLSHRLAETFPKSAITWFSVATYYMSLDRISEAQKYYSKSSILDPSFAAAWLGFAHTYALEGEQDQALTAYSTASRFFPGMHLPKLFLGMQFMAMNSLNLAESYFVLAYDICPNDPLVLNEMGVMYFKKNEFVKAKKYLKKALEVVKDLDPSSRTTISIQLNLGHTYRKLNENEIAIKCFRCVLEKNDKNSEIHCSLGYLYLKTKKLQKAIDHLHKSLYLKPNNSSATALLKNALELNVTL
J: AIERLRLWRFDALMQHMYRTAEYIADKVYNISNDPDDAFWLGQVYYNNNQYVRAVELITRNNLDGVNILCRYLLGLSFVKLQRFDDALDVIGEYNPFSEDGGIKMESSLCFLRGKIYFAQNNFNKARDAFREAILVDIKNFEAFEMLLSKNLLTPQEEWDLFDSLDFKEFGEDKEIMKNLYKINLSKYINTEDITKSNEILAKDYKLADNVDVVRSKVDICYTQCKFNECLELCETVLENDEFNTNILPAYIGCLYELSNKNKLFLLSHRLAETFPKSAITWFSVATYYMSLDRISEAQKYYSKSSILDPSFAAAWLGFAHTYALEGEQDQALTAYSTASRFFPGMHLPKLFLGMQFMAMNSLNLAESYFVLAYDICPNDPLVLNEMGVMYFKKNEFVKAKKYLKKALEVVKDLDPSSRTTISIQLNLGHTYRKLNENEIAIKCFRCVLEKNDKNSEIHCSLGYLYLKTKKLQKAIDHLHKSLYLKPNNSSATALLKNALELNVTLSLD
O: KYGPLGITNFITPYDLCILILIHAHCSQDNGISVPTAVFLRLISPTRPSLEWNPLLKDNSNLRSSSIVPPPVLPILDNIIRILLDDKDGNKIALTLMGYLEAINGLDSINRLMMDLEKNCLVNNYRSMKMRTTSTRRQMTRASFLGTFLSTCIRKYQIGDFEMRETIWINLQNFKTVFKHTPLWLRFKDNVHIQKVKNCLLANDEISVEDQQMVEFFQHFNNGNDADSKTMNEENYGTLISIQHLQSIVNRQIVNWLDYEEQSGLVFDLLDTLSLNDATKFPLIFILKYLEAIKENSYQTALDSLHNYFDYKSTGNSQNYFHISLLSLATFHSSFNECDAAINSFEEATRIARENKDMETLNLIMIWIINFIEVHPEYANRFYITVEQIIKYLKNSSDVEDANIFSNAYKFETLLSMVKESKTAEVSSSLLKFMAITLQNVPSQNFDLFQSLVSYEVKFWKELGYESISDVYEKFLSKTSSSSLRNYDSSIINQDIKVAFKALEEDDFLKVKQYLLKSESLELDYDQKINLKYLRVKYLVKIGDYDLSMRLINQYVKECCEEVADSNWRFKFEIESINVLLLSDVGIRSLPKIIKLIDEYKEIGNPLRCVILLLKLCEVLIQVGKSMEAECLISCNLSTILEFPFVRKKTDELLESLS
N: ARALRDISLFNDIRKDQNSVKYIPSLSAYNVFNEFPYYPTSASQLLDGKLDEFLMLSEQYKSRLPKIRKLGWNRFKPIGINKTMYELEMLRSRARA
Q: INDYFIDYNPLFPIFATRIAKGLAIYRVSDHARLAVIPIRNINLVANYDWDTTTGKFLSIFFKDGTIRIHDIFKDGRLVSFLRIPSTKISKGIWDRIPLRYEPNNRDFACNIIDDLPKLIRFVKDSKRINIVPYTQPNSLWRGPDEDDLDSNEKLDVHVVFNEGNDKITVFFNGDYAVFLSVDNIENENSLKSIIKVQDGFYQCFYEDGTVQTLNLGPLLQSKSSVNLLNYIMVIKELIGYMLTHLEFINRELATPYLDFVKRLCDEAYGYGKLKSELEALFLLGEISCDLEDWLCNSVGEKNFKRWKYLGCEAYQKTVQILTLIFVPACERIIIYVEKLRAILQAFSIQNKLSYTSDLTAVEVLLKSSQKLLTMTLNSIIGLGRDETLFEKFFIWFNDRLHEALDEDYKLKFQFEDDLYFGYDLLSYFDRILSKKGTEPSSIIDVKLYRDLINSMSDMEKDIAQSNVNSHIQQHILVDLKTDVFAQKYPSSQINLLDAIKLPKHNYIVYLIQVTKHNSAQEPFSEENKKKLYIGTLKDENLGIISKESSVKIPALFKSYRLSSTRFVPNRVHSLLRDIGLSDSNYHSSYIRENRENDDFIACTAKVSVDGRSASLVFPKEKQ
P: QDKIIHDIRIQLRKAATELSRWKLYGSSKWAAEALAGLAPQNGFGLSETEYDLYLLGSTLFDAKEFDRCVFFLKDVTNPYLKFLKLYSKFLSWDKKSQESMENILTTGKFTESQSNISSILKEINTFLESYEIKIDDDEADLGLALLYYLRGVILKQEKNISKAMSSFLKSLSCYSFNWSCWLELMDCLQKVDDALLLNNYLYQNFQFKFSENLGSQRTIEFNIMIKFFKLKVFEELNGQLEDYFEDLEFLLQVFPNFTFLKAYNATISYNNLDYVTAESRFDDIVKQDPYRLNDLETYSNILYVMQKNSKLAYLAQFVSQIDRFRPETCCIIANYYSARQEHEKSIMYFRRALTLDKKTTNAWTLMGHEFVELSNSHAAIECYRRAVDICPRDFKAWFGLGQAYALLDMHLYSLYYFQKACTLKPWDRRIWQVLGECYSKTGNKVEAIKCYKRSIKASQTVDQNTSIYYRLAQLYEELEDLQECKKFMMKCVDVEELLEGIVTDETVKARLWLAIFEIKAGNYQLAYDYAMGVSSGTSQEIEEARMLARECRRHM
U: MKVKINEVHSVFAWSWHIPSDEDVCGICRASYNGTCPSCKFPGDQCPLVIGLCHHNFHDHCIYRWLDTPTSKGLCPMCRQTFQLQKGLAINDAHVQKFVEIVSRRREEMIEEGV
T: QITPTRDLKVITDELQTLSSYIFHTNIVDDLNSLLTWMSPNDAKSNHQLRPPSLRIKNIIKVLFPGNTNKELQLQLFSTLKEFYIFQVRYHFFLHFNNINYLKDIQRWENYYEFPLRYVPIFDVNVNDWALELNSLRHYLLNRNIKFKNNLRTRLDKLIMDDDFDLADNLIQWLKSANGSLSSTELIVNALYSKINKFCEDNMSRVWNKRFMIMETFNKFINQYWSQFSKLVGCPEDDHELTTTVFNCFESNFLRIRTNEIFDICVLAYPDSKVTLLELRKIMKDFKDYTNIVTTFLSDFKKYILNPSVTTVDALLRYVKTIKAFLVLDPTGRCLHSITTFVKPYFQERKHLVNVLLYAMLDLPEEELKEKINFNVDMKALLSLVDTLHDSDIIRHAMLYEHILNYYIAWVPKSSYIKTNLFEVLLDLFESREFFISEFRNLLTDRLFTLLDEKWTRCLKLIREKIVKFTADADQSNLNSIDVMLWDIKCSEELCRKMHEVAGLDPIIFPKFISLLYWKYNCDTQGSNDLAFHLPIDLERELQKYSDIYSQLKPGRKLQLCKDKGKVEIQLAFKDGRKLVLDVSLEQCSVINQFDSPNDEPICLSLEQLSESLNIAPPRLTHLLDFWIQKGVLLKENGTYSVIEHSEMDF
W: MIRRAPTTLQLSHDDVTSLIDDLNEQKLKQQLNIE
input PDB
Selected Chain(s) A,C,E,D,G,F,I,H,K,J,O,N,Q,P,U,T,W
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                                        (00:00:40)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (03:23:31)
[INFO]       Main:     Simulation completed successfully.                                          (03:36:14)
Show buried residues

Minimal score value
-5.1321
Maximal score value
1.8927
Average score
-0.7214
Total score value
-5203.343

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
23 A F 0.6263
24 L F 1.1315
25 S F 0.3128
26 T F -0.0677
27 I F 0.0000
28 I F -0.0124
29 Q F -1.3207
30 L F 0.0000
31 Q F 0.0000
32 D F -2.1834
33 C F -1.3699
34 I F 0.0000
35 Q F -1.3890
36 Q F -1.5617
37 A F 0.0000
38 I F 0.0000
39 Q F -1.1597
40 Q F -0.7880
41 L F 0.0000
42 N F -0.4212
43 Y F -0.2259
44 S F -0.4727
45 T F 0.0000
46 A F 0.0000
47 E F -0.4055
48 F F 0.0000
49 L F 0.0000
50 A F 0.0000
51 E F 0.0000
52 L F 0.0000
53 L F 0.0000
54 Y F 0.2573
55 A F 0.0000
56 E F -0.0260
57 C F 0.0000
58 S F 0.3287
59 I F 1.5535
60 L F 0.8133
61 D F -0.7589
62 K F -1.5288
63 S F -0.6523
64 S F 0.1412
65 V F 1.5729
66 Y F 1.0684
67 W F 0.0000
68 S F 0.2186
69 D F 0.5597
70 A F 0.0000
71 V F 0.0000
72 Y F 0.0000
73 L F 0.0000
74 Y F 0.0000
75 A F 0.0000
76 L F 0.0000
77 S F 0.0000
78 L F 0.0000
79 F F -0.4106
80 L F -0.2669
81 N F -1.0079
82 K F -1.7168
83 S F -0.9786
84 Y F -0.6344
85 H F -0.5456
86 T F 0.0000
87 A F 0.0000
88 F F 0.0000
89 Q F -1.1315
90 I F 0.0000
91 S F 0.0000
92 K F -1.9531
93 E F -1.9545
94 F F -1.0763
95 K F -1.4455
96 E F -1.5225
97 Y F 0.3461
98 H F 0.3071
99 L F 0.0000
100 G F 0.0000
101 I F 0.0000
102 A F 0.0000
103 Y F 0.0000
104 I F 0.0000
105 F F 0.0000
106 G F 0.0000
107 R F -0.4028
108 C F 0.0000
109 A F 0.0000
110 L F -0.5713
111 Q F -1.0992
112 L F -0.5663
113 S F -0.6486
114 Q F -0.8616
115 G F -0.9630
116 V F 0.0000
117 N F -1.1071
118 E F -0.6885
119 A F 0.0000
120 I F 0.0000
121 L F 0.9920
122 T F 0.0011
123 L F 0.0000
124 L F 0.7036
125 S F 0.5372
126 I F 0.8912
127 I F 0.0000
128 N F -0.0529
129 V F 1.5718
130 F F 1.2085
131 S F 0.0722
132 S F -0.2836
133 N F -1.0363
143 L F 0.9493
144 N F -1.0112
145 S F -0.5147
146 N F -1.3682
147 L F -0.5738
148 V F -0.3599
149 H F -0.7063
150 I F -0.5647
151 P F 0.0000
152 D F -1.4221
153 L F 0.0415
154 A F 0.0000
155 T F 0.0000
156 L F 0.0000
157 N F 0.0000
158 C F 0.0000
159 L F 0.0000
160 L F 0.0000
161 G F 0.0000
162 N F -0.3644
163 L F 0.0000
164 Y F -0.9773
165 M F -0.9295
166 K F -1.1035
167 L F -1.2944
168 D F -2.2830
169 H F -2.0419
170 S F -1.2322
171 K F -1.0926
172 E F -1.6519
173 G F 0.0000
174 A F 0.0000
175 F F 0.0000
176 Y F 0.0000
177 H F 0.0000
178 S F 0.0000
179 E F -0.0569
180 A F 0.0000
181 L F 0.0000
182 A F 0.4088
183 I F 1.4904
184 N F 0.4453
185 P F 0.4417
186 Y F 0.1323
187 L F 0.0000
188 W F -0.2512
189 E F -0.5031
190 S F 0.0000
191 Y F -0.5565
192 E F -1.2834
193 A F -0.9779
194 I F 0.0000
195 C F -1.3827
196 K F -2.1762
197 M F 0.0000
198 R F -1.2480
199 A F 0.0000
200 T F -0.8165
201 V F -1.1613
202 D F -1.8085
203 L F 0.0000
204 K F -2.0962
205 R F -2.5820
206 V F -0.9993
207 F F -0.7321
208 F F -0.4173
209 D F -1.9260
432 T F -0.6499
433 L F 0.0000
434 P F -0.2344
435 E F -1.0859
436 I F -0.3906
437 M F 0.0000
438 Y F -0.1402
439 N F 0.0000
440 F F 0.0000
441 A F -0.1380
442 L F 0.0000
443 I F 0.0000
444 L F 0.0000
445 R F -0.8594
446 S F 0.0000
447 S F 0.0000
448 S F -0.9076
449 Q F -0.7405
450 Y F -0.2216
451 N F 0.0000
452 S F 0.0000
453 F F 0.0000
454 K F -0.1003
455 A F 0.0000
456 I F 0.0000
457 R F 0.0000
458 L F 0.0000
459 F F 0.0000
460 E F -1.5570
461 S F -1.1624
462 Q F -1.4398
463 I F 0.0000
464 P F -1.2204
465 S F -1.4960
466 H F -1.0686
467 I F 0.0000
468 K F -1.7547
469 D F -2.4091
470 T F -1.2742
471 M F 0.0000
472 P F 0.0000
473 W F -0.2318
474 C F 0.0000
475 L F 0.0000
476 V F 0.0000
477 Q F -0.2446
478 L F 0.0000
479 G F 0.0000
480 K F -0.2991
481 L F 0.0000
482 H F 0.0000
483 F F 0.3693
484 E F 0.2361
485 I F 0.0000
486 I F 1.7753
487 N F 0.5768
488 Y F -0.0033
489 D F -1.4698
490 M F 0.0000
491 S F 0.0000
492 L F -1.1657
493 K F -2.1631
494 Y F -1.7691
495 F F 0.0000
496 N F -2.0572
497 R F -3.0147
498 L F 0.0000
499 K F -1.8668
500 D F -2.3797
501 L F -0.7486
502 Q F -0.9434
503 P F -1.1612
504 A F -0.7295
505 R F -1.0741
506 V F 0.0000
507 K F -2.2483
508 D F -1.6556
509 M F 0.0000
510 E F -0.5834
511 I F -0.2021
512 F F 0.0000
513 S F 0.0000
514 T F 0.0000
515 L F 0.0000
516 L F 0.0000
517 W F -0.0206
518 H F -0.2928
519 L F -0.4128
520 H F -0.9882
521 D F -0.9033
522 K F -0.8793
523 V F -0.6940
524 K F -0.4358
525 S F 0.0000
526 S F 0.0000
527 N F -0.4006
528 L F 0.0000
529 A F 0.0000
530 N F -0.5956
531 G F -1.0127
532 L F 0.0000
533 M F -1.1527
534 D F -1.8175
535 T F -1.2035
536 M F -1.1002
537 P F -1.3764
538 N F -1.7733
539 K F -1.6599
540 P F 0.0000
541 E F -1.0324
542 T F 0.0000
543 W F -0.7087
544 C F 0.0000
545 C F 0.0000
546 I F 0.0000
547 G F 0.0000
548 N F 0.0000
549 L F 0.0000
550 L F -0.6134
551 S F -0.9465
552 L F -0.7273
553 Q F -1.2283
554 K F -2.5109
555 D F -2.6065
556 H F -2.6507
557 D F -3.0256
558 A F -1.9989
559 A F 0.0000
560 I F -2.2005
561 K F -2.8523
562 A F 0.0000
563 F F 0.0000
564 E F -3.1136
565 K F -2.6910
566 A F 0.0000
567 T F -1.7772
568 Q F -2.0437
569 L F -1.3778
570 D F -2.1576
571 P F -1.6294
572 N F -1.7341
573 F F -0.7580
574 A F 0.0000
575 Y F 0.1234
576 A F 0.0000
577 Y F 0.0000
578 T F 0.0000
579 L F 0.1527
580 Q F 0.0000
581 G F 0.0000
582 H F -0.5820
583 E F 0.0000
584 H F -1.8354
585 S F -1.8922
586 S F -1.5844
587 N F -2.6351
588 D F -2.9272
589 S F -2.0532
590 S F -1.9458
591 D F -2.2619
592 S F -1.5290
593 A F 0.0000
594 K F -1.3475
595 T F -0.9459
596 C F -0.7018
597 Y F 0.0000
598 R F -0.6215
599 K F -1.0562
600 A F 0.0000
601 L F -0.4532
602 A F -0.4828
603 C F -0.8518
604 D F -0.8736
605 P F -0.7809
606 Q F -0.8014
607 H F -0.4309
608 Y F -0.0735
609 N F -0.1481
610 A F 0.0000
611 Y F 0.0000
612 Y F 0.2695
613 G F 0.0000
614 L F 0.0000
615 G F 0.0000
616 T F -0.2232
617 S F 0.0000
618 A F 0.0000
619 M F -0.9113
620 K F -1.6451
621 L F -0.3938
622 G F -1.0416
623 Q F -1.3619
624 Y F -1.0039
625 E F -1.0646
626 E F -0.7498
627 A F 0.0000
628 L F 0.0000
629 L F 0.0000
630 Y F 0.0000
631 F F 0.0000
632 E F 0.0000
633 K F -0.1140
634 A F 0.0000
635 R F -0.0614
636 S F 0.0000
637 I F -0.1714
638 N F 0.0000
639 P F 0.0839
640 V F 0.2678
641 N F 0.3981
642 V F 0.9465
643 V F 1.2541
644 L F 0.0000
645 I F 0.0000
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480 I Q 0.0000
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484 L Q 0.3880
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486 T Q -0.7130
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494 P Q -1.2713
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496 S Q -1.8305
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500 L Q 0.0000
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502 D Q 0.0000
503 A Q 0.0000
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512 I Q 0.0000
513 V Q 0.0000
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515 L Q 0.0000
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522 N Q -2.5697
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524 A Q -1.2640
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6 I A -1.1362
7 N A -2.3202
8 K A -3.0510
9 V A 0.0000
10 L A 0.0000
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15 P A 0.0000
16 S A -1.0203
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18 L A 0.2379
19 I A 0.0531
20 K A -0.0501
21 P A 0.3404
22 V A 1.5556
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24 S A -0.1122
25 C A -0.7065
26 H A -1.6976
27 N A -1.7636
28 K A -2.0806
29 P A -0.9168
30 S A 0.1459
31 V A 1.6964
32 L A 1.4562
33 V A 1.4036
34 L A 0.0000
35 D A -0.8641
36 D A -1.4865
37 R A -1.5853
38 I A 0.2761
39 V A 0.6517
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41 A A -1.4227
42 A A -1.3448
43 T A -1.1281
44 K A -2.4232
45 D A -2.7815
46 L A -1.2961
47 Y A 0.0000
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49 N A -0.5348
50 G A -0.6960
51 F A -0.6097
52 Q A -1.7048
58 Q A -1.9784
59 N A -2.0744
60 P A -1.6350
61 T A -1.5817
62 P A -1.9747
63 E A -2.9263
64 N A -2.5017
65 L A 0.0000
66 Q A -2.5673
67 H A -2.4940
68 M A -1.8732
69 F A 0.0000
70 H A -2.2905
71 Q A -2.0615
72 G A 0.0000
73 I A -1.3013
74 E A -1.9229
75 I A -0.4251
76 L A -0.6613
77 D A -1.7201
78 S A -1.1137
79 A A -1.0946
80 R A -1.8388
81 M A -0.7294
82 I A -0.0938
83 N A -0.4840
84 V A -0.1251
85 T A 0.0000
86 H A -0.8020
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89 L A -0.2716
90 W A -0.8677
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92 P A -1.0671
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94 S A -0.8120
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128 S A -0.4053
129 K A -1.0591
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132 D A -0.8450
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152 L A -0.2185
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189 D A -2.5967
190 D A -2.0715
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194 K A -0.6515
195 C A 0.0000
196 Q A 0.0000
197 F A 0.0000
198 I A 0.0000
199 R A -0.8332
200 L A 0.0000
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202 F A 0.0000
203 P A 0.0000
204 V A -0.4041
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206 H A -2.2449
207 E A -2.9298
208 N A -2.4921
209 G A -2.2812
210 K A -2.5657
211 D A -1.5518
212 T A 0.0000
213 H A -0.2119
214 L A 0.0000
215 R A 0.0000
216 G A 0.0000
217 I A 0.0000
218 R A 0.0000
219 L A 0.0000
220 Y A 0.0000
221 V A 0.0000
222 P A -0.3754
223 S A -0.3590
247 A A 0.5760
248 I A 0.9293
249 L A 0.0000
250 R A 0.0000
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Laboratory of Theory of Biopolymers 2018