[Wed Aug 24 17:24:57 2016] >Input file: TM3P0GATD.pdb >TM segments: A31-55_A71-96_A104-129_A151-171_A198-221_A273-295_A307-326 MAIDEN score = -104.8588 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 ----------- ---------------- I47A-L80A 1.20875401662269 I201A-I294A 1.20243502897159 W286A-I314A 1.18099169958705 F71A-I127A 1.11893723599585 I278A-I325A 1.11030130970648 I43A-V317A 1.01392538045738 F289A-Y308A 1.01006690955872 V48A-D79A 0.953740845215064 F71A-V126A 0.949963808232422 V86A-W109A 0.940562383889307 I72A-Y326A 0.846169411903424 T118A-F208A 0.812600816169763 V48A-L80A 0.801468712862624 A85A-W109A 0.801381526051238 L115A-W158A 0.800960638918117 C285A-I314A 0.795209972565608 V86A-I112A 0.76796217384744 V129A-V218A 0.762575239237677 V292A-Y308A 0.747239682913908 V87A-Y316A 0.737789660788674 L115A-S161A 0.732453050298679 V48A-L84A 0.72609946857716 P288A-L311A 0.704873476228224 T123A-V157A 0.698218734621641 F208A-W286A 0.672684450474774 L115A-S165A 0.651946147316215 Y219A-L275A 0.628247138991877 V52A-L80A 0.622636517878401 F289A-G315A 0.613829154747255 S204A-I294A 0.613642082616815 T118A-S207A 0.610471746345199 F108A-Q170A 0.603548830352629 A119A-W158A 0.599056718802019 V52A-A76A 0.57707893083906 D79A-C116A 0.567121247002586 F282A-N318A 0.563630915858921 V33A-L95A 0.562618794857602 F289A-L311A 0.550528114290676 L75A-A119A 0.545216479911867 F89A-W109A 0.543614575677029 M82A-V87A 0.537768774018744 L115A-F166A 0.528996258608365 S161A-S207A 0.52441016236734 F208A-F290A 0.515466632485051 E107A-I169A 0.512571759018959 V48A-G320A 0.506793323931063 L124A-P211A 0.505835377610502 C125A-L212A 0.503726984925486 S120A-S319A 0.493218026605794 S111A-F166A 0.491635467634902 F108A-D113A 0.479530048937171 T110A-I169A 0.478357159786251 L75A-L124A 0.477647670854911 A128A-Y219A 0.469166355222365 I47A-V317A 0.466333939082009 C125A-P211A 0.463986567144853 V114A-T164A 0.45724061722295 F71A-T123A 0.451959443279633 I201A-N293A 0.450587204613951 I121A-F208A 0.450238567810156 A76A-N322A 0.444881019673083 A128A-M215A 0.440393265656831 A76A-P323A 0.438117201952692 V114A-S161A 0.434608762994525 L163A-P168A 0.433826098030855 M82A-S319A 0.433410230715344 M82A-I112A 0.432762294999767 F71A-I154A 0.431082806004187 I47A-G320A 0.420776666659973 C125A-I214A 0.419939426434532 A78A-V117A 0.419110738641386 I47A-M82A 0.416005430420173 Y199A-S204A 0.414546858036951 Q170A-Y199A 0.414239817237898 M40A-H93A 0.412447395372991 V44A-V87A 0.41205654211932 I55A-C77A 0.409752445317758 V54A-T73A 0.40809355747245 L80A-S319A 0.407266798326945 D79A-V117A 0.399259142371998 I72A-I127A 0.398317608503891 I47A-F321A 0.39795190709633 I205A-V210A 0.396168516579035 I112A-S165A 0.391334259148762 V54A-P323A 0.389982348970658 P288A-N312A 0.388299557302909 V44A-L84A 0.385953353543254 M215A-W286A 0.384730685768234 W32A-M96A 0.382512758187513 C285A-V317A 0.381641332146531 I277A-I325A 0.378566561877734 V44A-P88A 0.377964933522791 V81A-C116A 0.372666206164652 F289A-I314A 0.37184427017345 G90A-C106A 0.368853534911749 I43A-G83A 0.367118381139552 S204A-P288A 0.366454630589097 E122A-F208A 0.366028564331898 A85A-A92A 0.364017544168577 P288A-N293A 0.358619070948136 W286A-N318A 0.3537572921631 L75A-S120A 0.352121879493398 C77A-T118A 0.349800666629107 P211A-W286A 0.349424920426681 P288A-N318A 0.348961313189539 S204A-F290A 0.348841983486203 W286A-N312A 0.347716658818988 M82A-Y316A 0.347678117969172 S74A-P323A 0.342610683531725 L45A-G83A 0.341719123760435 L115A-T164A 0.341538626497767 S161A-P211A 0.340114642135922 V114A-S165A 0.338016381680582 G50A-C77A 0.335636030454999 V216A-M279A 0.335044546250054 I72A-T123A 0.334644182493864 S74A-A119A 0.333992699714984 I112A-F166A 0.331771258460602 V54A-M82A 0.331604785106438 S120A-P323A 0.323460381364332 C77A-I159A 0.322863184751283 V81A-V86A 0.322485171691132 I127A-M215A 0.321447210145811 D79A-L84A 0.321305459400116 G37A-L95A 0.320311043478598 C116A-I314A 0.319745658285587 S165A-A202A 0.319377439640034 M40A-A91A 0.316901717795081 W286A-G315A 0.316294422593767 S165A-A200A 0.314644343892509 I43A-G320A 0.312676306974323 G280A-G315A 0.310797365136261 V54A-A76A 0.309241944505608 T164A-V206A 0.308575178444458 S111A-Q170A 0.307535427044622 E122A-T164A 0.305184723522762 C125A-T283A 0.303361848479387 W313A-N318A 0.301190460568625 C77A-F321A 0.298974641997381 V129A-I214A 0.297323432213233 P88A-T110A 0.294016450367155 T123A-P323A 0.286602045602009 T73A-T123A 0.286311964329771 T73A-W158A 0.284927227424656 M40A-N312A 0.284726847967419 I55A-T73A 0.283440966006641 E107A-C116A 0.282983760048957 L212A-G280A 0.280422856227294 C125A-N322A 0.280315424525201 D113A-V317A 0.27973390359441 V87A-V317A 0.277104534831994 C77A-M82A 0.276354277902925 G90A-L310A 0.274954237925801 S111A-I169A 0.272125224022146 E122A-C285A 0.271447921915777 G276A-L284A 0.271126255907495 G50A-N318A 0.271062743758543 S120A-G320A 0.269141726697828 C116A-N318A 0.268976245551505 G83A-D113A 0.266048817680169 P88A-W313A 0.265220835969324 V44A-G83A 0.263189446390564 V117A-E122A 0.261981414530061 C116A-S161A 0.261002569299736 I55A-A76A 0.260677992691882 G162A-L167A 0.260235900217261 S203A-P211A 0.259958671214581 V87A-C106A 0.258284028370028 G162A-S203A 0.256566355804235 G276A-Y326A 0.25595835024011 A128A-R221A 0.255188737068674 S74A-T123A 0.255014382912991 N51A-S74A 0.253919593347783 C285A-L311A 0.253775117682538 W313A-G320A 0.253322793661823 D113A-Y316A 0.250275009744153 R221A-M279A 0.247488380720027 T118A-V206A 0.247045906986601 S207A-L212A 0.246955882128242 V292A-V307A 0.246715920362251 C125A-I277A 0.24610271519083 D79A-Y316A 0.246010369364749 V117A-S207A 0.243934983125774 L124A-T281A 0.242077258507959 T123A-L212A 0.242037282780174 L124A-T283A 0.241820266657447 A78A-C116A 0.240433750183032 F89A-C116A 0.239221120378981 F108A-F166A 0.238921986990388 I121A-P211A 0.238609925182509 G37A-A91A 0.238368859011653 V206A-P211A 0.237865647298128 H93A-W313A 0.237045623139798 A85A-D113A 0.237028401402371 M82A-D113A 0.23554774968862 A78A-Y316A 0.235319141322817 T123A-P211A 0.235179546892932 C77A-P323A 0.234655453519855 V129A-M215A 0.23408481305949 G280A-N322A 0.233984383864975 G35A-L42A 0.23380814138817 A46A-Y316A 0.23344832083616 D79A-F321A 0.232595188426778 V54A-I325A 0.232284518902533 V39A-Y316A 0.229341612994944 I277A-F282A 0.228263799109111 L45A-P323A 0.227737758371506 V87A-I314A 0.2254523033276 Y219A-K273A 0.223974387688666 Y199A-F290A 0.221832447422556 S41A-S319A 0.220632484341122 T118A-T164A 0.220439352522526 T164A-S207A 0.220437038300973 E122A-V206A 0.220152532106668 S111A-S204A 0.219231292334882 G50A-L75A 0.219047685275918 T123A-I154A 0.218946456199539 C125A-C285A 0.21841507986187 A76A-G83A 0.217690948834639 E122A-V210A 0.217522423867913 L124A-M215A 0.217276396674182 A119A-S203A 0.215215127478274 G83A-I112A 0.215107054176793 E122A-L212A 0.21505689204372 V44A-V86A 0.213919212236211 L284A-N318A 0.213666156962303 T118A-W286A 0.213547918097685 V54A-G320A 0.212879330137921 W109A-V114A 0.211475321579242 V216A-G276A 0.210375449347001 S120A-A128A 0.210120683768813 C116A-N312A 0.210058577653737 V44A-L80A 0.208305232916381 V48A-F321A 0.207919566675223 F71A-V152A 0.207640304298326 V210A-F217A 0.207319460915806 S111A-S120A 0.207100355446669 S319A-Y326A 0.206691397397416 D79A-A119A 0.205975995738163 M36A-V87A 0.204345603279243 C285A-G320A 0.202992082153074 L42A-M82A 0.202375116294803 L75A-M156A 0.20218900159242 L75A-N322A 0.201691423058568 S120A-S203A 0.201329348941367 V87A-G320A 0.200314167143397 H93A-T110A 0.199135071108688 M156A-V206A 0.198780931612578 P88A-G320A 0.198468706749072 C77A-V86A 0.19764488027873 G37A-I94A 0.197590954428589 V81A-G320A 0.19615812326397 T123A-I325A 0.195300626438157 D113A-G162A 0.194784181720758 C285A-L310A 0.194430124007971 C77A-Y326A 0.194012494880101 A76A-E122A 0.193586949261701 Y316A-P323A 0.193482781523739 T110A-I309A 0.193210932992552 C125A-W158A 0.192924069010047 G83A-W313A 0.190596297205103 L124A-V129A 0.188423843599725 V117A-Y316A 0.188279216576207 P288A-W313A 0.188188450063048 C77A-I112A 0.18752959446809 I43A-G315A 0.187450729353109 C116A-W286A 0.187347939181717 V206A-F290A 0.186148140221264 A91A-Y316A 0.185646440680703 N51A-F71A 0.185470431973623 S41A-M96A 0.185138628257778 S111A-N312A 0.185133514222207 S120A-Y326A 0.185113748125245 M279A-S319A 0.185008238893711 I55A-A78A 0.183911919437769 A200A-I291A 0.183684970242641 V126A-M279A 0.183238879577477 F282A-L287A 0.183200959631129 L53A-C77A 0.182451792751036 V114A-S207A 0.182300889457228 G315A-N322A 0.181606563783959 T123A-F208A 0.181576743928447 W32A-G37A 0.180611529739047 G83A-N322A 0.180431687472855 S203A-F208A 0.180167297082489 T73A-I121A 0.179948984856513 S41A-Y316A 0.179769117730562 V216A-F282A 0.179590988438565 F282A-N312A 0.179489754055136 L124A-P323A 0.178932319203 H93A-I309A 0.17891938585255 S220A-G276A 0.176504445786678 R151A-W158A 0.175794049779268 L42A-S319A 0.17560803789886 G90A-Y308A 0.174977451503406 C116A-V206A 0.17475399645496 G90A-G315A 0.174488087453388 P88A-S111A 0.174205034539122 G280A-Y326A 0.174085238362922 A200A-I294A 0.17369346002185 F208A-N312A 0.17339789269167 T123A-T164A 0.173231925084873 T73A-T118A 0.173019483127212 T123A-T281A 0.172541395225071 G162A-S207A 0.17177610089886 M36A-L95A 0.171649359084929 P88A-L95A 0.171373968054988 Y209A-V292A 0.17125044239308 I47A-S319A 0.171228508370582 F208A-G315A 0.170768509499307 S203A-N312A 0.170298661216055 L284A-S319A 0.170036490176635 L42A-P88A 0.169904791484788 H93A-F104A 0.168914736339153 A76A-T118A 0.16847639167135 G50A-L324A 0.168330054893552 M40A-G315A 0.167609056037332 G37A-H93A 0.167589196918736 C77A-L115A 0.167200631419961 V129A-M279A 0.166443000771854 L115A-P168A 0.166177060047676 C116A-G320A 0.166036164357656 C116A-W313A 0.16519935398287 T73A-I325A 0.164880556916385 Y209A-C285A 0.164344368447267 I291A-N312A 0.163357434643885 S207A-V213A 0.162943882059171 C125A-G280A 0.162063536928275 C77A-I121A 0.161845635547826 S207A-N318A 0.159070139989992 V117A-S161A 0.158890321404018 S220A-K273A 0.158200883600626 S165A-F208A 0.158091231518624 E107A-P168A 0.157775539994008 I94A-I309A 0.156724052602946 E107A-V114A 0.156166776300134 E122A-V157A 0.156109156737547 P211A-G280A 0.156083548450195 A91A-I309A 0.155980451166976 A128A-V210A 0.155933021329587 S41A-A91A 0.155780603692602 L53A-G320A 0.155403377509778 I47A-I325A 0.154830592493529 Y199A-S207A 0.15409155390255 F89A-E107A 0.153839667672821 S207A-F282A 0.15381887424388 S111A-Y199A 0.153450477640233 T123A-T283A 0.152963441146174 T164A-I169A 0.152892675772738 I205A-M215A 0.152861978821966 I277A-C285A 0.152139764225795 G280A-G320A 0.151243187137311 V206A-I214A 0.150380309295587 A128A-I277A 0.149975368708058 A78A-I159A 0.149746948486951 I43A-A85A 0.149519569609992 A128A-I153A 0.149208250555118 S120A-Y209A 0.149172414764617 W105A-D113A 0.148579569815471 V86A-S319A 0.148397888282753 V117A-S319A 0.147750517203511 Y199A-Y209A 0.14732311671965 V216A-R221A 0.147237772938362 S74A-V152A 0.146214538056686 E122A-V160A 0.146186384995746 V48A-V81A 0.146115715601544 A78A-G320A 0.145794817537044 E122A-V213A 0.145473909591684 V48A-S319A 0.14512232227368 Y199A-F208A 0.145074042518335 A119A-V210A 0.144213027183056 T118A-T283A 0.143795801858089 S120A-V317A 0.14337975362152 L80A-P88A 0.143177152845624 Y209A-M279A 0.143049797836488 S41A-V317A 0.142965258372495 D79A-N312A 0.142939425927034 G83A-P88A 0.142841022382552 V126A-V160A 0.142698497974682 V129A-S220A 0.142476761380511 I127A-V157A 0.142244937515652 F282A-F321A 0.142126330184984 S207A-N293A 0.142070864313471 A202A-F290A 0.14129594227718 C77A-G83A 0.141183975393938 V160A-S207A 0.14062106386012 C125A-G276A 0.14037388003785 C125A-S161A 0.139862456736582 F282A-G320A 0.139555762685773 I121A-Y326A 0.139317808728959 E122A-W158A 0.13847119117376 V39A-A92A 0.138393156758503 T123A-L155A 0.138033450632268 M82A-S165A 0.137819059513055 I72A-I278A 0.137011352634778 V126A-S207A 0.136803870376255 M215A-Y326A 0.13678278176422 S41A-V87A 0.136590985179199 S204A-V295A 0.136344717438845 L212A-P288A 0.136118482757654 N293A-I309A 0.135906196770615 C116A-C285A 0.135883524145232 G280A-F321A 0.135668494190039 L124A-W158A 0.135576206550732 L75A-G83A 0.134807684417745 N293A-Y308A 0.134386209477659 I291A-L310A 0.134275510692698 M36A-I314A 0.13416019633349 C116A-L155A 0.134120958604663 L53A-I325A 0.134074174120907 M82A-N322A 0.134036099098961 M156A-S165A 0.133533091459922 L275A-L324A 0.133305530122738 C116A-L163A 0.131613585634123 S111A-V160A 0.131408322410659 W158A-S207A 0.131298043385571 N51A-L80A 0.131232953444581 E122A-S161A 0.131181963757484 F166A-S207A 0.130716363249224 I47A-N318A 0.130666913472847 N318A-Y326A 0.130273385448489 T274A-T283A 0.130261714193158 L75A-Y316A 0.13018789365181 I278A-N318A 0.130146500761384 T73A-L124A 0.12985094696889 A78A-V317A 0.129710395215118 C116A-S204A 0.129682832376201 Y316A-N322A 0.129571133322667 C116A-M156A 0.129278860581064 N51A-S120A 0.129139976235361 I214A-T283A 0.128359926092544 N293A-L310A 0.12806732350291 D113A-N312A 0.127642374167423 S120A-I154A 0.127409093138903 E122A-N318A 0.127108268959524 S204A-N293A 0.126776235776136 T283A-I325A 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