[Wed Aug 24 18:58:25 2016] >Input file: TM2XOKATD.pdb >TM segments: K12-30_K51-71_M12-30_M51-71_L12-30_L51-71_O12-30_O52-71_N12-30_N51-71_Q12-30_Q52-71_P12-30_P52-71_S12-30_S52-71_R12-30_R52-71_T12-30_T51-71 MAIDEN score = -97.8968 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 ----------- ---------------- G21T-L20K 10 G21K-L20L 10 I17K-I17L 1.96825635370767 I14K-I14L 1.78311113237009 I17T-I17K 1.77994405228333 I14T-I14K 1.61913258787866 I17M-I17L 1.60764242051062 I17P-I17Q 1.58256674482606 I17S-I17T 1.57497272978751 I14M-I14L 1.52934812964609 I17M-I17N 1.4770357021219 I17P-I17O 1.47429012548548 I14S-I14T 1.42668746649594 I14P-I14Q 1.39080255884869 I17R-I17Q 1.36305304349987 I26M-E59M 1.30811037099227 I14P-I14O 1.30433821177228 I26Q-E59Q 1.29261220995492 I26T-E59T 1.29105882172261 I26N-E59N 1.28996046825954 I26P-E59P 1.28545303223856 I26K-E59K 1.28357483732818 I26O-E59O 1.28223220832677 I26R-E59R 1.27394168443941 I26L-E59L 1.26489195260341 I26S-E59S 1.26278867893797 I17S-I17R 1.24660121118187 I24P-I24Q 1.21327947066226 I24S-I24T 1.20369991772086 I24M-I24N 1.20304755572496 I24R-I24Q 1.19506109611977 I28K-I28L 1.1875254744524 I14M-I14N 1.18715758034719 I24P-I24O 1.18595066304938 I26K-F55K 1.18207529273504 I26M-F55M 1.18120141869197 I24O-I24N 1.17788003862888 I26R-F55R 1.17725496109959 I26L-F55L 1.1761164298348 I26O-F55O 1.17578339234999 I26Q-F55Q 1.17500878800461 I26T-F55T 1.17471901720336 I26N-F55N 1.17315252168537 I26P-F55P 1.17271129647032 I24S-I24R 1.16463568663431 I26S-F55S 1.16261681198866 T16T-C65T 1.14897848799055 I24M-I24L 1.14746222441338 I28R-I28Q 1.13199972477432 I17O-I17N 1.12771978031817 T16K-C65K 1.11816923975315 I14S-I14R 1.11328186672702 I28T-I28K 1.11068610844694 T16M-C65M 1.10947826163357 T16L-C65L 1.1061992702798 I28M-I28L 1.10574944259168 I28P-I28O 1.10185486353256 T16R-C65R 1.10102502909866 I24T-I24K 1.09627678926857 I14R-I14Q 1.09248519579926 T16O-C65O 1.08718088315102 I24K-I24L 1.08701979077256 T16S-C65S 1.07604165068615 I14O-I14N 1.06321938124389 I28S-I28T 1.06303458122131 L20P-G21O 1.05269389043392 G21M-L20N 1.05139239053555 T16N-C65N 1.05014466599326 I28M-I28N 1.03740490597736 G21P-L20Q 1.02577006099179 L20M-G21L 1.02141455937144 T16Q-C65Q 1.02050706350903 T16P-C65P 1.01018179702924 G21S-L20T 1.00738166841738 L20R-G21Q 0.996882210776876 F30M-V29L 0.972191595503689 V29K-F30L 0.971297245204163 I28P-I28Q 0.968581596008725 V29S-F30T 0.948806854831132 I28O-I28N 0.944791200119852 L20O-G21N 0.930813995483954 L20S-G21R 0.929771049316385 L20P-L20O 0.902560786038089 L20S-L20T 0.899440899008502 L20M-L20N 0.891751974144466 F30R-V29Q 0.89056414392538 L20P-L20Q 0.890504137103819 V29T-F30K 0.88833956765285 L20M-L20L 0.887928115754133 L20R-L20Q 0.879945763047508 V29M-F30N 0.862331017497105 V29L-F55L 0.857129195836576 V29M-F55M 0.847356194026201 V29K-F55K 0.838211666963297 L20S-L20R 0.836447217182067 V29P-F55P 0.836002310885723 V29T-F55T 0.835808255079834 V29N-F55N 0.834479416438144 V29S-F55S 0.829615481169128 V29R-F55R 0.825295824241349 V29Q-F55Q 0.822605407364001 I28S-I28R 0.814299228509761 V29O-F55O 0.807255624535671 T61K-L19L 0.790755194931885 V29P-F30Q 0.790011886342058 F30P-V29O 0.784671671477986 L20T-L20K 0.779572906195444 V29K-A27L 0.775680262210557 L20O-L20N 0.770632403651485 F30S-V29R 0.768020481157179 L19R-C65Q 0.757060416055945 I26S-L57R 0.745350198529506 I17T-T16K 0.731245845795977 C65T-L19K 0.727732845777795 S58T-I24K 0.723153360460551 L20R-L19Q 0.723090502399958 L20S-L19R 0.722663310625638 L19O-T61N 0.722524017984648 F30O-V29N 0.720427454438546 L19M-L20N 0.7198346472735 L20K-L20L 0.717399971960939 C65P-L19Q 0.717224303134945 L20O-L19N 0.716627721672285 L19P-C65O 0.716274353395743 S58P-I24Q 0.712755720567084 L19O-C65N 0.704201994300748 L19K-L20L 0.692682221086659 L19P-L20Q 0.691738687848232 L20P-L19O 0.691341973620508 I24R-S58Q 0.691036561308732 L20M-L19L 0.683231363797383 G13S-V68R 0.679336678695545 I17K-T16L 0.678533141179041 T61M-L19N 0.676926461052787 G13R-V68Q 0.673895858499636 L19T-L20K 0.671424236119702 L19S-L20T 0.668437538261367 I24M-S58L 0.652190824267155 F30M-A51M 0.652090655846649 T16K-T16L 0.651834704020489 L57S-I26T 0.648045319691135 L19S-C65R 0.644962178575315 F30N-A51N 0.642833694572624 I26M-L57L 0.635368707147399 G18T-C65T 0.634511818232415 G13M-V68L 0.633344964060158 T61S-L19T 0.626524464855091 F30L-A51L 0.623697097209788 T16M-I17L 0.622186787692605 C65M-L19N 0.621153119409155 I26P-L57O 0.620868145064099 L19P-T61O 0.620635012993104 L57K-I26L 0.620237643056564 T16T-T16K 0.610838637327733 G18Q-C65Q 0.609498519603521 F30K-A51K 0.60939320107054 A27M-F55L 0.608944920713002 I26O-L57N 0.606857440296427 V68T-G13K 0.604960409996177 S58S-I24T 0.603830915771685 F55S-A27T 0.602679282891405 S58M-I24N 0.601641666995043 G18K-C65K 0.600580350008828 F55P-A27Q 0.597059451377981 A27R-F55Q 0.596974062634708 F55M-A27N 0.595272569730715 G18L-C65L 0.594727962171644 G18P-C65P 0.593576270896907 F55T-A27K 0.592972184901331 A12R-V68Q 0.592262877899048 A27O-F55N 0.588874350327409 A27P-F55O 0.583632562716949 A51M-F30N 0.57772634148071 I28O-V29N 0.576073044053467 I26R-L57Q 0.575809264864901 A12S-V68R 0.573931285152879 L57M-I26N 0.573762576602618 S15O-L66O 0.573628406494508 F55K-A27L 0.572859560258737 S15P-L66P 0.572662966104852 V29S-I28T 0.572299347677537 A12P-V68O 0.570783880555316 I28M-V29L 0.570134110951613 S58K-I24L 0.569917233095405 S15N-L66N 0.569549648045736 S15S-L66S 0.568891967521013 I28S-V29R 0.564769431407146 I28R-V29Q 0.563627667823614 S15Q-L66Q 0.563625017032073 V29M-I28N 0.563324542318911 I28P-V29O 0.561789224993166 S15L-L66L 0.561494762515395 G18M-C65M 0.561239694479982 S15R-L66R 0.560899329327282 G18S-C65S 0.560808376727643 G18R-C65R 0.560217572214301 V29T-I28K 0.559075109740172 F30M-A51L 0.558016995054679 A27S-F55R 0.556125956680318 L66M-F64L 0.555131330042381 G18O-C65O 0.553180294698615 S15K-L66K 0.552931795917085 V29K-I28L 0.552034027158488 L57P-I26Q 0.548108969643505 F30T-A51T 0.548001711313044 S15T-L66T 0.546333485045099 S15M-L66M 0.545152228397264 F64K-L66L 0.541808334057267 T16M-T16L 0.541510594453689 A12M-V68L 0.541134071157165 F64T-L66K 0.538745084436861 I17P-T16Q 0.538178978389559 L19M-T61L 0.536227547527277 V29P-I28Q 0.531157524954623 F30O-A51N 0.52812861377233 F64S-L66T 0.527693556796379 I24S-S58R 0.527562256941875 T16M-I14L 0.527474207708011 S15T-S15K 0.526778099275086 S15M-S15L 0.524014446654898 T61P-L19Q 0.52365433496225 I17S-T16T 0.522831397388233 A12R-F70R 0.519199985693818 A12P-F70P 0.517335438206302 A12O-V68N 0.517013898364557 I14P-S69P 0.516462431465736 A12O-F70O 0.51585084543609 L57T-I26K 0.515374758813722 A12Q-F70Q 0.512328517926985 A51T-F30K 0.510547078535118 I14O-S69O 0.508671571354237 A12L-F70L 0.507751979251589 C65K-L19L 0.506818524174722 L19M-C65L 0.506286274492732 A12N-F70N 0.502929855557379 A12T-F70T 0.502729353042926 A12S-F70S 0.501751889373689 S15S-S15T 0.5005498160865 I14N-S69N 0.497328302404887 S15P-S15Q 0.496225986972495 A12K-F70K 0.494585201748911 A12M-F70M 0.493591950983825 V68M-A12N 0.491061087615247 I14Q-S69Q 0.490408368874996 S15K-S15L 0.489603446896524 I14R-S69R 0.489334252310872 V68M-G13N 0.488593261781797 I24P-S58O 0.483692123271595 G25S-S58S 0.483462817914758 F64M-L66N 0.48308430289789 A22R-T61Q 0.481117669998744 I17T-L20K 0.478890581718449 I17S-L20T 0.478520532871061 V68T-A12K 0.478323057477048 I17P-L20Q 0.477602338749319 G13P-V68O 0.475806506048522 G25T-S58T 0.475675561064502 G25Q-S58Q 0.475203978952587 G25P-S58P 0.474578113504437 G25R-S58R 0.474164158643333 I14S-S69S 0.473660334269872 G25L-S58L 0.471848665607806 G25O-S58O 0.470944746618451 V68P-G13Q 0.470900612499491 I14T-T16K 0.47029132527281 I17K-L20L 0.469175960405868 L20M-I17L 0.466844927803132 I24O-S58N 0.466583612414309 G25K-S58K 0.465648744322692 T61T-L19K 0.465621782991004 T16R-I17Q 0.46552983524257 G25M-S58M 0.465367906466922 A22O-T61N 0.464850475879675 V68S-A12T 0.464299160517945 S69K-G13L 0.464150742700332 I14L-S69L 0.463997975564028 L20S-I17R 0.461922114345704 V68S-G13T 0.461681181808058 F64P-L66Q 0.460561719153478 L20P-I17O 0.458649069267742 T61P-A22Q 0.455022390202315 L20R-I17Q 0.454045393100045 I28R-G25Q 0.453298234151836 G25K-I28L 0.452414527679446 I28P-G25O 0.451101386802294 G25T-I28K 0.450899270078665 G18N-C65N 0.450533916374103 V68P-A12Q 0.450507703025313 T61M-A22N 0.446815687578059 E59O-C65N 0.446444410841288 V68K-S69L 0.444474637894622 I28S-G25R 0.444385160544789 G25N-S58N 0.443889283910959 G25S-I28T 0.443584294734906 C65S-L19T 0.440363895774878 T61T-A22K 0.435133324754026 A22S-T61R 0.434864426503869 L20S-A22R 0.428544647916311 T16S-L66S 0.42818431457999 T16Q-L66Q 0.427805975535067 T16P-L66P 0.427600823627448 I14K-T16L 0.427483670823913 G13P-S69P 0.427061493628369 I17M-T16N 0.426018873154688 T16N-L66N 0.425046911326875 G25P-I28Q 0.423950516568243 L20R-A22Q 0.423195496640738 G25M-I28N 0.422622976408237 G62M-T61L 0.422607255976037 I28O-G25N 0.42195010730261 T61K-G62L 0.421768011504017 T16O-L66O 0.421188115912336 T61T-G62K 0.420735446404419 T16L-L66L 0.4197747319077 I14K-S69K 0.419412774967316 I14M-S69M 0.419073933112092 T16S-I17R 0.413255277296021 G13L-S69L 0.412897414760542 T16P-I17O 0.412346000954005 G13R-S69R 0.412312936675066 A22P-T61O 0.411548282689986 V68K-G13L 0.411116347576801 T16R-L66R 0.410342068212803 S15M-S15N 0.409905529294559 I17M-L20N 0.408915215795959 I28M-G25L 0.406988396786737 G13Q-S69Q 0.405958230705337 S69S-G13T 0.405870839160053 A22M-T61L 0.40544744269629 S69P-G13Q 0.405051235758626 S15P-S15O 0.404388335845571 S58P-I26Q 0.40131233605814 S58T-I26K 0.401194458091484 V68T-S69K 0.400868249587139 I26O-G25N 0.399650849153087 I26R-S58Q 0.399253295403508 I26P-S58O 0.398666681443398 G13O-S69O 0.397276110517594 I14T-S69T 0.3971109396934 S58K-I26L 0.396555046972814 C65M-E59N 0.396415065861814 I24P-A22O 0.396392812185379 S58M-I26N 0.396212240556874 A22S-I24T 0.396206150527866 I24M-A22L 0.395781875169786 T61K-A22L 0.395729257274532 A12P-V68P 0.395516454138837 V68K-A12L 0.395066447980742 A22K-I24L 0.394169504373415 A22M-I24N 0.393718720699473 I24S-A22R 0.393366685199262 A12R-V68R 0.39159623165635 G13T-S69T 0.391319840815858 G13S-S69S 0.390442974861216 A12K-V68K 0.390022929189431 A12O-V68O 0.389996839902402 A12S-V68S 0.389264334690401 L20M-A22L 0.388957719228021 A12T-V68T 0.386475472695867 A12L-V68L 0.386429916995455 A12Q-V68Q 0.386351207583469 A12M-V68M 0.386301870496249 A12N-V68N 0.386178490371777 A27O-I28N 0.385175423341434 T16K-S69K 0.38382121048282 T61S-A22T 0.382677346668833 T16N-S69N 0.382430393663215 T16K-L66K 0.381712567888777 A27S-I28R 0.38119255781939 G25K-I24L 0.380193835994882 I24O-A22N 0.380081379659586 T16T-S69T 0.377423892233202 T16M-S69M 0.377368639934089 I24R-A22Q 0.376677180065363 G13M-S69L 0.376577992537478 G13N-S69N 0.376501583735992 T16R-S69R 0.375616346643219 T16P-S69P 0.375371703576905 A22P-L20Q 0.374739566501636 E59P-C65O 0.374530905080275 T16L-S69L 0.373709595367233 A27S-A60R 0.373026096826615 S69M-V68L 0.372966232566291 G13K-S69K 0.372471916966297 G13P-S69O 0.370548372812224 T16T-L66T 0.370496957708785 E59R-C65Q 0.367491629070733 T16O-S69O 0.367469244681046 T16Q-S69Q 0.366385463069633 G13O-S69N 0.366257664204332 L19T-T61T 0.365837536645623 S69T-G13K 0.364978175175141 L20O-T61N 0.36478383644699 I17M-I14L 0.364571926902205 T16M-L66M 0.363893356773089 V68S-S69T 0.363438106780934 G13M-S69M 0.362788736424098 A27O-A60N 0.362398102000299 L19S-T61S 0.361791316788278 I24M-G25L 0.361576538182159 I14S-T16T 0.36136970190418 L19N-T61N 0.360951252753281 T16S-S69S 0.360933278522087 I24P-G25O 0.359076963792757 A27M-A60L 0.358748999396347 S69M-G13N 0.358524367705479 T61S-L20T 0.357459842756313 L19M-T61M 0.357199976110046 G25T-I24K 0.356943028468508 I14K-I17L 0.356527206573221 I26O-S58N 0.356447725692421 L20O-A22N 0.356172805904323 A22S-L20T 0.356112451611969 L19L-T61L 0.356061522292332 V68S-T16T 0.356008892732123 A22M-L20N 0.355704384501164 L20P-A22O 0.3553215600145 A22T-L20K 0.355295863698854 G25M-I24N 0.354867725911014 G25S-I24T 0.354269223824882 A27P-A60O 0.353564105842855 I24R-G25Q 0.353482578548117 I24O-G25N 0.353436363841649 L19K-T61K 0.353209628537291 L19R-T61R 0.353100613649015 L19O-T61O 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