[Wed Aug 24 18:09:43 2016] >Input file: TM2QKSATD.pdb >TM segments: A46-72_A74-121 MAIDEN score = -18.3808 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 ----------- ---------------- Q101A-H106A 1.70121440026081 I71A-M98A 1.50498044493379 P70A-Q101A 1.28242935767742 I71A-P100A 1.18725034191831 E88A-V93A 1.14081157150288 L90A-I113A 1.13148639488334 F85A-H99A 0.963959598997934 Y64A-I108A 0.887782483957684 A72A-D97A 0.861330816993008 A72A-M98A 0.830248829861715 T62A-F79A 0.826101984670817 M65A-F79A 0.720752380044839 A72A-P100A 0.685092106617105 A61A-F79A 0.669320334283483 F75A-G80A 0.619132178012615 L90A-M117A 0.616681755218267 M65A-A82A 0.615025249108006 F75A-A82A 0.600227564782488 A61A-F85A 0.599782506813505 F60A-S86A 0.581861330470537 G67A-Y104A 0.579161862620458 P100A-A109A 0.570674004074857 T58A-F83A 0.562458185627973 F60A-E112A 0.560943575159901 A91A-M117A 0.54924287214634 F85A-M98A 0.541223416040157 N57A-L90A 0.51498126220784 F85A-D97A 0.508234138294408 I71A-A105A 0.50237163789289 T62A-A82A 0.48687973689418 P100A-E112A 0.482207627739736 P70A-P100A 0.481399978874103 E88A-P100A 0.480122760939202 I71A-T102A 0.478976379393188 P100A-H106A 0.463405919982329 L63A-I108A 0.460681384522161 F60A-F83A 0.441847192552454 M65A-I71A 0.411853753337846 L90A-V115A 0.410488638650577 I71A-F85A 0.406704279694418 Q74A-H99A 0.405976949119523 M98A-H106A 0.403569205608775 A69A-T102A 0.383387263982663 A91A-A109A 0.379221054503521 T89A-T110A 0.375773037049324 T92A-G116A 0.374282393521864 M65A-P70A 0.360748140995792 A91A-A121A 0.350756177146023 T92A-M117A 0.347425425634515 T58A-E112A 0.341813554883553 Q74A-F85A 0.340438629187213 T89A-G116A 0.331821353107976 Y64A-I71A 0.325972527739396 A69A-Q74A 0.311482527962838 G96A-H106A 0.311442212987068 S86A-H106A 0.31125351723619 F75A-D97A 0.309547756904896 S68A-A82A 0.306072237678419 F60A-I108A 0.305931391785187 G81A-G96A 0.303815919153646 M65A-G78A 0.300036563750214 S86A-G96A 0.297051184329785 L52A-G116A 0.290413291888823 I71A-H99A 0.287687652582815 T89A-A109A 0.281519946687847 T89A-I113A 0.279938793427153 A61A-F84A 0.279737510014442 V87A-D97A 0.275352740597852 Y64A-P70A 0.27443106995514 M65A-Q101A 0.272786745521029 Q74A-A82A 0.269424039988297 M65A-Q74A 0.267046480717163 F60A-A82A 0.26604994204944 F83A-E112A 0.2635231176124 T92A-I113A 0.25279216955496 G67A-W107A 0.251735853618936 G78A-F85A 0.250574144834566 S86A-Y95A 0.250415019273799 A91A-I120A 0.247821837172484 Q74A-E88A 0.246862933527512 M98A-V103A 0.243707786463879 Q74A-T102A 0.23621982336632 N57A-F84A 0.235886979941808 T62A-E112A 0.235132006719822 A61A-A82A 0.233175468959464 A69A-Q101A 0.22741181431078 L56A-T89A 0.227223641799743 A69A-F75A 0.226607538549848 G94A-H106A 0.224212917714359 I71A-Q101A 0.222885333535279 F85A-Q101A 0.222124374224485 A69A-F79A 0.221466678540573 M65A-W107A 0.219332448356854 F84A-G96A 0.219178733662988 A82A-A109A 0.217701520491657 W107A-E112A 0.214092800659781 F75A-E88A 0.213789367644702 Q101A-T110A 0.212912380076979 T58A-G78A 0.211855067970045 T62A-T89A 0.211736184916833 T92A-H99A 0.209383354281647 G81A-Y95A 0.209045378322585 F53A-V115A 0.206424635575706 P70A-S86A 0.205332269600762 T58A-L90A 0.204851098597791 S86A-V115A 0.200897070412184 T89A-W107A 0.199004005291019 F84A-V93A 0.196442666289915 T58A-I108A 0.192103881707888 T62A-A69A 0.190735914163235 P70A-T110A 0.189321111208445 L90A-M98A 0.187831808148001 S68A-M98A 0.18683359034899 F60A-T110A 0.182403116423863 Y64A-P76A 0.180551574173311 I71A-A82A 0.179834945831537 A59A-I108A 0.179428286241668 V87A-V93A 0.178963218794088 L90A-G96A 0.176301335554913 Y104A-E112A 0.176287872112713 G94A-G116A 0.17569761855685 G94A-M117A 0.174990543504801 T89A-D97A 0.1722348341235 A82A-E112A 0.17210497301692 L56A-V115A 0.166688065984738 F79A-H99A 0.164765000878222 S86A-S119A 0.164249311598905 L63A-G80A 0.163502511385509 P76A-S86A 0.162008452014959 S68A-P76A 0.161694761256921 N57A-L111A 0.160973841300732 Y64A-A105A 0.159418557093443 A69A-G81A 0.158655099258441 H99A-T110A 0.15856029892238 P76A-D97A 0.158224319427502 S86A-A109A 0.156702892310873 G67A-G80A 0.155505990235594 T89A-P100A 0.151745725551477 H99A-E112A 0.150570356362349 A61A-I113A 0.150095489136167 L49A-G116A 0.14708527936889 G67A-Q74A 0.146358407038171 G67A-H106A 0.146247862001794 I71A-I108A 0.143557866096833 N57A-S119A 0.143433758754658 M98A-A105A 0.143055587125447 Q74A-Y95A 0.141473625407737 A77A-F85A 0.141098808400999 Y64A-I113A 0.141008551344655 Y64A-F75A 0.14053908251964 G78A-M98A 0.140145282345052 S86A-T110A 0.139349150825857 I71A-T110A 0.137874158551062 H99A-I108A 0.137727690314499 F60A-F85A 0.137463574881742 V51A-V87A 0.136039073237494 G94A-T110A 0.135948616431185 F75A-M98A 0.135485406580767 V51A-S119A 0.134820087635915 F53A-E112A 0.134107533623212 S68A-H106A 0.134029624196246 L56A-E112A 0.133980271930715 T62A-A77A 0.133602809727492 G67A-P100A 0.132246056394901 A59A-T89A 0.131649060327684 N57A-G81A 0.130573453294824 L54A-I120A 0.130565070361523 T92A-S118A 0.128365199694019 F60A-G81A 0.127720236398743 L63A-I113A 0.127371255622013 M65A-F83A 0.127189804311872 A72A-Y104A 0.126782660467081 G67A-T110A 0.12621630946017 S48A-L56A 0.124925498465525 T92A-S119A 0.124348571725774 G67A-G78A 0.123940417485109 V87A-S119A 0.122208357631783 A91A-I113A 0.121624976619623 H99A-Y104A 0.121279177526329 A61A-P100A 0.121262315447963 Y64A-H99A 0.120893562567181 A77A-M98A 0.120414302961361 G80A-E88A 0.120400011823785 F60A-G80A 0.12036448435855 A61A-H99A 0.120183047652571 G67A-F79A 0.120114723026331 Y64A-L90A 0.120100432818832 G81A-T89A 0.120025708139502 F60A-G67A 0.119471519447314 S68A-A109A 0.117016198259306 A69A-M98A 0.115588836193695 Q74A-F79A 0.115322543885059 A69A-S86A 0.115321396860628 A59A-L66A 0.114384482134666 T89A-S118A 0.114261228977268 A61A-S68A 0.114075337402287 F53A-F83A 0.113147732988959 N57A-I113A 0.112678713436734 M98A-Y104A 0.111837681369751 L63A-H106A 0.111102609332119 T62A-F85A 0.110420654513143 A50A-S86A 0.110255041300892 D97A-H106A 0.110132714514449 L90A-A109A 0.108720469606521 F75A-F83A 0.107879847984672 L52A-L90A 0.107507796074458 A72A-G94A 0.1067423739792 A82A-G96A 0.10646786144748 A91A-G96A 0.106281048897775 S86A-L111A 0.105606740353076 G67A-A82A 0.105359326876649 P70A-A77A 0.105035666200294 A91A-G116A 0.104317399055608 Y64A-A82A 0.104028197810568 L66A-V103A 0.103790960204476 L54A-S119A 0.103278771515156 S86A-E112A 0.101807858510585 G94A-P100A 0.101557277078582 A69A-P76A 0.101422795750813 A77A-P100A 0.100967561208688 V87A-A105A 0.100502315162144 A91A-E112A 0.100246884455213 P70A-G78A 0.100113497226725 A50A-F84A 0.0999738621846133 V87A-M117A 0.099492282372573 A61A-F83A 0.0994186976707869 A59A-F114A 0.0991747691411415 T58A-G81A 0.0990644923991305 L63A-L90A 0.0980842880650044 V87A-L111A 0.0974313582631805 A109A-S119A 0.0970766685024942 L55A-V115A 0.0963052738719519 H99A-W107A 0.0962874432688638 V93A-A109A 0.0955050231604253 L49A-L90A 0.0948915314681922 P70A-G81A 0.094477023084339 A50A-L90A 0.094320435625487 L63A-V103A 0.0927053140102119 I71A-L90A 0.0923852314461779 T89A-Y104A 0.0922813854921021 A61A-P76A 0.0922643598648802 A82A-Q101A 0.0920415010357423 T89A-H106A 0.0917970504803569 G67A-A72A 0.0908129222159069 Q74A-M98A 0.0905683772084829 N57A-T110A 0.0905123151872931 L49A-A91A 0.0904634730499096 L54A-A82A 0.0901501907444002 V51A-A91A 0.0897928528340044 G78A-A105A 0.0894509615575192 A69A-H99A 0.0889901929886978 L63A-P100A 0.0883779218643301 F85A-G116A 0.0874247942868429 Y64A-S86A 0.087113304873002 A59A-G116A 0.0869587637842817 Y64A-F84A 0.0849831495338496 L49A-A121A 0.0849611087822417 L90A-W107A 0.0846359818266791 L66A-Q74A 0.0843397115952831 A61A-A91A 0.0838976861950336 N57A-F114A 0.083866770228747 Y64A-V103A 0.0838187445519307 F75A-G96A 0.0835044651270653 Y64A-A72A 0.0832699862044328 M65A-P76A 0.0826182774426982 A59A-F84A 0.0825661685823622 A72A-S86A 0.080300702170101 T58A-E88A 0.0802084266180776 A59A-G81A 0.0797808630384154 N57A-A109A 0.079585422918111 Q74A-V87A 0.0793357470992997 L54A-F79A 0.0790017503111886 V87A-G94A 0.0788686062361776 I71A-E88A 0.0784787887202616 L63A-V87A 0.0780053117978003 L56A-A109A 0.0779524493561983 F53A-A82A 0.0777945051048734 V93A-I120A 0.0766678871571713 S68A-H99A 0.0765464063723173 F60A-L111A 0.0764391656829966 L66A-G78A 0.0758447662703627 A50A-A91A 0.075095477457932 M65A-T102A 0.0747538516751336 L52A-N57A 0.0745725630839367 S86A-Q101A 0.0742784738474498 L55A-L90A 0.0740978383951836 P70A-W107A 0.0740153279287972 A72A-V103A 0.0736715843088618 S68A-A77A 0.0735459529763585 I71A-W107A 0.0734380172051188 Q74A-A105A 0.0732561106693024 L52A-A91A 0.0732271468146219 A61A-Y104A 0.0729395132125039 M65A-A72A 0.0717658105621732 G67A-S86A 0.0695916826581304 A50A-S119A 0.06829967472083 P70A-L111A 0.0679496043410852 G94A-Q101A 0.0675863170937623 P70A-D97A 0.066874085436111 F53A-T92A 0.0668566938826434 N57A-V115A 0.0667341912657529 L90A-I120A 0.0666145110469216 P70A-G96A 0.0664432933557451 A50A-F83A 0.0663776861024186 F75A-T89A 0.0660099897011108 L90A-A105A 0.0658585865311034 F85A-T110A 0.0643799999131445 A69A-V103A 0.0643394466499356 S48A-N57A 0.0640394976414882 Y95A-I113A 0.0635046207529424 A91A-L111A 0.0632868419873853 N57A-G80A 0.0622550267279502 G81A-H99A 0.0621524889904697 E88A-T110A 0.0620723997175006 A61A-A69A 0.0616049287022256 F83A-E88A 0.0614112236509579 F83A-G94A 0.0605644804630612 G94A-E112A 0.0602166687938956 F53A-A121A 0.0592896763762978 P70A-H99A 0.0589162670292673 T89A-S119A 0.0583285659232899 A61A-G67A 0.0581462416914054 M65A-M98A 0.0579504351440514 A82A-G94A 0.0577584009623102 T110A-S118A 0.0575931978023734 F83A-D97A 0.0573752053611196 V87A-P100A 0.0570652094347652 A59A-A109A 0.0565126901703072 A82A-H106A 0.0564206662517428 P70A-G80A 0.0559820696567535 F83A-I108A 0.0558059365171538 N57A-F79A 0.0557394498139367 I71A-G94A 0.0548201736158749 L54A-A91A 0.0540048042634109 L55A-A91A 0.0539261291172817 G81A-E88A 0.053718762507966 H106A-G116A 0.0533337877745916 T58A-S86A 0.0532280331932879 I108A-G116A 0.0524983945607136 F83A-A105A 0.0524303721041703 G78A-S86A 0.052020240441361 A59A-L90A 0.0518866501460638 L63A-T110A 0.0518325274376856 T89A-A105A 0.0517113355142929 M65A-A109A 0.0515331707284412 G78A-V87A 0.0503490632822451 L90A-L111A 0.0499902854694485 T62A-F83A 0.0495913162939488 F53A-A61A 0.0485480190225651 A72A-A109A 0.0482525172466956 A82A-L111A 0.0482196009017493 G94A-V115A 0.0481335511811152 F53A-G116A 0.0479007815188712 A61A-I71A 0.047783292038547 F75A-Y95A 0.0477361786709611 L66A-A109A 0.0472225286178958 L55A-S119A 0.0471128287325049 A61A-T110A 0.0462528396891115 F79A-M98A 0.046179740832825 L55A-G80A 0.0456925483049626 E88A-H106A 0.045687446446697 I71A-G80A 0.0455439857340256 T92A-I108A 0.0454375470176558 L55A-I120A 0.0450360157682113 T58A-V87A 0.0449199701408195 V93A-F114A 0.0431763604438284 S86A-D97A 0.0430809745676328 T62A-Y104A 0.0429857805562737 N57A-V87A 0.0429216227215441 F84A-E112A 0.0427282741606136 A69A-H106A 0.0423598702029125 A82A-I108A 0.0420921832228582 G67A-H99A 0.0420274092230667 A50A-G116A 0.0415677475339313 F60A-G78A 0.0415238981056532 L56A-G116A 0.0410194746534858 A69A-I108A 0.0409293879325894 V87A-F114A 0.0408840828466508 L55A-A82A 0.0408581813682602 M65A-P100A 0.0400113370586542 A61A-A77A 0.0396471007704284 T62A-G81A 0.0395439445736474 L66A-G80A 0.039424201533683 N57A-M65A 0.0394027981786573 A77A-A82A 0.0393496526019712 S86A-W107A 0.0391054681780574 S68A-I108A 0.0379007770022937 P70A-H106A 0.0378608652006125 T110A-S119A 0.0377930223781355 L56A-L111A 0.0377269217035083 Y64A-W107A 0.0374805384330548 F79A-P100A 0.0374388639731036 I71A-Y95A 0.0368728411292314 A59A-G78A 0.036230846287872 S86A-I113A 0.0362188896463254 F53A-T62A 0.0359584139593703 N57A-I108A 0.0358169454615767 S68A-G81A 0.0355968552253694 P70A-P76A 0.0343982633496598 A82A-T102A 0.0343911998650033 Y64A-Y104A 0.0341830592314634 G81A-A105A 0.0336658487599517 G96A-A105A 0.0336003840553207 F60A-M98A 0.0327737449839396 L52A-S118A 0.0326984950294182 A82A-T110A 0.0322401518411732 L54A-F85A 0.0319257541823816 L55A-E112A 0.0309478274639776 P70A-F79A 0.0308133839269278 E88A-I120A 0.0305923620883037 L56A-F114A 0.0303156001666252 L56A-S118A 0.029885547288901 T58A-A91A 0.0298521882848559 G67A-G81A 0.0297701928289151 T58A-A109A 0.0296389113034687 V87A-I120A 0.029627591063317 F60A-E88A 0.0295915376410064 F53A-E88A 0.0290624817625664 A72A-T89A 0.0280281438244132 G78A-H99A 0.0280272192625526 V93A-E112A 0.027986631274588 L111A-S119A 0.0273574503333197 F60A-W107A 0.0270028576267327 Y104A-L111A 0.0269746836496321 A72A-Y95A 0.0265838899899387 A61A-M98A 0.0264277473852643 A69A-G80A 0.0263318922791531 P100A-T110A 0.025769344590536 M65A-F75A 0.0256801524344112 Q101A-A109A 0.0253819343411479 F85A-W107A 0.0253743698698456 L63A-G78A 0.0253321594253899 L63A-G81A 0.0250510756128799 A72A-F83A 0.0249563038385583 T92A-A121A 0.02476764194585 T62A-F84A 0.0247554773003884 Y64A-L111A 0.0244349031399542 G67A-A109A 0.0242427220388199 N57A-E112A 0.0235968070758372 T62A-F75A 0.0232070012445122 F60A-M117A 0.0229934080336145 G94A-A105A 0.0225542397396636 F75A-F84A 0.0224624492236263 P76A-V87A 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