[Wed Aug 24 17:58:43 2016] >Input file: TM4YBQATD.pdb >TM segments: A17-36_A38-92_A97-113_A129-146_A160-176_A196-212_A281-296_A318-334_A343-363_A374-396_A411-433_A438-452 MAIDEN score = -81.3572 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 ----------- ---------------- M284A-H418A 10 C351A-Y382A 10 G32A-I169A 4.41895054825847 F348A-C448A 1.77969295930617 P146A-L396A 1.62314419815845 C355A-F444A 1.29907343167387 L86A-M412A 1.24714308308592 A160A-V332A 1.2390616022575 F107A-C137A 1.21768940011826 F29A-F168A 1.18581688150573 I83A-I136A 1.15194974290533 M76A-L132A 1.14861597889259 N104A-C137A 1.12962313106493 Q288A-H418A 1.07508543680028 I356A-I442A 1.06494699379611 F29A-I169A 1.05338660444869 L102A-Q205A 1.02758134840221 Y33A-I173A 1.01977004121415 F79A-W419A 1.01156908075454 V163A-I393A 0.996251280171653 V38A-F77A 0.947615483381384 P111A-R131A 0.933618976417172 G286A-C448A 0.931822309119594 L344A-G389A 0.928328104698956 G84A-C137A 0.905578029777019 F29A-V171A 0.902232225840679 Y33A-I169A 0.900272739384819 S108A-C137A 0.894582044338064 K98A-L209A 0.883636653730315 F107A-L133A 0.877399393139195 L352A-L449A 0.819790323939806 Y33A-V175A 0.814165370423075 R97A-V145A 0.812322381176995 V171A-V325A 0.810970124108554 V88A-I140A 0.807462002116162 F348A-T451A 0.801320318316412 A387A-P392A 0.798996732274385 P111A-L133A 0.767032533827235 G81A-C137A 0.766144667061768 F107A-V134A 0.75994028366276 I281A-V417A 0.757987791399276 L289A-I447A 0.736947011282529 Q287A-H418A 0.736576009156371 F77A-V134A 0.735072424331772 V163A-L396A 0.731519856280383 C355A-F441A 0.729919502108316 T320A-I380A 0.725024277337392 L102A-L206A 0.724345944733401 L22A-L209A 0.721219514911042 V282A-T451A 0.712390930229729 V38A-R131A 0.710789471656758 T350A-V381A 0.710494013673737 T170A-T328A 0.709284043424152 S85A-I413A 0.702781959281531 L289A-F444A 0.702553583726368 V88A-N143A 0.696707311519412 F82A-H418A 0.685451308347542 A160A-F333A 0.674367448558909 I346A-G385A 0.67027153513866 Y33A-L174A 0.670197401157375 F107A-I136A 0.66816839920385 L174A-A322A 0.668085665339826 N105A-C137A 0.659224225937463 L101A-V144A 0.657614791356805 F82A-I136A 0.648547737348517 T359A-I442A 0.643205683097881 S28A-S142A 0.63502484897543 S290A-F444A 0.628291347352894 L352A-A445A 0.624877159108657 A24A-F168A 0.615405335384931 V323A-I384A 0.614260738601226 G291A-F441A 0.612963727044192 L22A-P201A 0.609334963219067 A24A-F29A 0.609169097021597 A19A-F212A 0.608057371296114 I83A-S416A 0.606676785677894 P146A-L161A 0.604046186191078 L289A-V425A 0.603656468888358 F348A-P390A 0.596902696403209 L167A-V325A 0.595254321256194 K98A-P210A 0.594224957537436 Q288A-V425A 0.588392040940326 V88A-Y411A 0.584372118203872 L362A-S375A 0.582410776881796 S85A-I136A 0.580843047345864 S108A-L133A 0.579313457200179 C355A-I442A 0.579067612242049 L283A-P390A 0.570218678716674 V74A-R131A 0.565697713935537 F25A-P201A 0.563496234808757 V92A-G99A 0.562779786314819 Q205A-P210A 0.559595915041965 L362A-P438A 0.558590975273829 S71A-L427A 0.556998295043994 L352A-F444A 0.5547201149342 V35A-I173A 0.554468527090237 F82A-W419A 0.54988569113003 F82A-S416A 0.548126597440883 P146A-A395A 0.546822143264468 T331A-V388A 0.543117937169441 G32A-V171A 0.539525080090374 G80A-R131A 0.537510290593898 P78A-F423A 0.537002051947841 T320A-V383A 0.533566923267321 G81A-I140A 0.533083835752306 Y31A-C137A 0.532739172136132 Y33A-V171A 0.530680769063822 F348A-L449A 0.528509802247665 F79A-F423A 0.520099395545457 Y31A-I169A 0.51941869917233 A23A-L101A 0.516668657465233 T359A-F441A 0.515082821968552 L167A-P392A 0.513416282276153 N34A-V134A 0.512658772035977 L358A-F441A 0.512084222589968 F79A-L132A 0.510061036618844 F29A-G172A 0.509222227550823 F25A-F168A 0.508838200734473 A24A-V164A 0.506118244420416 T353A-A445A 0.503832827621495 L22A-L204A 0.503603711172189 V163A-T331A 0.503500101559113 A23A-L209A 0.503184113436811 A100A-V144A 0.503102939320746 C351A-H386A 0.502573389202254 N104A-I136A 0.495392490848055 F79A-L420A 0.492133443302194 T331A-A387A 0.489244771803868 F77A-L132A 0.487584472426942 F79A-G135A 0.479142646546319 A361A-V374A 0.478086517333734 S349A-L449A 0.475202609370084 L91A-R97A 0.473745724932955 V357A-S375A 0.472027405859685 L289A-N422A 0.47003960110683 G80A-V134A 0.469735072166908 N34A-I173A 0.468743529789679 L352A-C448A 0.463919719747155 L343A-V388A 0.463795675510769 I356A-F441A 0.463244002257793 L344A-I393A 0.461263968179314 L344A-P390A 0.459533813033046 A395A-Y411A 0.456448120393762 I83A-G139A 0.453248039704341 G347A-I384A 0.453035772986912 L174A-A318A 0.45200349597371 I109A-G199A 0.451638020473603 G162A-I393A 0.451583791101646 F82A-G415A 0.45126488334214 T170A-V325A 0.449018790951698 A23A-K98A 0.444513176720712 V163A-V332A 0.437549178941445 F79A-I136A 0.433070642673307 C351A-V383A 0.432642406428017 N34A-A176A 0.429749759377964 V88A-A100A 0.429056915754892 Y31A-S141A 0.424517078437518 F82A-L420A 0.422966995666893 G84A-I136A 0.422963092823359 V325A-A387A 0.422451004157956 V88A-M412A 0.421876194064295 S85A-Y411A 0.419393453931672 Q30A-T198A 0.419310258469443 P78A-L420A 0.413479878990087 I83A-M412A 0.411462742712242 L174A-V325A 0.408732706755014 Y411A-S416A 0.405602036899761 Q287A-P394A 0.404736550957515 L283A-P394A 0.402875945678857 G291A-V425A 0.398888797332956 T20A-L161A 0.398214092078642 F25A-Q30A 0.39667668064796 S290A-A445A 0.396621257824657 I356A-A445A 0.393328881316671 P111A-V134A 0.391097711636908 G32A-F168A 0.390558070549 L352A-I446A 0.389627402146347 S290A-H418A 0.389268172060359 I424A-F429A 0.38893223429571 Y31A-G172A 0.388640937903921 M327A-I384A 0.38401423846279 V145A-P165A 0.382581146046585 M327A-A387A 0.382308533921914 Q287A-H386A 0.381728528158403 I281A-I413A 0.380174610811455 P78A-W419A 0.378261396514702 F77A-L133A 0.376228991256253 V334A-L343A 0.375066275511097 P111A-S130A 0.373048660816815 S75A-F423A 0.364384075813109 S85A-M412A 0.364296461244225 L344A-T452A 0.362593123856718 A19A-L209A 0.361993142135296 A23A-S28A 0.360413032068606 S28A-F168A 0.359410756874057 G80A-I136A 0.359028930183524 Y31A-G80A 0.358500538724095 L91A-F103A 0.356678446358654 K98A-A202A 0.354777271464159 Q166A-P390A 0.354713266762706 Q287A-V292A 0.354278669199095 L358A-C378A 0.352491839223689 Y33A-G135A 0.351749678679238 A294A-F429A 0.351665634925006 F29A-I173A 0.351116651401172 N34A-P78A 0.351005221990975 R131A-C137A 0.350080500459265 C351A-A445A 0.349862528514976 Y31A-G199A 0.349837941619591 L86A-S416A 0.347848901902102 N324A-P390A 0.346130503508712 C355A-Y382A 0.343703336959607 G321A-Y382A 0.343607989674303 F348A-C378A 0.343150596439565 S27A-S142A 0.343023773439334 S375A-P438A 0.342836714553817 K98A-C137A 0.342020025859966 V282A-Y411A 0.34201938456126 N143A-M412A 0.341832152492753 S27A-V145A 0.338590035446357 Y31A-G84A 0.336422445628688 S75A-L427A 0.334952238665355 S28A-V145A 0.334315493878748 I140A-M412A 0.334246834565292 V38A-Y296A 0.331522723737843 P78A-S142A 0.331389700565465 N34A-P201A 0.331068486766551 A23A-G203A 0.329862003753982 C351A-T359A 0.329604626583789 A100A-G139A 0.328896566829304 G26A-A138A 0.327469686600762 Y31A-S142A 0.326728377941344 M76A-G135A 0.326071006069745 F348A-T452A 0.325870459808936 S349A-C448A 0.321984789573078 S27A-L101A 0.321461884380225 I346A-C378A 0.321430872193307 F77A-I136A 0.320753621390715 A17A-A160A 0.320642148135607 I384A-C448A 0.319856542178629 A100A-S142A 0.318926370118517 L161A-V332A 0.318727569800057 S27A-A202A 0.31801895959589 F82A-G139A 0.317850940462622 G139A-A395A 0.317586148743175 F348A-G385A 0.316370389258399 A363A-P438A 0.313767627841451 V323A-V383A 0.313166164388401 A23A-G162A 0.311561652869305 G291A-H418A 0.310753780753507 T320A-C378A 0.31044280817746 G89A-M412A 0.31010597074909 L283A-T451A 0.309441666987361 A322A-A387A 0.308649388289188 T353A-L358A 0.308647122317931 L167A-M329A 0.308288288197601 V357A-C448A 0.307870371229694 Y31A-V164A 0.307164512658977 M284A-V417A 0.306284303049265 R97A-L102A 0.305414756824158 Y31A-P146A 0.303740780478064 V323A-C378A 0.303213362940035 C378A-I442A 0.302143861303538 Q166A-S391A 0.301471974244863 S85A-A100A 0.29895701598345 A36A-I173A 0.298062203342644 N104A-P201A 0.297742957734998 N105A-L206A 0.297520214508372 I173A-G321A 0.297285818019472 V92A-V144A 0.297258353733953 L204A-L209A 0.295961603083937 T20A-P201A 0.295883323280405 F29A-P165A 0.295465116885614 F25A-C137A 0.294680642959143 T331A-P394A 0.294662952603931 T350A-H386A 0.294572342465597 P146A-V163A 0.294461037262037 P165A-P390A 0.294414380337917 G81A-S421A 0.29380847416106 V388A-I393A 0.292989900984484 G286A-G415A 0.291850934279542 L22A-L208A 0.290966335393676 G135A-H418A 0.290796415138517 T20A-P210A 0.290246446150028 L86A-I413A 0.289790255051549 Q288A-P394A 0.289369838820684 S290A-G385A 0.288021031022215 G321A-H386A 0.286907752764163 G80A-N422A 0.285566652658953 Q30A-A202A 0.284380155802509 L110A-L133A 0.284271556833507 V292A-H386A 0.282736857799351 V330A-V388A 0.28268840004907 L167A-V332A 0.282665550038834 S142A-G162A 0.282099362498482 I295A-C448A 0.281682721389443 F348A-G389A 0.281521124823816 Y296A-P430A 0.281402721684128 M284A-G415A 0.280908257531295 L396A-G414A 0.280199411302361 L110A-S130A 0.28019204927807 L91A-G99A 0.279837701190988 G26A-C137A 0.27745985488285 Q30A-I169A 0.277114590514577 Q433A-Y439A 0.276041348033433 P78A-N293A 0.275993454699202 G291A-A354A 0.275895950638928 V88A-V144A 0.27518702400181 M284A-G414A 0.273851782777419 A285A-S391A 0.273211113222751 V282A-Q287A 0.272539317380583 N422A-P430A 0.272393655550598 F29A-N34A 0.272018613156328 N105A-P210A 0.271627442639133 L101A-G139A 0.270792651613748 I346A-V388A 0.269609359106232 V171A-G321A 0.269057656164774 V171A-A176A 0.268846724644881 S108A-G203A 0.268647689500588 S28A-Y33A 0.268174637916488 G139A-N422A 0.267050854521377 Q288A-P390A 0.266878449800278 A36A-G321A 0.266677741003055 Q166A-M327A 0.266336346926652 L358A-V379A 0.264793146649741 M87A-R97A 0.264298888116812 G81A-I136A 0.264001807729342 V144A-Y411A 0.263234611993413 S28A-Q166A 0.263045261523315 Y31A-V200A 0.261907181996479 S108A-G139A 0.261553971442374 A112A-A202A 0.25896464175928 G286A-L344A 0.258153434931788 S27A-G203A 0.258004699301393 R97A-Y411A 0.25712081155055 S108A-V134A 0.256803681996217 N34A-G139A 0.255925918558753 L101A-V145A 0.255731811033671 T170A-G321A 0.255489161865547 S28A-N105A 0.255243799743794 C137A-H418A 0.254848719457867 L344A-V388A 0.254827748884307 Q166A-Q288A 0.253773872984297 S141A-Y411A 0.252803250702973 Y33A-V325A 0.252413676713013 G26A-L204A 0.249934334993437 I295A-V379A 0.249887236045549 G291A-G385A 0.249716959331253 V38A-V74A 0.249705722370909 Q287A-S349A 0.249273956429199 N324A-S391A 0.24811705395619 M87A-I140A 0.246512612366617 G26A-Q166A 0.246050289853579 L345A-G389A 0.245326976625925 F25A-P165A 0.243789672509481 T359A-Q433A 0.242830421150443 Q30A-G196A 0.242283938838745 R97A-N105A 0.241602167954062 Y31A-A202A 0.240240934492312 S28A-K98A 0.240198424266593 V357A-V374A 0.240056432448387 L66A-S71A 0.239610002380326 Q30A-N105A 0.237697984676374 A24A-Q166A 0.237418851979091 L352A-Y382A 0.236999720817789 L101A-P146A 0.236714507078346 Q166A-T328A 0.235900562594106 G162A-F168A 0.235472967156953 W70A-G426A 0.23511904602504 P165A-T170A 0.233389089497267 G139A-W419A 0.233329773308972 A361A-F441A 0.23316354829433 N143A-L396A 0.232062467398393 Q287A-N422A 0.231868323318765 L102A-S108A 0.231281993812089 F79A-A129A 0.230784422583039 G99A-S141A 0.230548919990856 C351A-V381A 0.227238565616375 S391A-H418A 0.225936928618942 G84A-I140A 0.224516285121113 G26A-S142A 0.224312100823395 L101A-I140A 0.223767901283022 L101A-S141A 0.223742522326504 V164A-M329A 0.223404270109492 V145A-I169A 0.223068318678485 N324A-G389A 0.222932415925079 G32A-I173A 0.222855066155289 P146A-S391A 0.222273492078641 L91A-A100A 0.221645833354856 I136A-G415A 0.221548169240931 P146A-Q166A 0.221327038662067 P201A-L209A 0.221044023710415 G291A-I446A 0.221026876277901 T20A-P165A 0.220251886465435 F79A-G426A 0.220122853560328 G139A-L420A 0.219002767129909 S28A-A395A 0.219001040606451 S27A-S85A 0.218825519198606 Y296A-F441A 0.218810276530135 F168A-A176A 0.218726936911604 G81A-N104A 0.218717548921503 C351A-I393A 0.218590506634644 T73A-R131A 0.217796838894672 A363A-S440A 0.216270123772611 S75A-S416A 0.21590175203404 A361A-Y439A 0.215881540859286 N324A-G347A 0.215576506709255 V330A-G389A 0.215347579436355 S141A-P394A 0.214705281321966 S141A-A395A 0.214647902695708 H386A-T452A 0.214274925248269 F348A-H386A 0.21420484864908 G32A-C137A 0.214115109699765 S28A-S85A 0.213955266965836 V35A-G81A 0.213738002331882 G389A-A395A 0.212314031920508 V357A-C378A 0.212148007631961 V425A-S440A 0.212010774618748 C351A-I443A 0.211915593550248 G389A-L396A 0.211494109967212 A285A-F444A 0.211268426232776 G162A-G389A 0.210983782376633 G81A-F107A 0.21092453458395 T67A-G426A 0.210582727864323 V35A-G139A 0.210575921634242 I346A-G389A 0.209858202582295 N104A-G203A 0.209766934399103 G286A-I443A 0.2095774830435 S27A-V134A 0.209229039502652 F79A-V417A 0.208689033105449 V292A-S421A 0.208537111088071 K98A-S142A 0.208109116030341 L283A-V417A 0.207904738324753 G99A-V145A 0.207893175711241 T328A-V388A 0.207610348407063 S27A-V200A 0.207549025683665 M284A-H386A 0.207342648832256 Q287A-Y382A 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