[Wed Aug 24 17:43:21 2016] >Input file: TM4BBJCGD.pdb >TM segments: A11-33_A35-62_A75-102_A111-129_A267-290_A293-317_A604-628_A633-657 MAIDEN score = -70.0835 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. ----------- ---------------- BBeads pair Empirical energy ----------- ---------------- I122A-C312A 10 T123A-C312A 1.15803431843124 A94A-V112A 1.09646375776613 L627A-L633A 1.08961550208258 W88A-F116A 1.05521559162345 F61A-F77A 1.02728346714104 F283A-Y297A 1.00728318181325 W88A-A119A 0.875496648493061 L622A-L634A 0.870614660458734 L622A-L627A 0.868581722700288 F611A-V651A 0.85795000223415 A50A-E117A 0.842848407682038 I308A-V620A 0.834920313939682 E117A-I122A 0.833546262746035 V23A-F116A 0.800504236616677 F61A-T78A 0.795547862686346 V305A-V620A 0.717892529302325 L622A-L633A 0.710800184322041 N75A-V267A 0.708442737041625 F283A-L299A 0.688646986250456 F13A-L127A 0.68803698308642 L19A-L49A 0.687810322446567 I284A-G298A 0.683851928153032 F283A-A302A 0.676767798465665 V285A-G298A 0.676271779626056 F283A-A301A 0.668474598529593 F61A-I80A 0.66156453207915 A87A-F116A 0.659418543055734 L622A-L635A 0.657113480689189 P22A-Q46A 0.648369504122275 V126A-A313A 0.646314927609786 A87A-V114A 0.631677079345047 P621A-L627A 0.63000654097498 V54A-W59A 0.624600524284006 A87A-V303A 0.621594226097927 A81A-V86A 0.62024659909075 C310A-F613A 0.617696867427821 F62A-T78A 0.616824414006246 R12A-L17A 0.610510739523352 F62A-A81A 0.61042501591535 L125A-C312A 0.60984364984998 L288A-A294A 0.609192330680875 F61A-A81A 0.608234797144482 Y628A-L634A 0.602813935442211 I308A-A640A 0.598917103628341 F62A-F77A 0.590735073529494 L79A-S268A 0.582157487800968 R11A-A16A 0.581834832015033 M82A-C310A 0.581359459172525 A313A-N608A 0.578129260678356 I308A-V617A 0.570217842204213 A612A-V651A 0.569764435219705 F13A-T124A 0.555776995245512 V303A-A623A 0.5547076513384 A313A-F611A 0.554201508551893 L19A-A50A 0.55324462730798 V86A-I307A 0.548110422523918 G39A-V112A 0.547148218526814 L314A-L609A 0.544619673925807 S282A-G298A 0.543452531190391 A317A-N604A 0.540949661008305 V305A-G619A 0.538578912991653 V54A-I84A 0.531461484460782 A309A-F613A 0.529435536684334 L47A-F116A 0.526791535616859 L26A-S42A 0.524297898680482 F283A-L295A 0.523859498202941 A287A-Y297A 0.519489664186783 A279A-V303A 0.517982085363699 F611A-L646A 0.516878494711742 V54A-A119A 0.51520015068484 T20A-V121A 0.513914206009349 P311A-F613A 0.510322500292161 L125A-L316A 0.50994719851543 V53A-T123A 0.508436348805649 V54A-A120A 0.505674511382213 A16A-T123A 0.504342853496247 E117A-P311A 0.496550500600317 V305A-A624A 0.496509332588756 F611A-S650A 0.496020595928217 V53A-A119A 0.495055314431635 N40A-I45A 0.492301538195369 A309A-V617A 0.48422882423074 L79A-P311A 0.482971646485219 V285A-G290A 0.477973878069121 Y90A-V114A 0.472712340283411 T20A-A50A 0.472574072040476 N40A-V111A 0.470281736855219 L289A-A294A 0.46146106177521 I80A-P311A 0.457985839395755 N75A-I80A 0.455718425706916 A50A-F116A 0.455441559544222 I122A-P311A 0.454949557366511 P52A-E117A 0.451162791405001 S304A-V620A 0.447629814997176 Q607A-V651A 0.446427208120499 V278A-A624A 0.443401172720649 V24A-G29A 0.436238931316822 A309A-V620A 0.435940945716291 S648A-I653A 0.435552899646368 V278A-A302A 0.432595682291494 F13A-L128A 0.432252510296139 A94A-V114A 0.430797879676663 T20A-L49A 0.428193545641943 R11A-L127A 0.427193008945127 W286A-L295A 0.426346106486565 R12A-L128A 0.426162685135487 R12A-L127A 0.424811718472107 A317A-V651A 0.41966166128331 V121A-C312A 0.41901077703028 R12A-V53A 0.413560913476403 W286A-Y297A 0.413522120355896 M92A-W97A 0.410576902202005 Q607A-Y615A 0.40933770607093 V278A-V305A 0.408976503725954 F611A-S648A 0.408083736046107 S43A-V95A 0.40460846061816 S43A-V114A 0.402438869895952 S647A-I652A 0.399948326365994 W44A-V95A 0.395017936077351 V275A-A309A 0.393048017425958 V54A-T123A 0.3924097614823 A313A-V651A 0.389992913700639 I84A-A119A 0.389303238222809 V305A-C310A 0.38834606053387 A94A-V111A 0.38662158757073 W88A-Y115A 0.385745654425989 F283A-I300A 0.385095471165372 L33A-S38A 0.37773065406972 H31A-S42A 0.377560128024357 Y615A-S647A 0.37640149616585 A50A-A119A 0.376395499629438 I605A-F610A 0.37628037756089 A118A-A645A 0.376085395592953 V23A-L49A 0.376053564306848 A87A-A302A 0.376018167112744 A317A-I605A 0.37016723517957 T20A-T124A 0.370136520981468 A113A-P637A 0.369545665263686 N40A-V95A 0.368929181454599 G85A-C310A 0.367323421825292 L277A-S282A 0.364985103917945 L125A-A313A 0.363714200650233 C310A-M644A 0.362645074699781 P22A-W44A 0.361359802117103 N75A-W270A 0.359757781378617 Y615A-L646A 0.35468930225055 A317A-L609A 0.354374780537621 F61A-C310A 0.353915451914917 V275A-V280A 0.352116355232516 A118A-A309A 0.351410762579666 G39A-Y115A 0.350569390734609 Y297A-V626A 0.349773144430936 M76A-G269A 0.3485598229734 V86A-V303A 0.347983129975749 A119A-A641A 0.346649959557119 A87A-I307A 0.346100637353842 F611A-S647A 0.344801041538693 E27A-G41A 0.344664403029131 W59A-M76A 0.343655434669589 L128A-L316A 0.342854390924231 S91A-A113A 0.340246462274207 S91A-V112A 0.338754916016764 M82A-L306A 0.33849442750251 V126A-L314A 0.337908324322298 A612A-S648A 0.33730727563983 L128A-G315A 0.336652959226292 L299A-S304A 0.33296779675764 S282A-L299A 0.331958743278268 T78A-C312A 0.33110911908173 G57A-T123A 0.330669344405592 V114A-P637A 0.329555009616257 S304A-A624A 0.326570167007685 G58A-T123A 0.326499706325731 V54A-Y90A 0.326404959935467 V86A-S91A 0.326016416564907 L314A-N608A 0.325898293701114 I639A-M644A 0.324872368630341 I84A-I307A 0.324435269884912 G57A-A81A 0.323562092482141 G83A-A302A 0.322802011335177 L316A-V651A 0.32051863987415 T78A-T123A 0.320220859710496 V305A-M644A 0.319034179889786 S91A-P637A 0.318847903264013 L19A-V53A 0.317727753155856 P60A-N75A 0.315785630551796 I25A-G30A 0.315134555333055 V275A-V305A 0.313555623193306 N608A-M644A 0.313071947217073 A87A-A309A 0.31288986054629 A118A-A640A 0.312313041810258 A287A-G298A 0.311881702119844 G619A-A641A 0.310769675740462 L17A-T124A 0.309261717524081 G57A-G85A 0.308917239403864 L49A-E117A 0.307567096270372 A16A-V121A 0.307547107664316 P311A-N616A 0.307233517432752 P621A-S636A 0.307150611360984 V93A-P98A 0.305830242222002 H31A-G41A 0.305749094430385 Y628A-L633A 0.305485488163862 A87A-A640A 0.304590702895374 Q607A-A612A 0.302405213249927 A87A-A118A 0.301939199491086 I122A-A313A 0.301305732348127 Y90A-P102A 0.300661944162303 I276A-A302A 0.300430632428827 P52A-Y115A 0.29999136519097 V272A-L277A 0.299694327772443 G315A-S647A 0.29949591299203 N616A-P637A 0.299494174850672 P52A-W88A 0.299178200524471 S304A-L635A 0.298819672622288 G30A-S43A 0.298539273998803 G85A-S304A 0.29812102615459 I89A-A94A 0.295214881426639 L125A-L314A 0.295061676750007 P22A-T51A 0.294595141015031 L627A-L634A 0.29446924827945 P52A-G57A 0.294050444752799 L49A-A120A 0.293780314801455 S42A-A50A 0.292835469204442 V23A-I45A 0.292715856512041 S268A-A612A 0.29128887490661 V126A-L316A 0.29066796286502 L127A-G315A 0.290374995624462 S91A-F116A 0.290245660971441 Y115A-P311A 0.288417512000018 A301A-L635A 0.288188137112739 L79A-G315A 0.288150272723771 S42A-A94A 0.287296778410731 V114A-S636A 0.286236200655699 A309A-A624A 0.286127943619201 V278A-Y297A 0.285610168319634 G625A-L634A 0.285293641472494 L19A-A120A 0.284568187585105 N604A-A655A 0.284458352933155 L19A-G57A 0.283591148012137 M82A-I307A 0.281862078744078 I300A-A623A 0.281425545848643 N75A-C310A 0.280418365935752 A279A-L306A 0.280126987824238 A623A-L633A 0.279909214110166 L79A-A309A 0.279788037457549 A313A-L609A 0.279598245996716 A279A-L299A 0.2790774814468 V649A-N654A 0.279016581736312 V305A-V617A 0.276903790673162 P311A-A612A 0.276748228836063 G83A-I308A 0.275872760961596 F13A-C312A 0.275847470598149 M28A-Q46A 0.275457909518179 P98A-S296A 0.274519221946709 V86A-L306A 0.272833879493333 A317A-A612A 0.272367894503803 A301A-S636A 0.272334478011819 Q607A-N654A 0.270988088202948 V278A-F283A 0.269819338932596 I45A-A50A 0.269234970464342 G39A-V111A 0.269201161911879 N40A-E117A 0.2678309967556 W88A-V93A 0.267716649170644 N616A-P621A 0.267636001131916 T78A-S268A 0.267621780411125 Y90A-P637A 0.267079833748031 I80A-C310A 0.265516828423172 C310A-Y615A 0.264908538804076 M82A-V267A 0.263948482881176 T51A-T124A 0.263897786784478 L289A-G625A 0.262549125002202 V626A-L633A 0.261305232377083 W59A-G85A 0.260614729525494 H35A-N40A 0.257511466616014 V275A-L306A 0.256406879251678 L79A-V272A 0.255107669471083 V275A-V620A 0.253168463246543 A301A-G619A 0.252957992753644 F116A-V121A 0.251882314754608 M28A-V112A 0.251232030322932 S38A-Q46A 0.250896647490886 I37A-S42A 0.250686795282235 A302A-A624A 0.250663025511417 L609A-S647A 0.250514563948887 P311A-L646A 0.250287845346457 S38A-S43A 0.250210027057474 N75A-P311A 0.249787899942574 C312A-I605A 0.249353965823225 N75A-G315A 0.249253264621052 A113A-S636A 0.248022678710083 L79A-C310A 0.244323851255338 V126A-C312A 0.243992447463524 C312A-I653A 0.243120724847698 A94A-A113A 0.242210324499826 A287A-A294A 0.240674717122253 M82A-A87A 0.239690967428212 Q46A-P637A 0.238997425844146 L17A-P52A 0.237873761778626 I307A-A640A 0.23775265903755 A313A-Y615A 0.237120657450391 V280A-V285A 0.235009960356763 E27A-V114A 0.234094665488607 A94A-F116A 0.233396583352399 G83A-C310A 0.233311004683686 S304A-N616A 0.232551986111326 S647A-N654A 0.232540857336433 A279A-Y297A 0.232494387620437 S42A-L47A 0.232169141604114 G85A-E117A 0.231713324386512 Y90A-A119A 0.231132106236211 P311A-P637A 0.230192635881608 A87A-S636A 0.228875239846611 A313A-M644A 0.228765109755402 T78A-L306A 0.227345683234896 R12A-A120A 0.226353139065938 F36A-S42A 0.225337340089352 V278A-I300A 0.225104234993189 S91A-L96A 0.224415956666112 T123A-L316A 0.224091956009063 V280A-W286A 0.223612535301539 W14A-P52A 0.223202409679265 P273A-L306A 0.22301760122959 N40A-Q46A 0.222757729969703 P98A-Y297A 0.221451696379386 F613A-S647A 0.221334858198623 V114A-I307A 0.220361277748446 G58A-L125A 0.220083020095957 N604A-N654A 0.220013845420563 Y615A-V651A 0.219278514142768 L299A-G625A 0.218548523485232 S38A-A113A 0.21832383497957 A87A-L306A 0.216826016861366 F101A-A294A 0.216533861371164 V95A-V112A 0.215997894298259 C312A-I652A 0.215305173862004 M18A-V54A 0.214292041272821 P22A-P637A 0.214188649061671 V23A-M638A 0.213386921067277 Y615A-P637A 0.212675675730969 Q46A-Y115A 0.211899486618775 Y297A-A302A 0.21157424068101 V114A-S304A 0.211306651128307 V620A-L635A 0.211081900832388 T124A-C312A 0.210477167748243 W56A-T124A 0.210170538729784 S91A-A120A 0.209592112035627 G83A-N616A 0.209339259185259 V303A-L635A 0.209194916659422 T51A-W59A 0.20919451144264 G99A-S296A 0.208899593027403 Y90A-Y115A 0.20881421721417 G83A-V272A 0.208796499661866 L316A-N608A 0.208085857941742 Y615A-S650A 0.20775985044011 N75A-G83A 0.207334500304236 P621A-P637A 0.207048163967225 V23A-L47A 0.206994979153595 L17A-V53A 0.206698448199387 A317A-R606A 0.206572026260966 F283A-V305A 0.205960518371779 I89A-C310A 0.205590345547366 V272A-L306A 0.2055504319123 F613A-V651A 0.205421111714229 L314A-S648A 0.205219780525765 A317A-Q607A 0.204510390199718 S91A-V303A 0.20448436694413 T123A-I307A 0.204468229660882 L314A-V651A 0.204402248025336 G29A-G41A 0.204295054628957 L26A-Q46A 0.203586800111125 F62A-M82A 0.203513786966502 G315A-Q607A 0.203022327454296 M644A-V649A 0.202862765258867 M76A-L306A 0.202783578106363 A279A-A624A 0.202631125518459 S304A-V617A 0.201783606855859 P22A-G39A 0.201546103361919 G83A-W88A 0.200254190629395 P22A-G32A 0.200225945583197 F61A-C312A 0.199294084856918 C312A-V617A 0.198748256971387 V53A-F61A 0.198411317316075 A624A-L634A 0.198124722126672 F77A-M82A 0.197905668252104 V24A-S43A 0.197688165404408 V272A-I308A 0.197327622604562 F36A-Q46A 0.197080914505857 A279A-S304A 0.196946847942266 P98A-V112A 0.196807992583673 V275A-G619A 0.195615282244334 Y115A-C312A 0.195533032914241 I284A-G290A 0.195277841112568 E117A-A645A 0.19452405907885 N604A-S650A 0.194176169217986 V280A-A302A 0.194097339771364 V278A-L306A 0.194072937989537 N608A-R657A 0.193697180325909 N604A-L609A 0.193219497262051 S43A-P98A 0.192806971824482 I308A-Y615A 0.19275100635322 M76A-S268A 0.191948646737577 L47A-V95A 0.189880406754658 V121A-S648A 0.189810545486001 L96A-V112A 0.189169029419038 S42A-P98A 0.188376462848087 L306A-P621A 0.188278693297629 A118A-A641A 0.187649287689788 G39A-W44A 0.18735871549944 G315A-I605A 0.187221704509456 P22A-Y115A 0.187220842451141 V275A-L281A 0.186917393134026 F613A-A645A 0.186915724943657 G298A-Y628A 0.186891634595725 S296A-A624A 0.186710723426193 V303A-S636A 0.186328088202043 G39A-P637A 0.186293285133531 L314A-S647A 0.186151249025595 F283A-G298A 0.185592881065812 V285A-L295A 0.185295946892905 G269A-G315A 0.18376350079809 M18A-L127A 0.183016035937393 E27A-H35A 0.182966124598548 L622A-Y628A 0.182906005282523 G41A-M92A 0.182870556053396 R11A-V126A 0.18229187241935 F77A-T123A 0.182015490161327 W97A-V112A 0.181480737930444 C312A-S648A 0.181453552489069 F611A-A655A 0.180999909834966 G619A-Y628A 0.180885219184953 V267A-L609A 0.180803921978403 T78A-I308A 0.18065111025149 V23A-G41A 0.179906469668951 S91A-V114A 0.179635080324942 A279A-A301A 0.179630607200926 L49A-G58A 0.179299091664424 S304A-A309A 0.178667979330061 P98A-V111A 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