[Wed Aug 24 17:50:47 2016] >Input file: TM3PQRCGD.pdb >TM segments: A35-60_A73-100_A102-137_A151-181_A202-228_A248-273_A286-309 MAIDEN score = -41.9377 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 ----------- ---------------- P171A-S176A 10 C264A-F294A 6.90790654822331 C110A-Y178A 2.27734277217054 Y136A-C222A 1.79491385177675 P171A-R177A 1.76336826970612 P170A-W175A 1.52874475237704 P267A-P291A 1.32993251365346 T97A-Y102A 1.23669552830094 P170A-R177A 1.00838589288638 W265A-F294A 0.976341005084995 A82A-E122A 0.947718291272823 T118A-C167A 0.928976811355664 F88A-T93A 0.82798132508106 W265A-A295A 0.81733745160279 A169A-W175A 0.815513748090085 V129A-I219A 0.807647699061594 Y223A-V254A 0.806719571015973 W126A-F159A 0.802864577564252 L79A-I123A 0.799122141937166 F85A-F116A 0.791751664378973 W175A-F203A 0.784411567952733 V209A-I214A 0.774245713119825 I123A-W161A 0.722844118833546 N78A-I123A 0.718733098919541 V304A-M309A 0.711509969309833 T97A-V104A 0.70420943543543 N302A-I307A 0.702201147878847 L50A-V300A 0.694721753974399 N55A-V81A 0.692725662858425 M86A-F116A 0.687013112213767 L76A-Y306A 0.677878264838106 A82A-L119A 0.677340787198143 R135A-C222A 0.677257515385657 L47A-A299A 0.667144891089217 V81A-G120A 0.664036560073582 C110A-F115A 0.662896654788851 A132A-Y223A 0.658865715255114 L47A-K296A 0.65162278860976 L119A-C167A 0.634681547175714 Y136A-L226A 0.627625892652727 G90A-F116A 0.624842044414624 R135A-L226A 0.620152528757936 F85A-A117A 0.618511783091009 W35A-L40A 0.611480677084275 C264A-F293A 0.606384320576951 C264A-K296A 0.59605556171652 M44A-F91A 0.593354947430566 E122A-C167A 0.588761127761826 F85A-G90A 0.58866429336009 L165A-P170A 0.581009574204774 I48A-V87A 0.576057042015497 I75A-V157A 0.57379421472911 F52A-D83A 0.566383284322374 V227A-T251A 0.553868542433698 F261A-L266A 0.553058709909422 F105A-C110A 0.550352251047631 D83A-A124A 0.548051965260926 M207A-F212A 0.546967401027616 V130A-R135A 0.544986692359971 N111A-I179A 0.543991276687539 T97A-F103A 0.543803878573944 F37A-A42A 0.54185312700651 F116A-A168A 0.541760117756986 M86A-K296A 0.541713780685539 M44A-T94A 0.541322431542841 Y223A-F228A 0.538002529161338 W161A-A166A 0.535431116850498 M86A-F91A 0.53184556043924 L79A-S127A 0.528271395246971 A41A-Y96A 0.525864730631727 L40A-S98A 0.525553712541034 F85A-L119A 0.524932457163621 F52A-L84A 0.521081955254274 S38A-S98A 0.519320711907572 L119A-W161A 0.514642428436179 F52A-L57A 0.511313846687913 E122A-W161A 0.511111532614884 L47A-F91A 0.509190501979578 W126A-L131A 0.508121410653725 L172A-Y178A 0.507782617201933 D83A-F88A 0.506737407332952 S38A-L99A 0.505286664222913 L47A-F52A 0.503007418798463 M44A-T92A 0.502393703061447 F208A-A269A 0.501436391399458 N78A-A124A 0.501237810912753 V204A-A272A 0.498913708060069 F56A-A80A 0.489529803121111 L266A-P291A 0.48152901055452 Y74A-V157A 0.479271400422554 W126A-T160A 0.472498165234946 C264A-A295A 0.467062940968698 K248A-M253A 0.465993244070111 I54A-P303A 0.461452028890983 P267A-I290A 0.45520396040743 A132A-V218A 0.452559765971353 G114A-Y178A 0.448691121753678 F208A-I213A 0.447089626973638 I219A-G224A 0.445695917220255 E181A-M288A 0.443337734160573 E113A-P171A 0.44252265061314 I154A-F159A 0.437336658236864 E122A-P215A 0.437173308844285 F37A-L99A 0.436730918177243 F220A-Q225A 0.430965706682529 E122A-M163A 0.420117935250049 V204A-V209A 0.419475275443827 I256A-F261A 0.417593779308534 G90A-E113A 0.417460640650889 I219A-M257A 0.413796465690884 M86A-A299A 0.411373462843318 I75A-L131A 0.409564526270848 S38A-Y43A 0.408973971369286 V87A-A117A 0.407969268190524 I75A-G156A 0.40788941380267 E249A-V254A 0.404843042962633 P267A-A272A 0.401715590460368 I48A-P53A 0.400877207801615 T97A-E181A 0.400843591576166 L131A-Y136A 0.400701235795855 L266A-V271A 0.395589828099552 F212A-I217A 0.391769360206168 A82A-I123A 0.390321053694449 N111A-P171A 0.388790301872739 T118A-A164A 0.388756048169098 L262A-P267A 0.387898249402477 I48A-F91A 0.387136005420762 Q36A-Y96A 0.385263307342753 G51A-V87A 0.384229915541605 S127A-T160A 0.383864739607585 V129A-E134A 0.38204768168921 F45A-F91A 0.37650233696514 L47A-V87A 0.374220945006682 A132A-I219A 0.372964081042575 N73A-A153A 0.370124585492039 L47A-V300A 0.370058163869887 W126A-M257A 0.366266683881203 F45A-L50A 0.365753252195223 I263A-F294A 0.363729659901261 A117A-A299A 0.362835094418291 C264A-P291A 0.362090866269422 L40A-L95A 0.360036010454988 L40A-T94A 0.358651817572475 Y136A-V254A 0.357097503397677 V210A-Y268A 0.356492726351009 L119A-A168A 0.356247948971359 Y136A-Q225A 0.356242036983512 T58A-A80A 0.355248932669094 A292A-A299A 0.354167370636225 L76A-S127A 0.352004466014089 C110A-R177A 0.350080690023588 N55A-P303A 0.349281210004506 V218A-Y223A 0.349227132686519 V129A-V218A 0.348358830988539 T58A-L77A 0.347647354447258 P53A-N302A 0.34672852221839 A80A-K296A 0.34658429189766 Y96A-G109A 0.345295046605687 F208A-I214A 0.344714834011114 L172A-R177A 0.342037104443433 E181A-F293A 0.339093968455852 H152A-V157A 0.338698915957965 F228A-E249A 0.33858566027933 V81A-Y306A 0.336556533398319 V250A-M308A 0.336433635386711 V81A-M163A 0.335480804222877 G121A-Y268A 0.334935460788356 S127A-H211A 0.334572604488688 I133A-C222A 0.331924996515751 E122A-F261A 0.331738842626946 G90A-A295A 0.328781498361189 T97A-C110A 0.328148644348418 C110A-I179A 0.327172138194419 T94A-T289A 0.32622005417195 F212A-W265A 0.324889947805534 A82A-G90A 0.323422196827767 C222A-I259A 0.322683254861842 P107A-E181A 0.320085215710469 Y96A-G106A 0.319907353311946 G109A-A117A 0.319628817871629 C264A-G270A 0.318435833901429 P171A-Y178A 0.316278492553404 G121A-Y301A 0.316065893309777 M86A-G120A 0.315452089612962 P171A-S202A 0.313638149311552 E134A-C222A 0.312149056098947 Y74A-L79A 0.311570386628421 I219A-C264A 0.310856605370531 H211A-G270A 0.309577136328031 A42A-K296A 0.307997512431788 L59A-L77A 0.307682382330494 N78A-V157A 0.307397433601797 L79A-E122A 0.307212209740304 G114A-A164A 0.307041274614142 F37A-S98A 0.306985514420947 L47A-T297A 0.305981169233606 T94A-E181A 0.305383846026805 C222A-T251A 0.301315192533206 A41A-G90A 0.300562145816345 I205A-V210A 0.300074034126693 L119A-L165A 0.299710952904724 A41A-T94A 0.299672278154998 F115A-A169A 0.299225811993145 C264A-T289A 0.29767263752708 Q36A-A41A 0.295367725936751 T160A-P215A 0.295285028420543 L77A-A82A 0.294671793347224 T118A-P291A 0.292050359021451 I54A-V300A 0.290979422368833 I214A-C264A 0.289353929451034 H100A-G106A 0.289159933179709 R135A-M253A 0.2878705668166 L84A-A299A 0.287045614972549 V227A-V254A 0.284555597744567 Y74A-P303A 0.283405549697511 G51A-L79A 0.283128014885951 M44A-L95A 0.283065567647932 A41A-L99A 0.282551425781662 W126A-W161A 0.281521104526842 L50A-A299A 0.28095085019578 W35A-T97A 0.280946446514231 N111A-C167A 0.280819720431773 W265A-M288A 0.280361792918107 V250A-Y306A 0.280163837013083 L112A-A117A 0.279731836912524 L119A-A124A 0.279599520787338 L59A-A80A 0.279256335201617 E134A-Q225A 0.278056831364386 P171A-Y206A 0.277411982972811 V81A-Y301A 0.276718821058228 G174A-S202A 0.276696576818678 Y74A-I154A 0.275214834180314 A124A-G156A 0.274816004338547 T93A-T108A 0.271307532201609 N78A-E134A 0.268295254861202 T93A-P180A 0.267463041483691 M39A-H100A 0.267133903143685 C167A-M207A 0.265250225803226 S176A-F203A 0.265089612347865 L77A-G156A 0.265079131706813 N73A-H152A 0.264897420346445 G90A-A299A 0.264319420232985 R252A-Y306A 0.262503032693977 I54A-A80A 0.261528877782049 Y268A-F273A 0.260690034478873 G121A-N302A 0.257089678947553 N55A-L84A 0.256557809443296 N73A-S127A 0.255434388461253 N73A-P303A 0.253172813884366 L131A-H152A 0.252084949576035 N111A-L172A 0.248311126298534 L40A-H100A 0.24826341479815 L46A-P53A 0.247940000959239 W265A-T289A 0.247744137134714 V129A-P215A 0.247215091446977 S127A-V157A 0.247158724380074 F88A-F116A 0.247019918603015 I123A-M163A 0.245610703942586 L84A-G120A 0.244708573184486 D83A-V304A 0.244277498668677 F212A-G270A 0.243312061187361 G120A-H211A 0.243280862942273 F91A-G114A 0.242868427753888 S127A-P303A 0.242857349387863 P215A-L262A 0.242212754750506 A80A-Y301A 0.241779381612622 E134A-F220A 0.241663153080898 Y96A-Y102A 0.240311976260486 C110A-T118A 0.239523727737877 G51A-G89A 0.237671444376953 P267A-T297A 0.237139306347319 Y43A-P291A 0.23658804602423 E181A-P291A 0.236406342780973 L125A-G156A 0.235266630054061 P107A-L172A 0.23441720741396 F159A-A164A 0.232531849320033 A299A-Y306A 0.230102776477555 Y178A-F203A 0.230059928899583 N111A-G174A 0.22987030301224 E113A-L119A 0.228965623677275 T94A-C110A 0.228245559379465 E122A-V162A 0.227982132032202 V81A-V87A 0.226874781541408 R252A-M309A 0.226830495136597 F115A-A166A 0.2265625283823 P215A-W265A 0.226489874801812 L47A-T94A 0.225637537424621 L46A-G51A 0.22554765503808 F56A-A299A 0.225230965619753 A41A-L95A 0.224884671203408 L125A-P303A 0.224186848951626 V204A-V210A 0.222860388637304 P53A-L77A 0.222635911855969 L47A-S298A 0.222437591934789 F203A-Y268A 0.222211393071799 W161A-H211A 0.221188614576707 F91A-Y102A 0.220596516053724 Y43A-I48A 0.219150116039904 Y206A-A269A 0.21826894806332 Y136A-V250A 0.21766904605267 C110A-C167A 0.217660363753174 G89A-L112A 0.21682905554866 M86A-T118A 0.216679994742112 F261A-A269A 0.216139144865238 D83A-G121A 0.216021373012969 V227A-I255A 0.215831296372651 L262A-P291A 0.215631589015617 E122A-L128A 0.215593259564549 H152A-T160A 0.214878676269446 I75A-V130A 0.214815792641565 C167A-Y206A 0.214690228848916 R177A-M207A 0.214319280295638 Y206A-A272A 0.214170806347283 C222A-I255A 0.213970276943266 C110A-P180A 0.213736885870643 G114A-I179A 0.213180290659498 F208A-V271A 0.21227493288937 L128A-V218A 0.210682129694854 T94A-G106A 0.210429138668373 W265A-T297A 0.210391596314939 G270A-T289A 0.208498443249694 V87A-T92A 0.207762839520764 M288A-F293A 0.207283754925054 G120A-V162A 0.205666174325464 C167A-I214A 0.205590345547366 V227A-V250A 0.204840090229409 F261A-Y306A 0.204584363324779 A132A-G156A 0.204261796774162 F103A-C110A 0.204076535513034 V130A-Y306A 0.203952507462986 V210A-L216A 0.203905956951562 L84A-G89A 0.203785510002026 G121A-P303A 0.203397660035503 M163A-V204A 0.203354952195994 F293A-V300A 0.201482020967611 F221A-V254A 0.201373844151026 L128A-M155A 0.201230771659557 T118A-H211A 0.200875075323298 V204A-G270A 0.200221948000239 G89A-T108A 0.199846462618441 M257A-L266A 0.199009120137847 C222A-R252A 0.198820079741799 T118A-I123A 0.198702638615722 A82A-A295A 0.198316309200294 G120A-C167A 0.197945024018528 G89A-A117A 0.197910873999605 G121A-P267A 0.197640840901719 T94A-I179A 0.197218600038882 V129A-F212A 0.19683321830494 L47A-N302A 0.19538355868923 E122A-A169A 0.195249953534574 F115A-A168A 0.194702025198002 Y136A-H152A 0.194671856280832 I54A-M308A 0.194013064345931 L128A-C222A 0.193957802051833 G90A-P291A 0.193798763727077 G114A-E181A 0.192997732163455 D83A-G120A 0.192050150517734 A269A-T289A 0.191885357962453 N73A-R135A 0.191774294792157 Q225A-M253A 0.191295389604457 L131A-P215A 0.190851723783446 L84A-N302A 0.190832928940615 Y74A-A158A 0.190662324972855 L50A-M308A 0.190261769253179 G114A-L165A 0.189841109075696 I219A-T251A 0.189637349079494 S127A-A153A 0.189559460872029 L77A-M155A 0.188383374208072 T58A-D83A 0.188352052895369 M49A-L95A 0.188016707024623 A168A-F203A 0.187580429445739 V130A-G156A 0.187268974222833 A272A-T289A 0.186807032499127 G120A-A164A 0.186576345757941 F88A-N111A 0.186109705813024 P215A-P267A 0.18590138681683 F56A-N302A 0.185299932448574 A82A-F115A 0.184995811180801 I133A-T160A 0.184970608930562 T92A-L99A 0.184315759192101 V130A-M257A 0.184106685961901 L262A-K296A 0.182260657671562 L40A-K296A 0.181908388450942 F91A-T297A 0.181777711935282 V254A-I259A 0.181744000479118 V129A-I213A 0.181203077525316 E113A-P180A 0.181193879077343 Y96A-E113A 0.181044896972852 G121A-M207A 0.180299833173032 G114A-E122A 0.180188638035029 I214A-C222A 0.180180182967707 D83A-N302A 0.180169608548328 W126A-M207A 0.180156522368225 Q36A-M44A 0.179546651365945 G51A-D83A 0.179242519967087 M257A-V300A 0.178664367005588 Y96A-C110A 0.17857858494875 P107A-P170A 0.178355630542201 I75A-A153A 0.178338530843627 L76A-G120A 0.178001243642227 F85A-C110A 0.177953458392365 T92A-H100A 0.177595764966737 M86A-L125A 0.17655218938695 Y43A-S298A 0.176511887232283 V210A-P215A 0.176379831146517 F261A-T297A 0.175058475683624 T94A-F105A 0.174815557025107 F208A-C264A 0.173803138471397 T108A-T118A 0.173484766882365 F88A-K296A 0.173326241734021 L226A-V250A 0.172880954606878 T92A-G109A 0.172781752455041 Y43A-A292A 0.172580989893323 A124A-Y301A 0.172151827498412 V81A-S127A 0.171875584854535 F203A-F208A 0.171619549368836 D83A-F116A 0.171148697876092 G120A-N302A 0.171118151440644 R135A-V218A 0.170908990070562 R252A-A260A 0.170878131736739 Y206A-Y268A 0.170249069658817 I133A-I219A 0.170212958571486 Y60A-Y74A 0.169784949211453 G90A-Y102A 0.169664389772784 N55A-L79A 0.169120077415272 S202A-V210A 0.168926168388145 A260A-Y306A 0.168910957206477 Y223A-E249A 0.168850147091953 L165A-S176A 0.168616007018609 I214A-I219A 0.16838260435474 F56A-D83A 0.167728679529723 F88A-T118A 0.167677623920511 C222A-V227A 0.167506782459755 V130A-V162A 0.167436011982991 W265A-G270A 0.167392284353754 F85A-T93A 0.167092196825319 T94A-T118A 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