[Fri Aug 26 18:14:46 2016] >Input file: TMQ8C3S2S1D.pdb >TM segments: B836-851_B854-874_B878-894_B896-910 MAIDEN score = -3.2442 Below is the ranking list of the residue pairs and their related pseudo-energy (the lower, the better). This includes inter-chain residue pairs. The maximum (least favorable) pairwise energy value has been set to 10. See the MAIDEN software article: Postic,G., Ghouzam,Y. and Gelly,J.C. (2015) Biochimie, 115, 155–161. ----------- ---------------- Calpha pair Empirical energy ----------- ---------------- K862B-F868B 2.49186353102538 K863B-F868B 1.21147622004844 L869B-K905B 1.18590776874511 K862B-L869B 1.14896526467964 Q861B-F868B 1.07210680768462 Q866B-L902B 1.00888711330374 E860B-I867B 0.971592532956951 A855B-K862B 0.903859950319659 W849B-L858B 0.825824403923535 L846B-E860B 0.805486827531546 V850B-L858B 0.729740111059693 L872B-Y906B 0.688519829493727 L846B-Q861B 0.683941800802735 L872B-A883B 0.675618666992443 E860B-F868B 0.602016731431417 A855B-L890B 0.555832425684093 F868B-L902B 0.549562260207366 H874B-V879B 0.522479023418582 F868B-D901B 0.521994335271322 Q861B-I867B 0.521028673929814 E854B-V893B 0.517064351767784 L869B-L902B 0.515219193028347 N871B-V879B 0.488333366982902 L872B-L902B 0.485111289214094 Y880B-G909B 0.482345199447304 E873B-L902B 0.479659449216307 L865B-D901B 0.479414433328801 Q861B-Y894B 0.473135105514804 L843B-S882B 0.468192138852832 Q866B-K905B 0.447634180034694 A855B-K863B 0.439098852686847 Q861B-Y880B 0.436007016618825 W849B-E854B 0.43458060954404 E870B-L902B 0.429340386836168 A855B-V893B 0.427833076667075 Q866B-D901B 0.397089226839645 K862B-E870B 0.376370350728867 R839B-V879B 0.359165625935535 G886B-Y894B 0.355617003874158 L872B-V879B 0.352475470338369 E854B-K863B 0.349963720808608 H874B-K905B 0.349402626714749 L872B-Y880B 0.348969072625448 Y880B-Q885B 0.339154125951172 E859B-Q866B 0.333069974204626 E873B-F878B 0.328670243316198 K863B-A888B 0.319141321994454 E854B-L890B 0.308081573196927 T845B-E859B 0.307497731281102 A847B-A883B 0.296293746038684 A842B-G886B 0.296022970826746 L858B-K863B 0.295787317955535 E860B-H874B 0.292718870576638 R856B-E896B 0.283972275576442 L843B-R848B 0.271401796121788 E854B-Y894B 0.270220558417023 K863B-L899B 0.267395772170222 Y880B-D907B 0.263344274419408 D901B-Y906B 0.259333339637473 K863B-L869B 0.256553592455448 V850B-D892B 0.250911316054314 E860B-Q866B 0.250116668090619 Q861B-S891B 0.247195302671046 L902B-D907B 0.246196355898086 P837B-T845B 0.243618188428919 V900B-D907B 0.239688420085298 L872B-G886B 0.237258400966843 A855B-Q861B 0.230320429696615 A855B-F868B 0.229438251069173 K863B-D892B 0.226233669612999 I884B-Y906B 0.223650903319205 K862B-Y894B 0.221804813506385 E873B-Y906B 0.220848266722215 E873B-Y880B 0.219437248670141 Q861B-L869B 0.219293531683851 Q861B-S882B 0.218983348985517 W849B-K863B 0.213306548241949 A840B-G886B 0.212390553679887 L846B-E859B 0.210603730105195 H874B-A883B 0.207805455892646 F868B-V879B 0.204905321846261 N871B-G886B 0.203401770092806 N871B-L902B 0.201332568957973 K863B-E896B 0.200812350880319 A857B-L864B 0.199610325725656 G886B-Y906B 0.198360904948567 E851B-A857B 0.196137567360373 Q885B-G909B 0.195068047447937 S882B-S891B 0.194103426474624 R848B-R856B 0.192986459861973 A888B-Y894B 0.18865944575381 H874B-L881B 0.187527965562365 R848B-A855B 0.186153514768446 R848B-E854B 0.186148340137794 K863B-N871B 0.185798041765201 A883B-S891B 0.185657415580739 A855B-Y894B 0.184794343138481 W849B-E859B 0.184636713202841 T838B-F878B 0.182184386373405 K863B-L903B 0.179345416778882 N871B-G909B 0.178475847125019 L872B-K910B 0.178124190562309 R856B-D901B 0.177067253434545 A841B-S882B 0.174942117106111 S891B-L902B 0.173326853141891 T845B-A883B 0.173234218903803 Q866B-N871B 0.170611882446837 L881B-K905B 0.169992438870692 S882B-Y906B 0.169815264043684 L869B-V900B 0.169631155425456 L902B-K910B 0.167859030637 W849B-R856B 0.167716996766881 A857B-G886B 0.161636831452177 A842B-F878B 0.161186646590336 N871B-L903B 0.161030598637223 I884B-G909B 0.160507344479329 L858B-G886B 0.160180436974711 R844B-E859B 0.159707177141087 E873B-K910B 0.158388600115369 L858B-S891B 0.152565803081467 A883B-G909B 0.151328099864376 K862B-E873B 0.150465767385539 E851B-E859B 0.149658043991021 E870B-V879B 0.147685605810457 R839B-S882B 0.144078154394034 R844B-Q861B 0.143293214801668 H874B-S882B 0.143078587411468 E851B-S891B 0.142025416965946 A847B-I887B 0.140529010610396 E851B-Q861B 0.139387842522088 N871B-D907B 0.139010489062017 V850B-E859B 0.137953476288762 A847B-E859B 0.134705596473529 H874B-L902B 0.134523927485893 R844B-A883B 0.134109131013869 Q861B-E873B 0.133252590869413 E851B-Y894B 0.132907604757876 A841B-A883B 0.132768445160482 Q866B-Y906B 0.132132188263554 I887B-E896B 0.131087423454098 S891B-E896B 0.130241114163761 A855B-I867B 0.129991789189933 Y894B-L899B 0.129821916668597 A857B-S891B 0.128301060337542 Q866B-H874B 0.127212025075727 L872B-I884B 0.126394804187187 R856B-E897B 0.125165027103704 I887B-L899B 0.125146722124949 F878B-G909B 0.124154616718081 R839B-F878B 0.123022875024376 N871B-Y880B 0.121542536704474 R848B-G886B 0.119915637190758 A840B-R848B 0.118789600587549 H874B-Y906B 0.118704574043123 E860B-G886B 0.118501112032606 E860B-I887B 0.117918952346121 L843B-L858B 0.117594826069956 E860B-E873B 0.116810557064877 V850B-S891B 0.116799976580016 N871B-Y906B 0.116585373959235 W849B-E860B 0.116124239883196 L846B-Q885B 0.115973840252244 R839B-E860B 0.115851403902428 L865B-L872B 0.115696087934314 A855B-G886B 0.115608194250223 E870B-I884B 0.115551919756476 Y880B-A904B 0.115360650535085 E851B-G886B 0.115025577565677 F868B-G886B 0.114989292786499 V850B-A855B 0.114976693754017 Q861B-N871B 0.114719481522638 Y880B-L903B 0.113800238721117 T845B-S882B 0.113594092014634 V850B-I887B 0.11277694563551 A847B-A857B 0.112329639294186 I884B-A904B 0.111746777292836 R839B-A847B 0.111432116398907 K862B-L890B 0.111161389363342 L899B-A904B 0.110935272598225 A840B-Q885B 0.109317647630585 L865B-A904B 0.107816927126394 L864B-L903B 0.107054047284544 S882B-G909B 0.107034029740045 L869B-A888B 0.1064918335749 Q866B-I898B 0.106109448311793 L858B-L864B 0.106081783903763 N871B-A904B 0.106056096531949 S891B-V900B 0.104914736083034 L869B-D907B 0.104466153286339 F868B-Y880B 0.103845474885687 Y880B-Y906B 0.103514268591521 I867B-H874B 0.103471331078914 E854B-G886B 0.103111175323614 L846B-V879B 0.101536373547536 T838B-V879B 0.101380044633739 A847B-V893B 0.0991377094549044 L890B-L902B 0.0990780277132752 K862B-E896B 0.0988878830225195 L864B-S891B 0.0987329913380108 L843B-L872B 0.0986938954916621 A857B-V893B 0.0984527456548587 A857B-L869B 0.0983440363004993 L865B-E870B 0.0979556899225651 Q861B-L899B 0.0975331462439712 L858B-L872B 0.0963071242520028 A857B-L890B 0.0958398148389858 L858B-V893B 0.0957182120214901 T845B-G886B 0.0954624872875904 L865B-L903B 0.0950899340773799 E854B-E896B 0.0945150111166517 L846B-L881B 0.0942390372124464 R848B-E859B 0.0940057615238519 I887B-G909B 0.0932186597648095 E859B-L864B 0.0920969234649749 A855B-S891B 0.0886974787155665 K862B-G886B 0.0880734547242092 L899B-K905B 0.0879004248443502 A857B-L899B 0.0871740146880167 V836B-A883B 0.0869070984711642 L858B-L890B 0.0865539042613221 A888B-Y906B 0.0864904255729793 R844B-L889B 0.085993496798665 G886B-D892B 0.0856434779780986 L843B-G886B 0.0855075830297438 V850B-L890B 0.0852775850443219 R844B-E854B 0.0844045214138935 K863B-G886B 0.0836466998398719 E873B-S908B 0.0830437179648245 A847B-S891B 0.0822727730146702 R844B-L890B 0.0821044082412465 E851B-E860B 0.081975568585082 L899B-Y906B 0.0819433856042027 E860B-S882B 0.0791975988549769 E870B-G909B 0.0789259682549255 E873B-L903B 0.0787953781078308 L864B-N871B 0.0786735318285876 L846B-R856B 0.0785240563202623 N871B-D901B 0.0784450597229736 L858B-N871B 0.0774472050920489 E854B-E897B 0.0765989747364247 R844B-S882B 0.0763833388290639 F868B-V900B 0.0763420054726698 R856B-K863B 0.0761225498107028 G886B-G909B 0.0754339169793966 E854B-Q861B 0.0753004398450599 Q885B-L890B 0.0730804919810897 E854B-I887B 0.0728890725822433 A847B-Q885B 0.0723394970579212 L846B-S882B 0.0692623245176129 A842B-Q861B 0.0688447549896383 P837B-L846B 0.0688442532400213 E870B-Y906B 0.0687359288148104 L846B-G886B 0.0686990548355899 A857B-L865B 0.0674948990093114 Q885B-L902B 0.0671461846436205 E870B-Y880B 0.0668976461019138 A855B-L902B 0.066690365560838 I867B-L872B 0.0665128389159928 A841B-V879B 0.0663239276827694 A855B-L899B 0.0659853163197684 V836B-R844B 0.0657405841207905 A847B-A888B 0.0651298811987839 S891B-L899B 0.0648948462332886 A888B-L902B 0.0648739384270209 E859B-E870B 0.0641614072622337 K863B-L872B 0.0641392270860051 L864B-I887B 0.064134639719307 L872B-A888B 0.0641039391907114 R856B-A888B 0.0639701584995099 L846B-I884B 0.0633922205832922 K862B-S891B 0.0632763819602022 A842B-V850B 0.0631706287328235 Q885B-D892B 0.0624668777713574 E873B-A904B 0.0624498334831976 R844B-Q885B 0.0614512727123442 A888B-L903B 0.0609219361405218 I867B-V900B 0.0592742867828537 A842B-L881B 0.0589370342940598 L843B-A888B 0.0582544419444917 R839B-N871B 0.058201732235847 R844B-A855B 0.0579734674614367 G886B-V893B 0.057176855182826 R844B-E851B 0.0568883844437407 A841B-F878B 0.0567189400484507 E851B-L889B 0.055220092119086 S882B-K905B 0.0546491501755892 A855B-A883B 0.0542396387522437 S891B-I898B 0.0539263305081215 Q866B-E897B 0.0538682203480945 I867B-L903B 0.0536651605136833 R856B-I887B 0.052990705902479 Q866B-A904B 0.0524817893200011 Q861B-Q885B 0.0513688301518531 A855B-A888B 0.0511302617736753 A883B-L902B 0.0506835654259543 L881B-S908B 0.0506343563397931 E859B-L869B 0.0500268127425993 L872B-L881B 0.049037038814132 L846B-K863B 0.0489690542132739 P837B-S882B 0.0486751065856392 I887B-D892B 0.0485448054930773 A841B-V850B 0.0483358455368723 A840B-V879B 0.0483333291197496 A841B-L881B 0.0482196009017493 R856B-Q861B 0.0473356551032511 T838B-L846B 0.047017814467516 L846B-I867B 0.0469182771881336 A857B-Q866B 0.0466967428235838 I887B-E897B 0.0447539410541742 K863B-L902B 0.0446117517107956 A847B-Q861B 0.0444732153320468 H874B-Y880B 0.0435762687278347 D901B-S908B 0.0430783366615803 N871B-S908B 0.0426785339167191 R856B-L899B 0.0417824285248005 N871B-I887B 0.0416832093567452 H874B-A904B 0.0415576015386604 N871B-S882B 0.041518394872083 A840B-A883B 0.0408804051267735 S891B-D901B 0.0408480206462816 V900B-G909B 0.0403811460200454 K862B-Y880B 0.0401196998238733 R839B-R844B 0.0392361929710348 R848B-L858B 0.0385937767427604 A842B-F868B 0.0381822382018697 I867B-A883B 0.0380465220471287 L843B-L889B 0.0360364618642777 E854B-L889B 0.0356496850868995 N871B-F878B 0.035364802063196 V879B-K905B 0.0350575374803501 W849B-K862B 0.0346737237730702 T845B-Q885B 0.0346347132748341 V850B-K863B 0.0346167620317358 L872B-L899B 0.0340300396291831 K863B-V893B 0.0339867904150187 L858B-A883B 0.0337011516482923 A883B-L903B 0.0330974419383989 A855B-I898B 0.0330412426573021 Q861B-I884B 0.0323864390083908 L869B-L881B 0.0319961103735089 A883B-A904B 0.0314351066319638 V879B-G909B 0.0311297754914568 F868B-L890B 0.0310061688296859 R839B-R848B 0.0302867017364687 L869B-S908B 0.0293280385036855 R848B-E860B 0.0288589255372158 R856B-Q866B 0.0285872280210637 W849B-L889B 0.0284719109892455 E860B-L865B 0.0282592686821872 E870B-L903B 0.0280769500296223 A847B-S882B 0.0278638294891613 E870B-V900B 0.0278145037562421 I867B-K905B 0.0269373646422157 Y880B-L902B 0.0264821883550019 S882B-L890B 0.0264278044855283 E870B-K905B 0.0259711879886839 E854B-E860B 0.0247255904414185 K862B-V900B 0.0240379094213072 P837B-R844B 0.0239401378558528 A841B-G886B 0.0235713325348232 T845B-A855B 0.0226653640675818 R844B-I884B 0.0221954597637856 R848B-I887B 0.0221840200635937 R856B-D892B 0.0204619740613965 A857B-L902B 0.0188624562569064 A842B-Y880B 0.0169621847003985 D892B-E897B 0.0162588743527499 I867B-I884B 0.0162150559545609 L869B-G909B 0.0157855864577559 V836B-F878B 0.0156232712114112 Q866B-E873B 0.0155185858047848 Y880B-A888B 0.0143638015843006 Q861B-D901B 0.0139463806351792 R856B-I898B 0.0139096690683926 T845B-I887B 0.0138247709899622 Q861B-L889B 0.0126566898891998 H874B-I884B 0.0117961498472429 F868B-S882B 0.011466888449787 R856B-I867B 0.01011927848739 Y880B-K905B 0.00957820128570308 Q861B-V893B 0.00876731779540019 R844B-W849B 0.00852329092268 E873B-V900B 0.00776238658529138 A855B-L889B 0.00760006799008917 E860B-V879B 0.00722299681723371 L858B-F868B 0.0070679203239461 A841B-Q885B 0.00694856153573647 S882B-K910B 0.0067699637305294 L864B-E897B 0.00644593744237554 Q861B-V900B 0.00504214918443813 E851B-R856B 0.0048772695604784 Q885B-Y906B 0.00480858896738301 L858B-L902B 0.00462467889887463 L846B-L872B 0.00462467889887463 R856B-F868B 0.00417069086585231 L890B-E897B 0.00382496391538822 L843B-L881B 0.00148422720359509 K862B-Y906B 0.000938578394775291 R848B-Q861B 0.00036772947127206 L843B-E860B 0.000286269720831012 F878B-G886B 0.000191152237697167 V850B-Q885B 3.84446480585776e-05 R839B-Q885B -0.00117200263342276 L872B-V900B -0.00125439545858619 F868B-E873B -0.00141457160956193 L846B-F868B -0.00223066598673327 E860B-Y880B -0.00246733005743138 A857B-I887B -0.00518555449712998 L846B-V893B -0.00556222884663615 T845B-L889B -0.00744486350540363 F868B-S891B -0.0076921989629879 W849B-Y894B -0.00783059783393347 Q861B-L890B -0.00790844845653527 L865B-E897B -0.00792992474007281 E897B-L903B -0.00814101435817238 A842B-I887B -0.00915937924695243 A847B-F868B -0.00937619558072278 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