[Wed Aug 24 17:51:20 2016] >Input file: TM3HFXATD.pdb >TM segments: A14-29_A43-64_A96-112_A132-150_A231-248_A257-306_A312-328_A352-369_A447-464 MAIDEN score = -85.9869 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 ----------- ---------------- I112A-L135A 1.23957848611244 I240A-I454A 1.21032445349625 F55A-V318A 0.973853431298403 W53A-F302A 0.972797550100815 F55A-W321A 0.916447800821481 M62A-T149A 0.912502901334576 L139A-W360A 0.850524348513845 L135A-T364A 0.811922904597419 F312A-T317A 0.771879231202527 W147A-V352A 0.765225906804753 H141A-P146A 0.759446969622054 W57A-F302A 0.74575416573663 G108A-W363A 0.723709595247398 V273A-N369A 0.718422468167109 T48A-V318A 0.70943877468412 L139A-W363A 0.687134800936388 S277A-I282A 0.685850171024732 L135A-Y285A 0.670850607549747 D232A-L464A 0.665723386372457 L139A-L293A 0.658055312333738 L63A-L145A 0.65602918450375 V273A-L366A 0.648676497104402 F274A-V365A 0.642143042515074 V352A-A357A 0.639235110814264 F96A-A357A 0.638261183240457 Y137A-L293A 0.630989534078831 F55A-A322A 0.624207186097273 I282A-T364A 0.621676674434441 F274A-A279A 0.614843801607904 F96A-L355A 0.613572119683352 E56A-F302A 0.600583467575193 P144A-L353A 0.598962949170517 I112A-S138A 0.598534123765095 L270A-V365A 0.59098427529047 I112A-S368A 0.58676406088752 L135A-S368A 0.585321877197838 D305A-P313A 0.577968631146767 E56A-W321A 0.570157872567245 C238A-C246A 0.567344525551789 L63A-T149A 0.567215475865144 A136A-F286A 0.5526064952101 T237A-I454A 0.545954012681075 M62A-A148A 0.545373882131519 D305A-F312A 0.542138127428716 I282A-V365A 0.534706979737525 F96A-S358A 0.531232707716799 L135A-F286A 0.529269741927539 F286A-T364A 0.526149803823039 F140A-L297A 0.52565435439731 L270A-L362A 0.522778894847151 F140A-L293A 0.5201407456618 H141A-T317A 0.49988363039153 D305A-Q314A 0.497769826975721 C26A-I459A 0.495622618661141 S138A-W363A 0.484822711921268 A136A-M292A 0.479856977219011 L63A-P146A 0.471093057921283 L135A-W363A 0.466869890899551 W142A-W360A 0.466034086808649 S277A-S368A 0.46428743824071 L139A-S289A 0.4642859994911 E132A-D288A 0.454206148996296 N243A-I450A 0.452850565384753 F274A-L366A 0.448182777198202 E132A-T287A 0.440325946786491 I240A-G457A 0.437548029560736 G52A-T304A 0.434170770948434 T48A-E56A 0.43323633682865 W142A-T359A 0.420342317048202 S45A-V50A 0.415813178153958 E56A-T149A 0.408672536093516 W53A-V318A 0.401157546215787 F140A-L145A 0.399770305630178 M59A-W142A 0.399729540669951 A136A-D288A 0.396011898402506 Q314A-F319A 0.395462048261829 Y137A-S289A 0.387895292997085 W51A-V318A 0.385716546862929 T304A-T317A 0.384930638920899 A233A-I461A 0.384003059944701 T304A-Q314A 0.375336439822134 I240A-I450A 0.374040760779543 M269A-W363A 0.370331318564082 V22A-W27A 0.364294255755077 L139A-T364A 0.363725759285631 E56A-P298A 0.361623709426109 S45A-P313A 0.358278858565312 Y137A-V318A 0.356804596119735 W142A-W147A 0.355543875483619 A97A-S358A 0.355337048555941 V247A-R449A 0.354990297600147 S259A-Y264A 0.353036260181948 L135A-S289A 0.352284418940146 D288A-L293A 0.348056576633301 E56A-F64A 0.338756923387895 C99A-R262A 0.338423867304122 Y46A-W51A 0.336124254222121 E111A-F312A 0.335362711224581 T237A-G457A 0.332369072127336 W27A-V462A 0.332357194835962 E111A-T317A 0.332293002192284 S109A-W363A 0.332198471943195 C26A-G460A 0.330780022520783 Y285A-S368A 0.330721774184682 M59A-L145A 0.327407480903937 L270A-L366A 0.326058371799993 C99A-G354A 0.321510312704732 G108A-Y320A 0.321137821002155 I110A-G367A 0.318425088485973 F274A-I282A 0.318330941251765 L133A-S289A 0.313681409200605 M59A-P146A 0.313671315123562 T100A-R262A 0.312745197635122 G134A-G291A 0.312589470258651 M283A-W363A 0.311562325779787 F267A-W272A 0.308463535641772 T48A-G315A 0.30259118503481 C26A-V462A 0.301914071471047 A148A-G354A 0.296935858237888 S101A-G108A 0.296400735402799 G23A-G457A 0.294415132027357 W147A-W324A 0.293872492604913 Y303A-Q314A 0.293654027335858 C238A-V456A 0.292872717482993 W142A-M300A 0.290433101949912 T48A-P306A 0.290068263536784 A136A-S289A 0.289379802295435 W147A-L355A 0.288668069834179 D260A-M269A 0.285365797869203 W51A-T317A 0.284812675507179 L133A-M292A 0.284489292004452 W53A-P306A 0.284151213455591 Y150A-G354A 0.28397828520588 G143A-L294A 0.283008471842783 T29A-V462A 0.281407202053797 A136A-L293A 0.27991194821837 F44A-N49A 0.279700716657142 G108A-L270A 0.279525212065945 N243A-G457A 0.277111258905288 P298A-T317A 0.276471803269031 Y296A-P313A 0.275100446561709 D232A-G457A 0.272956885243025 G278A-G367A 0.267003419213603 N284A-S368A 0.263340126478251 E111A-F140A 0.261698809000598 D305A-G315A 0.261450492296833 D260A-L265A 0.258460115026218 G108A-G143A 0.257999686398905 G52A-F312A 0.254600311788888 V60A-L301A 0.25407505958398 L139A-V290A 0.254001370895984 M269A-N369A 0.247141506542308 S138A-T364A 0.246678515625106 F106A-E111A 0.245310074430614 A244A-I450A 0.243629320699016 T149A-W323A 0.240738752816049 H141A-P313A 0.236998053783782 F274A-N369A 0.236338380418508 W363A-S368A 0.235659746338169 P144A-T149A 0.234558204446282 G52A-L301A 0.228663772006667 F44A-Y320A 0.228629430916406 M59A-V352A 0.226578523678349 V14A-I21A 0.2260548876569 C99A-V352A 0.224751055781796 Y303A-T317A 0.223436828261987 W272A-V365A 0.222041983274874 E56A-Y303A 0.22198687795613 E132A-Y285A 0.220049531808723 S277A-L366A 0.217971304213322 P144A-L355A 0.217717547197751 V104A-G367A 0.217232818384502 S45A-P306A 0.216090641382059 C238A-I458A 0.215283494940481 G108A-L362A 0.214445556258367 V276A-M283A 0.214282577334309 T48A-W321A 0.21418139763717 G23A-V456A 0.212651531758844 V104A-S266A 0.212257081431765 L135A-G291A 0.212251152375298 L145A-P298A 0.211767369332563 V276A-S368A 0.211502733535294 T29A-G460A 0.211454390405357 L297A-P313A 0.210267465676705 C99A-I361A 0.209317003870201 I112A-Y137A 0.209218705693424 W107A-W363A 0.209197416150665 W57A-T149A 0.209134401048063 F319A-Y327A 0.208797678501491 E56A-V61A 0.207783154714053 H141A-T364A 0.207618503414689 S109A-S266A 0.20652215814476 W316A-W321A 0.206403458994753 S280A-S289A 0.206306182600856 I236A-C246A 0.205590345547366 I235A-G460A 0.204447865537119 H141A-G367A 0.202704722302669 M283A-L362A 0.202367895961793 I241A-G457A 0.20220782186066 V104A-S358A 0.20220448404462 W57A-T304A 0.202166535870489 F140A-M300A 0.201698254673739 G23A-I459A 0.201129118832614 V247A-S453A 0.200811553678125 S277A-V365A 0.20068952784348 W360A-V365A 0.199498423293115 W142A-W363A 0.199021432402413 I236A-G457A 0.198511178906685 L135A-G367A 0.196996793080318 G134A-T287A 0.19639637652709 P146A-P313A 0.195922140322355 L135A-M295A 0.195790545175036 W57A-P298A 0.194528839451582 G134A-N369A 0.193871022954188 Y137A-D288A 0.19382605820655 D288A-T364A 0.192923425593773 M62A-Y150A 0.191582783607413 W57A-Y303A 0.190815034252253 E111A-G315A 0.190548840456612 V47A-Y320A 0.190166535706071 G354A-I361A 0.190083239052962 A136A-T359A 0.188711730588056 W142A-T149A 0.188306603654766 E56A-F140A 0.188094940580403 D305A-T317A 0.187755988834444 S266A-L362A 0.187696979585026 F96A-G354A 0.187686194628487 H141A-Y296A 0.186994334912605 A148A-T359A 0.186441299313655 S109A-G134A 0.186352399507022 G143A-L297A 0.185527279345024 Y137A-G315A 0.184932417403728 M269A-S368A 0.184779392917286 Y58A-Y320A 0.184754946275885 M283A-L366A 0.18298367790268 F44A-F319A 0.181974479087146 M300A-Q314A 0.181799230431684 G271A-N369A 0.181419303270808 G52A-M300A 0.181383890928322 P298A-P306A 0.179834679994796 E56A-P146A 0.179527967136236 G134A-D288A 0.17947542201895 G134A-P313A 0.179198117177587 L231A-G460A 0.178964559031222 L139A-T287A 0.17856970354388 S45A-V318A 0.178440271594206 D232A-I461A 0.178180287466328 S138A-P313A 0.178027270581823 S138A-P298A 0.17776632956329 L135A-M300A 0.177659983461399 F140A-G291A 0.177323048297189 I282A-T287A 0.176253220046135 G134A-H141A 0.1761832705655 H141A-T149A 0.175263827395136 M292A-R299A 0.175231350740377 L105A-S138A 0.175080925255138 A103A-I110A 0.173475153671871 M283A-G367A 0.172757771724163 R299A-P306A 0.172024648437268 T149A-T359A 0.171955348201748 W107A-T359A 0.17108719759789 M59A-G143A 0.170899163249731 W107A-T364A 0.170624930610348 P146A-W360A 0.170507651566615 L25A-G460A 0.169689895733755 T237A-W452A 0.169564123033882 A102A-G367A 0.167470190447545 V22A-I459A 0.166805082766729 G315A-A322A 0.166444848306158 T100A-T356A 0.166443275775989 C238A-G460A 0.16641784570611 Y150A-A328A 0.165743019262217 A102A-G457A 0.165319193679888 E132A-N369A 0.164794536520556 Y137A-S368A 0.164627649891039 H141A-Y303A 0.16435619812813 E111A-W363A 0.164325609155696 I20A-T29A 0.163844467182253 V14A-V22A 0.163537542319353 L105A-N369A 0.163293893973036 W57A-W324A 0.16313425815839 V47A-G315A 0.162737357274563 C99A-F106A 0.162689544656873 T359A-L366A 0.16261053504593 S98A-A357A 0.161948923619702 D232A-V462A 0.161927875047922 L135A-G143A 0.161877473271966 H141A-V290A 0.161773987864384 Y303A-W316A 0.161738121518358 S289A-P298A 0.161694761256921 F15A-G451A 0.16150723807577 D305A-W316A 0.160450718568635 W27A-L455A 0.160325785290959 M283A-N369A 0.159730940663636 L63A-W324A 0.159692369270108 S138A-L301A 0.159142068628825 W239A-G460A 0.158813107473621 L105A-L366A 0.158362507325323 G143A-T317A 0.157933485534666 I240A-I459A 0.157610773900769 G271A-G278A 0.157441359436384 F140A-P146A 0.157344794735394 F96A-S101A 0.15723669722142 Y264A-S358A 0.157183513371141 S138A-M295A 0.156946588851695 E111A-T364A 0.156894412381966 A103A-G457A 0.15643777576636 H141A-V325A 0.155919381406426 G143A-M292A 0.155097544203389 G143A-T359A 0.154871466505113 S277A-F286A 0.154427786911373 M283A-G291A 0.154311023294824 S289A-W363A 0.153979946335389 C99A-W107A 0.153777123728019 C99A-W324A 0.153772683661808 V273A-M283A 0.153528597109888 Y150A-Y320A 0.152504866094179 I21A-W27A 0.152444819366229 H141A-F286A 0.15230652651173 W142A-L355A 0.150569046882356 G23A-G460A 0.150347639789347 I240A-I461A 0.15007147245524 I112A-G134A 0.149732699809158 I112A-T317A 0.148452481552816 I245A-I454A 0.148422950254179 V456A-I461A 0.148367470164299 D305A-V318A 0.148289441458472 F44A-F55A 0.147696036884589 A244A-R449A 0.14734412437939 M292A-L301A 0.147204685529076 L145A-Y296A 0.146939863028008 L270A-T359A 0.146740894576432 Y58A-F319A 0.146711171438966 T287A-W360A 0.146449383943811 W57A-T317A 0.146227448289678 G134A-V290A 0.145555837732689 Y296A-Y303A 0.144087297576695 A136A-T317A 0.143872312624758 M59A-A328A 0.143800204586728 V47A-V325A 0.143689538979835 V104A-S138A 0.14304964636626 V14A-V448A 0.142933552927641 L19A-W27A 0.142757953948511 I275A-V365A 0.142575663964444 I240A-G451A 0.142177634394929 Y58A-W324A 0.141901607995202 N49A-W316A 0.141632786817401 M300A-G315A 0.141400863180439 G354A-L362A 0.140779071855013 T149A-T317A 0.140677398784359 F44A-A322A 0.140478579915311 W107A-L366A 0.139314183003638 Y303A-Y320A 0.139267827770849 G108A-G271A 0.13906571303663 W452A-G457A 0.138450144461226 A102A-T359A 0.137950358129215 E111A-S138A 0.137641028496516 Y58A-Y327A 0.13753940332862 P144A-L293A 0.137408483199038 S289A-N369A 0.137304876414718 P306A-P313A 0.136800327762165 W360A-S368A 0.135519186876669 T100A-I257A 0.135420815865304 W51A-P313A 0.135107894531641 I241A-I458A 0.13508627854582 F96A-S259A 0.13504979609042 Y58A-Y303A 0.134841459384037 A136A-N284A 0.134266019195634 W147A-L353A 0.134254110416355 I112A-W316A 0.133998336710749 L362A-G367A 0.133798585812783 W107A-Y320A 0.133075065295454 R449A-I454A 0.132819325747707 I20A-W27A 0.132196633603181 H141A-Q314A 0.131904867260602 W57A-L63A 0.131904839877158 A97A-A102A 0.131091585346721 I236A-G460A 0.130978125518047 C238A-S453A 0.130671243957226 Y303A-F319A 0.130649098569474 G271A-M283A 0.13043741441698 W239A-I458A 0.13033434691859 I24A-T29A 0.130213824661167 M59A-Y327A 0.130065667131452 F267A-V365A 0.129976425276983 T100A-S358A 0.129758726772315 G143A-S289A 0.129743985699808 G143A-Y320A 0.129678941424459 V276A-L366A 0.129314250013794 V247A-L447A 0.129145395589678 L135A-V365A 0.128891919713462 G108A-H141A 0.12861266220206 W107A-W321A 0.127821660690291 F106A-N369A 0.127708092300565 I112A-H141A 0.1276681208837 M283A-W360A 0.127548743861137 G108A-G134A 0.127446859098872 G143A-P298A 0.12713998423321 L133A-D288A 0.126747124938208 C99A-L270A 0.126340604508626 G108A-M269A 0.125008300495753 I236A-I450A 0.124958974906537 S289A-A357A 0.124891682016846 M292A-L297A 0.124867871791857 V60A-H141A 0.124601875261806 N284A-N369A 0.124494776290418 E56A-V318A 0.124153331876185 V61A-L301A 0.124068856463969 E56A-G315A 0.124008906891531 F96A-R262A 0.123908395442451 V273A-S280A 0.123214874394878 A54A-P313A 0.12283507790278 L145A-T356A 0.122734123683287 L139A-Y320A 0.1223280925307 W107A-W324A 0.121720579552466 V14A-L19A 0.12167130620945 R299A-F312A 0.1213628695068 A102A-S263A 0.120867523273204 I234A-I458A 0.120655058543269 S138A-T356A 0.120413173588262 A103A-W323A 0.120187624217984 A102A-I110A 0.119990090960558 S289A-V365A 0.119755595477622 L105A-L265A 0.119658200981396 P144A-L297A 0.119576007704266 G278A-T364A 0.119278948061708 V247A-I450A 0.118963211296614 H141A-G315A 0.118631831721458 L265A-L362A 0.118416683502283 S266A-V365A 0.118276615587437 V50A-Y303A 0.118252073984448 W107A-T317A 0.118220219356166 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