[Wed Aug 24 18:33:39 2016] >Input file: TM4S0VATD.pdb >TM segments: A53-80_A90-116_A120-150_A171-193_A210-245_A303-332_A342-368 MAIDEN score = -43.1462 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 ----------- ---------------- C193A-D211A 10 K221A-V329A 10 C127A-E192A 10 E192A-C210A 10 C193A-C210A 10 K327A-M332A 10 C76A-V94A 2.28498621802151 C316A-V353A 2.21566388115824 H224A-N324A 1.54919790695413 W120A-C210A 1.36830616635644 M305A-L367A 1.32534165806077 L326A-M332A 1.31737549164228 L143A-I176A 1.2262987191321 E54A-I116A 1.14576187679024 W120A-C127A 1.11319032927899 I320A-H350A 1.08855738726774 V140A-W177A 1.05263304862854 V114A-W120A 1.05132354814077 K128A-M191A 1.03255160126193 C127A-C210A 0.985505249854532 V136A-C181A 0.981519644280013 T104A-Y354A 0.969034093780024 F228A-V325A 0.961165554610602 V140A-I176A 0.883852436083674 A68A-D100A 0.873715655253863 L57A-W351A 0.842582690903357 F227A-Y232A 0.841158333833784 F122A-C127A 0.841041539716969 L69A-D100A 0.835618146337478 W120A-C193A 0.827633207254877 Y132A-I185A 0.818293675538011 V64A-Y354A 0.817950273623491 E192A-D211A 0.808640726809791 P131A-A188A 0.806457635393111 V190A-D211A 0.785827897174782 V325A-F330A 0.754577478237602 C76A-L98A 0.750016311335195 N95A-I173A 0.744279486522691 V190A-W214A 0.741049125363161 T144A-I176A 0.736537818349043 V103A-L133A 0.722576230653218 V138A-T231A 0.715252540652292 L69A-V101A 0.711733542972735 C193A-E212A 0.710591550444542 V312A-N356A 0.700100548003143 Y61A-L108A 0.69054227484528 Y317A-L352A 0.689899938396587 I320A-S349A 0.673709913423567 I320A-F346A 0.670610667187791 V136A-M184A 0.663643504269595 H224A-R328A 0.656850301445258 N72A-A358A 0.646168241292605 I363A-S368A 0.630170043044919 A99A-V138A 0.629826060905283 V142A-Y232A 0.628397336079674 Y61A-L112A 0.627330906997879 L108A-Y354A 0.623343078756985 I225A-V329A 0.61639997939543 L102A-C107A 0.610294383694714 N324A-V329A 0.608009211339193 L143A-P235A 0.602424648047645 I225A-V325A 0.59300781212364 R304A-L367A 0.59089092733894 L102A-S137A 0.584488086613725 V79A-Y91A 0.574039247218126 F92A-I173A 0.571798339912628 C316A-L352A 0.570048022481313 F92A-C147A 0.569115295635725 F92A-I148A 0.568613366432415 L150A-A242A 0.566231236194475 K128A-I189A 0.564655627765642 F92A-T144A 0.559098781183213 V309A-I363A 0.556116414048433 C107A-I130A 0.552827506382417 F65A-A358A 0.549598977119616 F65A-T104A 0.542156633950761 V312A-A359A 0.537653987023487 Y61A-W351A 0.53677519153553 F228A-M233A 0.532276042668693 L323A-F346A 0.528354042575594 T144A-I173A 0.527401915471394 A68A-V101A 0.523535215828936 Y232A-A314A 0.521007869924204 F65A-L108A 0.518081131661798 W214A-Y219A 0.516759368532585 S97A-S357A 0.512353627716893 M305A-I363A 0.497031997702628 C107A-L133A 0.494034012773609 L323A-R328A 0.490244122408901 V103A-L108A 0.482793084769668 P186A-E192A 0.482074207794232 A149A-M239A 0.479264561249354 A68A-A358A 0.474709352921256 I218A-R328A 0.469363156316451 I58A-L112A 0.46698374779449 D115A-F346A 0.466820664400909 C147A-M239A 0.460208974937166 F92A-L145A 0.458893716727099 S146A-M239A 0.451884379109684 V103A-Y354A 0.447855596675494 N324A-H350A 0.445760471978543 K221A-F330A 0.444315760844201 Q124A-C193A 0.440223764146146 V101A-S357A 0.437564359814832 N72A-L98A 0.436289581960372 S139A-I176A 0.432365642387794 F65A-I105A 0.431949175143915 M184A-H224A 0.418717166553373 M305A-S368A 0.418513089775009 H224A-M233A 0.414393788446551 Q134A-Y317A 0.414076768327315 T111A-H350A 0.413073618237704 S137A-S180A 0.410738340188315 L236A-A314A 0.409462219395598 L150A-M239A 0.406261948033348 V136A-W177A 0.404208522731162 V190A-E212A 0.401904108496547 V73A-L98A 0.400976255339416 L96A-T144A 0.398565870294968 V73A-S97A 0.391499020264892 K128A-E212A 0.391039066674643 P319A-N324A 0.390708416500286 A68A-P361A 0.390312050433238 C226A-K327A 0.389869903607967 V75A-P361A 0.381462560892807 V79A-N90A 0.377766036023463 Y232A-S321A 0.3687737539391 I148A-M239A 0.367482891636381 L69A-T104A 0.366008396933617 P186A-W214A 0.363551328878106 C107A-F121A 0.361079739615371 C181A-F227A 0.360689953880442 Y132A-V179A 0.356786757134193 V67A-Y364A 0.356199021661183 D100A-A358A 0.356170842948742 Y317A-S349A 0.352558518230678 Y243A-M307A 0.350904382478636 A149A-Y243A 0.350251107065112 L145A-L310A 0.349577379179106 G71A-I362A 0.348410565154314 Y219A-V325A 0.347470352788612 P319A-N356A 0.34218348274098 M305A-Y364A 0.342143744376434 Y132A-M184A 0.342057208477324 A68A-T104A 0.341513232499504 R304A-V309A 0.339704092798239 V64A-S357A 0.338941354088496 L69A-A358A 0.337720291729962 T106A-L133A 0.337506494877858 V140A-M233A 0.336433635386711 V140A-M239A 0.336433635386711 V94A-M305A 0.3350808786317 F228A-S321A 0.333133348173951 I93A-T144A 0.332143259277774 F228A-C316A 0.331266664828837 L145A-M239A 0.329842688944469 C226A-F330A 0.328569775085518 K128A-V190A 0.328551841332311 V67A-D100A 0.32770451550643 Q124A-E212A 0.326062628038529 H350A-S357A 0.325762890006787 A68A-V73A 0.323477669567449 V75A-D100A 0.323358253302903 C316A-A355A 0.322348850365884 C76A-I363A 0.322171123266244 C76A-S97A 0.321910732698201 V64A-D100A 0.321271842272871 M222A-V329A 0.320479712147169 C76A-I173A 0.319421110779838 C107A-P131A 0.319278051198527 K128A-P186A 0.317730030224619 S146A-L238A 0.317706335504921 A242A-A303A 0.317010820620391 P131A-S139A 0.314343487463352 C226A-I320A 0.314147178549711 N72A-V94A 0.312938264080143 T104A-S357A 0.312436634428469 V136A-Y232A 0.312387153612939 G71A-A358A 0.310984004759164 I182A-C226A 0.308859505597438 V114A-D211A 0.308541254821135 C147A-V179A 0.307275658296831 Y354A-P361A 0.303823137513893 K221A-C226A 0.303482691168096 V64A-C316A 0.301699840607405 A110A-G123A 0.300723805642582 A110A-I130A 0.299627154845582 A149A-L306A 0.299158441263298 C127A-D211A 0.299136808201579 A78A-S97A 0.297819647602458 V103A-S137A 0.297165677767711 I320A-V353A 0.297141296096815 Y219A-G331A 0.296847562981375 P109A-T347A 0.295593903089948 I322A-K327A 0.29444779515266 P220A-K327A 0.293304332724128 K221A-S321A 0.292648322341063 T104A-P131A 0.291944637829201 L229A-P235A 0.291230319315453 V142A-C181A 0.290913654404899 W351A-N356A 0.290648066419979 L96A-V140A 0.288977990186654 K128A-C210A 0.28650179908506 N95A-P361A 0.283163052981601 V113A-W120A 0.28314586498244 C76A-N360A 0.280558023638773 P131A-Y354A 0.278489070268453 T106A-C127A 0.275473866662479 T135A-C226A 0.272849818685447 G71A-N356A 0.272587532209159 I58A-C107A 0.271610085931954 V79A-V94A 0.271572214280021 Q124A-Y132A 0.271011485637956 E217A-N324A 0.270878929877275 K128A-Q187A 0.270797068458142 V73A-V94A 0.268846523052368 S141A-A314A 0.26637664198498 G60A-W351A 0.265040246686782 V136A-V179A 0.264863493555469 N171A-I176A 0.263444544751088 S141A-N356A 0.263230725817378 L74A-S97A 0.262765777660683 Y91A-V140A 0.260797819318118 L352A-S357A 0.258007406740081 Y223A-R328A 0.257303181204663 T104A-T135A 0.256996603682195 M184A-I189A 0.253741421004118 V230A-P235A 0.252537686971754 W120A-K128A 0.251670334981218 E217A-C226A 0.250904863371728 V142A-T231A 0.250429362359863 V73A-Y364A 0.249301557225412 C107A-Q134A 0.248719837183288 S139A-Q187A 0.248211500042066 N95A-V140A 0.24711978364833 E217A-V329A 0.245958048505401 S146A-L236A 0.24525365716638 N90A-P361A 0.244644023631314 G60A-L108A 0.244536520070042 A68A-A359A 0.242638548092065 V113A-C127A 0.242121706245214 T106A-L112A 0.241917602438361 M191A-E212A 0.240584123203233 V77A-V94A 0.240116712964285 T104A-L112A 0.239765732880737 Q134A-M191A 0.239336990733099 L102A-T135A 0.23835225039901 A149A-R304A 0.238292122146468 N95A-S172A 0.236425497852361 Y317A-S357A 0.234370872992492 V114A-C193A 0.233629940601137 N95A-S137A 0.233600358729107 G60A-A68A 0.23324711349688 L145A-T231A 0.233137469634268 V94A-I148A 0.232128694293682 D115A-F348A 0.231929156001941 A78A-Y364A 0.230824646074575 L96A-N360A 0.230657797931652 P235A-Y317A 0.23028562922946 I320A-V342A 0.229781295122425 D100A-Y354A 0.229614978419627 R213A-K221A 0.228440013344277 P109A-L133A 0.228307296850104 V56A-I116A 0.227996694425596 D115A-Y343A 0.227526191992825 W214A-P220A 0.226932340372343 P186A-H224A 0.225601349922612 D100A-V142A 0.224401679593808 A68A-A355A 0.223987302675027 Y53A-D115A 0.223740971304688 T106A-I130A 0.222151694445458 C127A-Q134A 0.221891218010533 T231A-L318A 0.221766240606016 V140A-I182A 0.221698814633447 W55A-T347A 0.221275472507331 S97A-Y364A 0.221174881203481 V308A-I363A 0.220707062837555 Q134A-S357A 0.219899961421836 A110A-D115A 0.21968954870936 K327A-H350A 0.219258551781026 V75A-S97A 0.219031598697458 A314A-S357A 0.218760233081506 P131A-E192A 0.217540420960288 A314A-S349A 0.217392487002917 S180A-A188A 0.217232404390986 P109A-H350A 0.216854385528019 S97A-N356A 0.216586542907585 T135A-T144A 0.216539208892875 K128A-A188A 0.216264073182462 S125A-P186A 0.215732617630972 P109A-Q134A 0.214815661926843 C147A-V309A 0.214712085085131 G60A-A358A 0.214216853337907 P186A-P220A 0.213766416551362 V138A-M233A 0.213269271335525 S137A-S146A 0.212791247162857 V73A-S357A 0.212030414239821 V73A-Y91A 0.210026123816018 V230A-L236A 0.209973524087789 V142A-L310A 0.209265555297775 V240A-L311A 0.208949598401811 G216A-G331A 0.208653517153592 V77A-Y364A 0.208646544464901 Q187A-M222A 0.207496447439102 S137A-V353A 0.207416288495859 Y132A-S137A 0.206663370667883 V75A-L98A 0.206342138480124 I173A-C181A 0.206128196265656 V64A-L352A 0.206035653491386 I218A-C226A 0.205844070748957 C316A-I362A 0.205590345547366 G60A-T111A 0.205411474420746 V73A-V101A 0.205406163783892 V230A-Y317A 0.204918007616469 M184A-F227A 0.204790066575702 G71A-V94A 0.204781028229068 C147A-S172A 0.203741928184451 S349A-N356A 0.203154890500508 V230A-M239A 0.20290268586697 L229A-M239A 0.202421071784232 F227A-V329A 0.202309018980528 T104A-H350A 0.201661961476816 V103A-S139A 0.201467414189817 L326A-G331A 0.201390746947854 L352A-N360A 0.201259552292403 L57A-L112A 0.200972086338279 L69A-T106A 0.200412723974184 A149A-S172A 0.199910939709945 F92A-V142A 0.19988653993588 A68A-A99A 0.199757793291516 S146A-A314A 0.19973537262868 T135A-H224A 0.199162059297948 Q134A-C181A 0.199081026823504 C107A-Y354A 0.198634167935635 L310A-P361A 0.198374356989143 L143A-V179A 0.197586487914725 T144A-L306A 0.197445191661206 V230A-S321A 0.196603597052454 V114A-M191A 0.196299482426751 V342A-H350A 0.195022045013679 Y61A-D115A 0.194138856393864 S137A-P186A 0.193986602482033 L98A-S141A 0.193717509476946 T135A-H350A 0.193305201779826 M239A-R304A 0.192757137488171 Q124A-P131A 0.192695017021634 P220A-V329A 0.192604681962706 Y232A-V312A 0.192497249300284 Q187A-C226A 0.192399106519104 G60A-N356A 0.191561329176452 V101A-S141A 0.191020910650931 V138A-H350A 0.190504560267599 V67A-N72A 0.190282347236004 Y61A-V103A 0.190009193041321 L143A-M184A 0.18962048188674 M222A-S321A 0.187913934402501 V138A-F228A 0.1875225000636 T104A-W351A 0.186593250772499 D100A-T144A 0.186545115743374 S97A-Y354A 0.186478980257418 L69A-S97A 0.186266335930096 P186A-C226A 0.186185277191406 L69A-I105A 0.185588842928534 F65A-N360A 0.185436361420392 N90A-C147A 0.184733641372527 C147A-I178A 0.184402018525862 W80A-I93A 0.183732232591646 C237A-L311A 0.183316148364182 V75A-M305A 0.182563038683984 E212A-K327A 0.181779119849144 T111A-F348A 0.181570980725835 W120A-I130A 0.179227927262422 Y243A-A303A 0.179219231428529 T231A-C237A 0.179208587621295 S137A-V179A 0.178795270053019 G71A-Y354A 0.178648639281092 G71A-D100A 0.178614066172793 Q187A-T231A 0.178546677753921 E54A-Y343A 0.178343194625938 G60A-C316A 0.178243807307669 S141A-V309A 0.177591747032337 W214A-R328A 0.17676296800107 D100A-T135A 0.176210707358038 C226A-N324A 0.175957218553051 C147A-L306A 0.175956674892336 A78A-I93A 0.174688390507111 Y91A-S141A 0.174478011650776 P319A-Y343A 0.174473799985842 L323A-T347A 0.174343157395299 V142A-P235A 0.174279710887864 S141A-M307A 0.173632998685502 L98A-P361A 0.17359189838195 Y243A-R304A 0.173324888403291 C127A-Q187A 0.17276318143056 P131A-R213A 0.172249820590157 N324A-F348A 0.172232939579695 S137A-Y317A 0.172182123878489 Q124A-Q187A 0.171788720911854 Y223A-S321A 0.171255443946247 N324A-S349A 0.171168930490009 I315A-A355A 0.170317799385301 L102A-P109A 0.169367047231341 S137A-Y232A 0.169340403607512 D100A-N360A 0.168135370992605 V230A-V325A 0.167719922422457 K221A-L229A 0.167540285804016 C193A-G215A 0.167391202398968 V312A-N360A 0.166688741233846 A59A-V113A 0.166602888213051 K221A-V325A 0.166275208486683 D115A-T347A 0.166072947800009 L306A-P361A 0.165693156783465 V73A-V103A 0.165534256316051 W80A-V94A 0.165373878588068 S146A-L311A 0.165302713021418 I93A-I176A 0.165299128018563 V75A-F92A 0.16524101960306 D100A-V309A 0.165207337930586 L74A-N90A 0.164841926279317 I189A-C210A 0.164478927760707 L306A-N365A 0.164317736588856 L74A-S357A 0.164284865555336 C316A-W345A 0.163987253550622 I93A-I362A 0.16329474952844 L145A-W177A 0.162229322847492 T111A-C127A 0.1621647240271 P109A-S349A 0.161694761256921 A78A-Y91A 0.161537544340052 Y232A-L318A 0.16055365993653 S146A-V230A 0.160527379856928 F92A-V174A 0.160317487702346 V308A-I362A 0.160058448965735 S146A-M305A 0.159951866978568 V138A-A355A 0.159652875649948 E192A-R213A 0.159627408699274 A149A-A242A 0.159150531212923 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