[Mon Aug 29 17:52:15 2016] >Input file: TMQ8BXQ3S3G.pdb >TM segments: A60-117 MAIDEN score = 55.7558 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 ----------- ---------------- H75A-L98A 10 W76A-N100A 10 S89A-L112A 10 V65A-L88A 6.82547053977709 T90A-V114A 1.46422586342647 H75A-N100A 1.29091654491023 L67A-L91A 1.25929508558991 I74A-L98A 1.20373025609799 W76A-L98A 1.17011151950495 L93A-V117A 1.14252189805895 A79A-E104A 0.962510173937365 L69A-L93A 0.961945647389167 L88A-L112A 0.928521517366601 H75A-N96A 0.925374896492089 L77A-L101A 0.919760522742564 S94A-V117A 0.910498221175517 W63A-V85A 0.887463770073249 W63A-L87A 0.871106778580482 L91A-L115A 0.851973337201417 T66A-L91A 0.834397491987421 L68A-L91A 0.820880252885757 L88A-L109A 0.804388388229899 L67A-T90A 0.804074035198673 L68A-N92A 0.801774519002226 T64A-L87A 0.798735694764359 D71A-L93A 0.796399933003778 W76A-L101A 0.766823283066964 F82A-F106A 0.737023591010782 P78A-L101A 0.735667055989941 Q70A-L93A 0.726234577253988 L68A-L93A 0.718913804786526 V85A-G108A 0.683806397356064 L80A-A105A 0.630255666438064 T90A-L112A 0.619422964715806 L88A-R113A 0.616299012514426 V65A-L87A 0.612921532952389 V85A-L109A 0.610930156276272 L88A-H111A 0.606204533707967 N95A-V117A 0.604063339769751 L87A-P110A 0.595791065761875 P78A-A105A 0.578437623120532 P62A-L87A 0.572514753511186 L69A-S94A 0.562742789965307 R73A-L98A 0.560327633154408 L87A-H111A 0.55500582905449 L91A-V114A 0.55477798995974 F82A-A105A 0.553851487768176 Q83A-L109A 0.543975416093685 S86A-G108A 0.533899316238707 L88A-P110A 0.522242550400043 T90A-L115A 0.520409012709036 W63A-L88A 0.48933898035759 P62A-V85A 0.469031489563605 L91A-R113A 0.46298930888317 F82A-L109A 0.432400048737136 L77A-A105A 0.430910644970644 L60A-V85A 0.40083569078918 S84A-H111A 0.39317279900259 P78A-N100A 0.388584913765189 S89A-L109A 0.37197815978166 A81A-A105A 0.364435282138155 S86A-L109A 0.360363828631998 W63A-S86A 0.353371618943953 E104A-P110A 0.352481943107934 L67A-L88A 0.34412774965008 L77A-A102A 0.338394368418167 L87A-L109A 0.334523218858575 D71A-V117A 0.329458601499882 N92A-V117A 0.323890185673593 N92A-V114A 0.323327144801221 P62A-S89A 0.319335224736235 H75A-S94A 0.316175728248483 L77A-L98A 0.310867857681906 W76A-A102A 0.308482470352747 V65A-V85A 0.306425999774468 P61A-V85A 0.298973092635149 L91A-L112A 0.296943733252199 L87A-L112A 0.294868785029506 T64A-P110A 0.293893799368852 P62A-S86A 0.284666717470083 F82A-G108A 0.284139341601773 W76A-S97A 0.283206847014282 V65A-T90A 0.282445295666287 T64A-V85A 0.281615547518363 P61A-Q83A 0.274952788480464 Q83A-E104A 0.27241341000121 R73A-N100A 0.267064027404317 N72A-N95A 0.266280972185251 T66A-T90A 0.253944537115403 S94A-L115A 0.251755349483298 A103A-G108A 0.241783843941946 Y107A-V114A 0.239500976540374 T66A-L93A 0.238133973770904 T64A-L112A 0.233360207721562 T66A-L109A 0.233030829608305 L69A-L91A 0.22646941442797 Q70A-N96A 0.226295919809441 I74A-V117A 0.222781269696037 L60A-T66A 0.221711403985867 A81A-S86A 0.217662661260538 A79A-S84A 0.215235632596753 Q70A-N116A 0.212387887701044 P78A-S84A 0.211135075497818 L88A-V114A 0.209446483931982 P62A-Q83A 0.205738055858363 W63A-T90A 0.205735986897904 L93A-L115A 0.198642932934128 A79A-A105A 0.198555622161689 D71A-N92A 0.19820795451298 F82A-A102A 0.198123634586962 N96A-L101A 0.19610650810699 P78A-Q83A 0.19531853691721 T66A-N116A 0.195045563055524 S84A-Y107A 0.19190830437332 L93A-N100A 0.187334845958116 S84A-A105A 0.185921974027018 L77A-N92A 0.183368410950577 T64A-F82A 0.181773337195856 F106A-V114A 0.178603568617629 E104A-L109A 0.171917636041255 L67A-S84A 0.165138858946232 L91A-N96A 0.162087741785823 L69A-N96A 0.157798396906295 V85A-L112A 0.155594230367386 R73A-N92A 0.154956052914596 L67A-N72A 0.152575298821125 S89A-G108A 0.151735959450317 A79A-A103A 0.151037165690968 S86A-R113A 0.150212950630261 N72A-N116A 0.148946145462247 P78A-L98A 0.148535309991116 P62A-L109A 0.148035169315389 S89A-Y107A 0.146387546904175 L67A-N92A 0.144762941859969 T66A-S86A 0.140396742939372 V65A-S84A 0.140258630330718 N95A-L115A 0.139126471897844 N72A-L93A 0.137960211181948 G108A-R113A 0.134256399167318 S89A-V114A 0.132422675076888 L77A-V117A 0.129756132952355 S84A-L112A 0.128878660549054 L68A-V117A 0.127774223397321 L98A-L115A 0.12375007280021 H75A-N95A 0.123358470644444 A105A-P110A 0.121823721672483 I74A-N95A 0.121152973618146 L91A-N116A 0.119282997505027 Q83A-L112A 0.118277373907195 A79A-S99A 0.118082093627987 L77A-L115A 0.117843019078758 N95A-N100A 0.117779597266136 L60A-S86A 0.11586794322508 L68A-S89A 0.115463349933547 L67A-S94A 0.115273225750347 L77A-L109A 0.114869880155158 L80A-V85A 0.113877585087148 S94A-V114A 0.113517122623202 L69A-L115A 0.113146585145347 N72A-L77A 0.112828239079812 L60A-L87A 0.112784394190893 L101A-L115A 0.112613952121805 L69A-L88A 0.112481060795895 W76A-A103A 0.112079770066621 L88A-N116A 0.111604174275069 L60A-L91A 0.111066185351919 A103A-L115A 0.109691817934675 S97A-A102A 0.108285442910281 N92A-L115A 0.107829271768682 A81A-L87A 0.107719381468718 F82A-N92A 0.106506490259993 W76A-N96A 0.106034309165576 I74A-N96A 0.104462106941918 N92A-L109A 0.102048279175275 I74A-S99A 0.100090495667147 P62A-L67A 0.0996368421883513 L112A-V117A 0.0985971326812989 L69A-S97A 0.0981957336703174 L69A-L98A 0.0964532709226384 N100A-N116A 0.0958392578522167 T64A-T90A 0.0956527691585176 L68A-L77A 0.0936302778761759 Q70A-L77A 0.0927927731202496 L60A-L109A 0.0924532987572895 L69A-V114A 0.092148544144103 S86A-A105A 0.0912668545783495 I74A-L91A 0.0901625236586403 L93A-L112A 0.0896571895952083 L68A-L109A 0.0892110605189713 T90A-Y107A 0.0879825114048743 T64A-H111A 0.087124341736371 L68A-L112A 0.0868776258648787 L88A-L93A 0.0860201411930515 T66A-G108A 0.0857159172247908 T66A-S94A 0.0854873556327672 T66A-H111A 0.0853661874088691 T66A-S84A 0.0853014375874134 L68A-R73A 0.0849136194733831 T64A-L109A 0.0832456930082248 L68A-V85A 0.0822968470068326 I74A-A81A 0.0819755421615653 A81A-L88A 0.0819086764466843 L80A-A103A 0.0817681859739485 A79A-N100A 0.0806214683076685 F106A-L115A 0.0772455658507907 V65A-G108A 0.0762774907238672 R73A-S99A 0.0747995352782596 Q70A-H75A 0.0737489433028817 S84A-G108A 0.0730413577229947 H75A-V117A 0.0705647152976638 Q70A-L91A 0.069395219371442 L67A-L109A 0.0691669546684617 T90A-V117A 0.0680927488960591 T66A-L88A 0.067946552397391 A79A-P110A 0.0673670016905721 L98A-A105A 0.0671562073841505 V65A-H111A 0.0668589574412968 Q83A-S89A 0.0664876032713329 I74A-F82A 0.0655750302379303 F82A-N100A 0.0643277380269618 L67A-I74A 0.0640123911614623 R73A-A81A 0.0638640272927292 L77A-G108A 0.0637506359663771 L69A-F106A 0.0631486305027673 A103A-L109A 0.0630444857148449 T90A-F106A 0.0621242561559292 N92A-S97A 0.0588807819938131 L91A-G108A 0.058039490239187 V65A-N92A 0.0569524542058109 Q83A-H111A 0.0547625621022654 D71A-S99A 0.0544268799885248 L60A-F82A 0.0538321438386546 L93A-A105A 0.0531947515936437 P62A-P110A 0.0520514681798687 W76A-E104A 0.0518407015212019 W63A-H111A 0.0518332331364455 T66A-P110A 0.0512760267025048 W76A-S94A 0.051231037456569 L88A-A105A 0.0510279721561009 L87A-L115A 0.0509512712184552 L91A-A105A 0.0504404244742709 A81A-N100A 0.0500660934915276 V65A-Q83A 0.049126879377221 L93A-A102A 0.0482196009017493 L68A-L98A 0.0477838595788684 W63A-L112A 0.0473830088705274 L91A-L109A 0.0471721705208933 L60A-L67A 0.0470602288738748 H75A-A81A 0.0463148396828722 L68A-F106A 0.0461280744077461 N96A-V117A 0.0460740185640809 L77A-E104A 0.0460420998697941 R73A-S94A 0.0455277620475123 N100A-V117A 0.0453404933279691 E104A-H111A 0.045133658976884 S99A-N116A 0.0444930363130469 L88A-Y107A 0.0444390380589592 L80A-G108A 0.0431947251710794 L93A-L101A 0.041519355913163 Q83A-T90A 0.0411316631699114 L60A-L80A 0.0397967829107264 A81A-L93A 0.0397132894501748 T64A-R113A 0.039157492420631 S97A-N116A 0.0389361995538446 F82A-L88A 0.0388256409950758 L69A-H75A 0.0382205424566627 A81A-Y107A 0.0374609785788387 T64A-F106A 0.0364495791955521 L69A-A81A 0.0360312525326352 L80A-P110A 0.0355921446565208 L80A-L101A 0.0355375702946494 V65A-S89A 0.03533913520711 P61A-F82A 0.0346064718841306 L67A-S86A 0.0339772516915731 S86A-L91A 0.0337747459664308 A81A-L98A 0.0332369619608614 N100A-F106A 0.0327891103239946 L93A-S99A 0.0327314467504817 N92A-L98A 0.0326253244241794 L69A-N95A 0.032608780450456 A103A-P110A 0.032149943480368 V85A-R113A 0.0313837765334101 Q70A-T90A 0.0313163199300073 R73A-V117A 0.0312577443211541 L87A-F106A 0.0305420734489896 L60A-S84A 0.0298538623211027 L80A-L109A 0.029573847819095 H75A-A102A 0.0295199540652411 F106A-R113A 0.0293790438068373 F82A-L93A 0.0287834376051537 D71A-N116A 0.0281391702291525 T90A-A105A 0.0279935983695774 L77A-N100A 0.0267091272880808 T66A-Q83A 0.0248294387574539 A81A-T90A 0.0247445394997636 N92A-R113A 0.0229296037018356 W76A-S99A 0.0226493866517394 N72A-N92A 0.021163527739476 E104A-L112A 0.0210771194284418 F82A-L112A 0.0204057385677467 N96A-N116A 0.0203615769762834 L101A-G108A 0.020240730783887 L69A-W76A 0.0201919146980654 V85A-H111A 0.0195546715095354 L77A-S94A 0.019398843255571 W63A-L91A 0.0172822749954866 L80A-E104A 0.0163752434411233 S84A-S89A 0.0161339257612885 A79A-A102A 0.015282776346754 S89A-N116A 0.014780054071421 L67A-V117A 0.0146087196929221 F82A-N116A 0.0130950095501889 T64A-S86A 0.0124622793068809 L77A-V85A 0.0123013716146039 T66A-F82A 0.0122975238963123 F82A-L87A 0.0119742155626454 A81A-A103A 0.0117816047585428 S94A-N100A 0.0117030988686178 L91A-Y107A 0.0112660180010105 L67A-H111A 0.0107142962478439 P62A-L80A 0.0102561393336558 I74A-S97A 0.00896046644149173 A81A-L115A 0.00890841252129349 I74A-N92A 0.00859663606493122 V65A-L115A 0.00517896150556041 V65A-F82A 0.0047587680982949 F82A-S89A 0.00471031214126727 L80A-F106A 0.00299977488825309 T64A-L115A 0.00273095978291094 W63A-P110A 0.00179824047463839 L68A-S97A -0.000806715402513081 A105A-V114A -0.00120375496636438 L69A-F82A -0.00141246871590539 H75A-L80A -0.00156890228130813 P61A-A81A -0.00233569673527634 L77A-N116A -0.00306274898169256 L68A-F82A -0.00357105241890476 Q83A-A102A -0.00403967590533161 A81A-N92A -0.00446249110817017 P78A-V117A -0.00568247338072903 W76A-V117A -0.00592974125620005 A102A-G108A -0.00635528202696634 S86A-E104A -0.00640078642458608 N72A-S99A -0.00647969005043691 S84A-E104A -0.00821350237681368 V65A-P110A -0.00861379596317002 D71A-L91A -0.0106921779708435 L60A-L68A -0.0110969398589749 W76A-N95A -0.0117981892302979 P78A-G108A -0.0124835247476012 P78A-V85A -0.0126553717352311 N72A-S97A -0.0145422719461523 F82A-T90A -0.0168801843719717 L98A-A103A -0.0184379577254079 L68A-T90A -0.0191158480508395 I74A-A102A -0.0192459796911744 A79A-L109A -0.0200693788026829 S86A-L112A -0.0207075848204408 P62A-G108A -0.0216970026984146 V85A-A105A -0.0220055109624449 A79A-V85A -0.0226594259643678 P62A-A81A -0.0244796027443128 S84A-L109A -0.0246037152738303 A105A-V117A -0.0251024501034524 L60A-Q83A -0.0253298412961698 P62A-H111A -0.025427307213798 W76A-L91A -0.0254992314289257 S99A-A105A -0.0297849959521921 V85A-N92A -0.0302152864887817 D71A-L98A -0.0312253938102645 A102A-V117A -0.0313356081955387 L68A-N96A 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E104A-L115A -0.0558421217836274 A105A-N116A -0.0568011342911927 A102A-L109A -0.0585060666475652 S86A-Y107A -0.0603348129334559 L69A-T90A -0.0604992421305734 L98A-N116A -0.0608084488389504 P61A-S86A -0.0620721864061817 N92A-L101A -0.0624353514884833 A105A-L115A -0.0628815605575954 L87A-Y107A -0.0635264738477881 L67A-R113A -0.0638037565853535 L101A-F106A -0.0639745719225653 L67A-F106A -0.06536004989941 T64A-L69A -0.0656419821559586 A102A-Y107A -0.0664213674409426 L69A-V85A -0.066504239910004 L93A-R113A -0.0673362814891814 P78A-L109A -0.0677634835578944 Q83A-L101A -0.0679594068115956 N72A-V117A -0.0680382382285525 Q83A-L91A -0.0680385873016704 L93A-N116A -0.0686245496555689 L87A-N92A -0.068907509205403 V65A-L93A -0.0694802365701515 L101A-Y107A -0.0699600729674761 A81A-P110A -0.0713307545902646 N92A-A105A -0.0718464869025892 T64A-G108A -0.0721054488290087 N100A-A105A -0.0723646820828607 I74A-L101A -0.0784522771342615 R73A-P78A -0.079083884029183 W76A-L93A -0.0792439521231501 Q70A-S97A 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