[Wed Aug 24 18:28:05 2016] >Input file: TM4RWACGD.pdb >TM segments: A111-142_A149-178_A181-216_A226-254_A279-305_A317-341_A352-379 MAIDEN score = -84.5199 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 ----------- ---------------- Y214A-C299A 2.03071099023239 W332A-C361A 1.16083516308745 F285A-H336A 1.0412488462528 K189A-M251A 1.03757239282112 F285A-V290A 0.96953910552908 F226A-K231A 0.951779304218059 V137A-F156A 0.934550893080815 F183A-C188A 0.899251305795609 V323A-F328A 0.853276196249485 I335A-I362A 0.797648649831432 L131A-D162A 0.78075251738076 C331A-L364A 0.759315841360346 I235A-W240A 0.749507692562879 T207A-I295A 0.740619477766655 L122A-C127A 0.73528907083233 V126A-Y366A 0.729183320608704 C127A-L132A 0.727427158017834 C127A-L169A 0.725427130430308 K189A-V252A 0.725114298774162 V284A-F289A 0.715969965316578 T168A-V191A 0.705903032806223 I119A-S124A 0.702893843069067 E185A-A254A 0.700617580824259 I153A-K233A 0.697057039446655 M138A-F156A 0.678258859674024 M138A-A159A 0.674913664178575 F200A-A243A 0.673673658906004 L164A-I194A 0.667727325252824 F204A-I239A 0.666506418180587 T149A-T228A 0.664146012905681 V211A-A216A 0.64980204525656 I335A-C361A 0.649710256040733 W332A-I337A 0.639758781257633 V135A-A163A 0.639287512928135 Y196A-V246A 0.634624822662951 K281A-I340A 0.629903964362057 L286A-P292A 0.628031889128702 C331A-C361A 0.620314149421008 D212A-C299A 0.61697578146404 F328A-N368A 0.610747314187369 A165A-N198A 0.596675987094263 W332A-I362A 0.593220776582609 K233A-C238A 0.577177707976273 K189A-I194A 0.575111760936151 R319A-L379A 0.572729878099343 V126A-T166A 0.563692226558636 F328A-A333A 0.563098109815011 F200A-A288A 0.556835192565302 F287A-P292A 0.544439861897705 L286A-V291A 0.542555404558607 N198A-I203A 0.537911714582222 A327A-N368A 0.535750650886129 I141A-N152A 0.529434056499686 Y154A-A232A 0.528865084389956 A165A-V191A 0.52705468669132 S210A-I295A 0.525897521390262 A190A-M251A 0.525326802514521 Y123A-A128A 0.520254932117194 T151A-M209A 0.509987960062366 S124A-L169A 0.508099090888708 Q172A-L177A 0.506599723521022 Y196A-A243A 0.506372536912282 K189A-I250A 0.501663018157712 Y197A-G247A 0.500168232401333 A165A-Y366A 0.500154592143791 Y123A-A363A 0.498537711167687 A165A-D195A 0.488459106464028 A174A-W181A 0.487199881195344 D212A-F226A 0.482278864829041 T120A-A125A 0.478716294003405 C188A-M251A 0.478559236254404 L294A-C299A 0.478412581629854 K189A-M253A 0.477110447150305 V324A-N372A 0.477016583062547 D195A-F200A 0.467442109895871 L192A-I250A 0.466642606905706 V135A-A159A 0.464765256463567 V129A-S369A 0.463609349340685 L122A-A363A 0.463415240815261 K281A-V339A 0.458219175233291 L192A-M251A 0.454962079247818 F156A-D162A 0.45165285379068 F200A-T205A 0.443327456595302 S193A-V248A 0.44150125161173 E185A-A190A 0.432985742408716 A161A-Y197A 0.43175917190373 I153A-P229A 0.429584658834579 I282A-F287A 0.427904816332995 G130A-V135A 0.427076560791921 Y123A-S173A 0.421685496368548 I203A-P292A 0.421194209239068 S210A-Y300A 0.420394193339985 M199A-H336A 0.418958116966345 N134A-L160A 0.418634127238843 V324A-V329A 0.417451597538002 C331A-N368A 0.416645394545961 R319A-V324A 0.415313708300266 V129A-N134A 0.415188270895818 G133A-S370A 0.407359482649921 P249A-A254A 0.406336895502246 P334A-C361A 0.406190239649762 V126A-L131A 0.404581424734456 T201A-A243A 0.403743833693111 V126A-S369A 0.402932239391221 I335A-L358A 0.399556736253384 V211A-C299A 0.398437067122104 I194A-G247A 0.397284587131433 A150A-K231A 0.396364498849517 Y214A-L302A 0.395959827449015 V355A-L360A 0.386843883934689 V374A-L379A 0.386698614287073 A161A-T201A 0.385419149051933 I203A-M208A 0.385305167972167 T149A-Y154A 0.382399120919551 V137A-A159A 0.379667276941717 I153A-A232A 0.37645377524708 I239A-S244A 0.374810866564275 V354A-H359A 0.372826917019577 V330A-L364A 0.371528593400139 M208A-I296A 0.369250619357644 C238A-G245A 0.36725702654908 F285A-C331A 0.35772100910459 W332A-L364A 0.356659222850213 A288A-A333A 0.356541832930453 Y154A-V325A 0.356253796259382 G130A-Y376A 0.355051258055104 P352A-A357A 0.354859334546597 C331A-A367A 0.350769181804221 N157A-P373A 0.350387453867821 A116A-S173A 0.350371227425304 S112A-I117A 0.349948511839962 Y196A-G247A 0.349024946838995 N152A-P373A 0.348658081101623 N368A-P373A 0.348329749660707 D162A-Y197A 0.34742844823836 I203A-F289A 0.346780794019259 T151A-T228A 0.346262205020305 Y196A-V252A 0.346066620673896 A163A-S369A 0.342992946414993 Y197A-V246A 0.342587065370571 A161A-S202A 0.341781515267607 H336A-H359A 0.340685420402269 F204A-C299A 0.338443147283745 T207A-C238A 0.338209184049618 L158A-A163A 0.329627524283189 V137A-D162A 0.329581688642591 L322A-A327A 0.32513634211256 G140A-Y154A 0.324626530814893 K281A-L286A 0.323734944691034 N152A-R213A 0.322725327146955 L206A-V211A 0.320421314134419 M199A-A288A 0.31938212726208 Y197A-S202A 0.319334116931792 M320A-L375A 0.318143272311171 N152A-K231A 0.31789013542812 A161A-S370A 0.315237076846048 R213A-T318A 0.312372747981962 I295A-Y300A 0.311853821264869 N152A-P229A 0.311745442009595 C238A-A243A 0.311481873475132 Y214A-R319A 0.309176357023941 F200A-I239A 0.309083862159429 L164A-D195A 0.308093135757725 L206A-V321A 0.306813398396799 S112A-H359A 0.305750549120668 C299A-R319A 0.305670101884937 Y154A-K233A 0.304799015500009 S370A-A377A 0.303148576535123 R213A-C299A 0.302574050873567 Y196A-T201A 0.302558056477977 M320A-L379A 0.301054944584441 L113A-A118A 0.300012511215738 S167A-K189A 0.299875724416647 L158A-T201A 0.297285452903619 I119A-S173A 0.296835345814982 L113A-L177A 0.296737476680322 I293A-C331A 0.296686661836685 A121A-A174A 0.29571851667586 Y154A-N236A 0.293888276757492 T207A-D212A 0.293652175089552 L132A-A163A 0.293642622144591 T168A-P182A 0.291641418064541 N134A-F139A 0.290361945508608 A121A-K175A 0.289563375304241 A128A-A367A 0.28867456014352 T201A-L206A 0.288234737474678 L169A-A174A 0.287996106650662 M138A-N372A 0.286285254014325 V321A-G326A 0.284756361580749 L192A-A254A 0.284162789992022 I250A-C283A 0.283949828088181 A118A-K175A 0.283790012192445 L115A-A356A 0.283546318980772 I362A-A367A 0.283357538357111 I296A-G301A 0.282445120437517 L358A-A363A 0.28221255066338 G130A-L169A 0.281957665000817 G365A-N372A 0.281725916197039 C331A-I362A 0.28143696770332 Y154A-P373A 0.281108760374754 L160A-A165A 0.280956191855387 C331A-N372A 0.280641032663225 T166A-Y366A 0.280513768192394 I117A-C361A 0.279612689454475 Y214A-M303A 0.279604947560573 W240A-V246A 0.278647766355624 M209A-V321A 0.277122372822488 C127A-N372A 0.276327185286039 L206A-V325A 0.275765859207047 V126A-C361A 0.275389660959224 L131A-T166A 0.27500027045275 V324A-Y366A 0.274482369651002 Y154A-R213A 0.274465821313666 I117A-C127A 0.273293553134356 P170A-W181A 0.272598085683384 Y123A-L169A 0.272496743005525 T207A-I296A 0.271318216750329 R227A-A232A 0.26968055405161 S193A-V246A 0.268729433718037 F156A-C238A 0.267252870075371 C331A-V339A 0.266875746757852 D195A-V248A 0.266024793555441 N372A-A377A 0.265057259142219 M253A-V279A 0.262586116613276 G326A-L371A 0.261743595187519 A165A-K189A 0.261448811332971 C127A-D162A 0.260051356283856 R213A-Y300A 0.257579292148219 D162A-G365A 0.256171823436834 I203A-A288A 0.256156161447219 K189A-P249A 0.25513934809806 V323A-V329A 0.251862764762029 V126A-A367A 0.251340159600188 S193A-M251A 0.250846362484313 K281A-H336A 0.250680312935008 T205A-T318A 0.24618050504754 S124A-V129A 0.245772485717297 A128A-A165A 0.241310350864733 A327A-Y366A 0.240834391538871 L131A-S167A 0.240287860263821 G133A-A161A 0.238660729902811 T151A-P229A 0.237897558854879 T151A-T201A 0.237833280553229 L158A-N372A 0.236761663691376 N198A-S369A 0.236522585296917 I317A-L379A 0.23597888621229 L206A-P292A 0.235013632267211 M208A-R227A 0.234034957086456 C283A-F338A 0.234021644222485 C127A-S167A 0.232816879272628 M303A-R319A 0.231935841677564 A150A-D212A 0.229097452953839 S202A-S370A 0.228386516419844 D162A-Y366A 0.228187178113769 Q172A-G184A 0.227638980150314 Q172A-Y366A 0.226922344869991 V126A-S370A 0.225270310714083 K189A-Y197A 0.224033238688954 Q172A-C188A 0.222728555042617 V339A-I362A 0.220628719723374 Y123A-A174A 0.220551676322931 L206A-T297A 0.220540977820662 L192A-Y197A 0.218522174554468 L115A-T120A 0.218275511743933 V135A-G140A 0.218022783165576 Y197A-G365A 0.216169004658504 T205A-T297A 0.215683179118356 I296A-G326A 0.215595552200866 I203A-M209A 0.215371365373381 L131A-S370A 0.215228533088652 M208A-R213A 0.214955856629131 V129A-Y376A 0.21436947331545 F200A-C331A 0.213705276576833 Y196A-K281A 0.213282668541766 M209A-C299A 0.213230229292828 K281A-W332A 0.213208262161906 T149A-T205A 0.212456487591048 K231A-N236A 0.210583107690276 S210A-V324A 0.210134240359325 L169A-V191A 0.209352040200271 V137A-L160A 0.20927807922277 F285A-V291A 0.207623025347995 V135A-S370A 0.206886400431852 I119A-T166A 0.206366632804464 A163A-D195A 0.205818147324447 G133A-N157A 0.205106334421625 N198A-G245A 0.205014686603623 Y154A-R227A 0.204754692058996 N368A-Y376A 0.204321340260948 T120A-L360A 0.20399257941631 F171A-E185A 0.203824900968772 D162A-V374A 0.203786606394592 G301A-T318A 0.203743258267933 A163A-Y197A 0.203453508296222 N134A-Y154A 0.203165674625959 M209A-L234A 0.202862328703772 L158A-S202A 0.202735252993739 Y154A-S210A 0.202199085162289 V135A-S369A 0.202060798044697 T280A-H336A 0.201854152912988 F200A-F287A 0.201787287804522 L132A-N368A 0.201520069203263 V246A-F287A 0.201329928631677 S202A-P373A 0.201196894976953 F204A-V325A 0.201181795848184 G140A-A159A 0.200548950537773 T280A-I337A 0.200122233424826 P292A-G301A 0.199589806083663 I293A-V298A 0.199496712351865 S173A-H359A 0.199342228820556 T297A-L304A 0.198803873191262 V330A-I337A 0.198408827398852 G140A-N157A 0.197894326893983 G245A-I250A 0.197807337393694 T207A-G326A 0.197089880000242 I153A-K231A 0.196249027640055 F204A-P292A 0.195913236160665 A161A-I194A 0.194941970620679 T151A-N236A 0.194940377812801 Y154A-N372A 0.194172066121494 T207A-N236A 0.193876051311031 P352A-H359A 0.193766758748152 C299A-T318A 0.19363549549172 D162A-N372A 0.19342391691701 P334A-H359A 0.193131303176408 S202A-V329A 0.192563981646672 T207A-I293A 0.191392564388158 T205A-L234A 0.19128963847462 Y196A-F289A 0.190948166155019 V135A-Y376A 0.19087574998263 T120A-A367A 0.190561603318985 V126A-L132A 0.19042864254004 T297A-L302A 0.190339810092841 I194A-W240A 0.189445225884081 L122A-T166A 0.189247932123003 F289A-V325A 0.188432852174484 C127A-Q172A 0.188166138580191 T149A-D212A 0.188032850835224 G130A-G365A 0.187853263895618 K231A-W240A 0.187846042596889 V325A-Y376A 0.187047958773002 V137A-L158A 0.187042572527466 C283A-F289A 0.186398788709871 M303A-V321A 0.186097287643899 L122A-G365A 0.185928155639909 S124A-N134A 0.185314990782703 Y197A-Y366A 0.18524439283256 Y196A-M253A 0.185074524135663 I141A-A159A 0.184774041325313 A230A-I237A 0.184608472833853 V290A-C299A 0.184161468239884 C299A-L322A 0.184085000045273 N198A-C331A 0.183061263671984 F204A-M209A 0.180618600674508 M209A-R319A 0.180305107997963 A216A-I317A 0.180062195749864 N152A-R227A 0.179775324492959 M209A-I296A 0.178935343330116 M199A-V291A 0.178874426962408 A121A-T166A 0.178289351700141 V191A-M199A 0.177812218999111 Y366A-P373A 0.177352359513312 M199A-V241A 0.177123199293057 T201A-I293A 0.176984816165427 S210A-I215A 0.176564663089138 L177A-P182A 0.176202390423117 M209A-R227A 0.176169640940143 V126A-L371A 0.176121508142653 G130A-L371A 0.175418713716572 V329A-I337A 0.174857244327865 S202A-Y366A 0.174750229453858 G245A-M253A 0.174480418547237 G133A-Y366A 0.174181010300057 F338A-L358A 0.173948865871139 Y196A-W240A 0.17362823456906 D195A-K281A 0.173435112250303 K231A-I237A 0.17323673362111 K189A-S244A 0.172203669642438 V291A-V329A 0.172182571624024 L122A-C361A 0.17218196540045 L122A-S167A 0.171909712267186 L206A-C299A 0.171314019468961 F171A-H359A 0.171239278282337 S193A-L242A 0.171139952723461 L353A-C361A 0.170554729361994 Y300A-G326A 0.170437558791608 N157A-S210A 0.170390759384964 M138A-S370A 0.170200790326876 T168A-I362A 0.169508553103006 R213A-M320A 0.168303691904546 T149A-T318A 0.167444629225631 H336A-L364A 0.167418859094987 G140A-I153A 0.167384063280188 G247A-C283A 0.167229979589406 C331A-L358A 0.167103219689621 I203A-C238A 0.166801442765747 S124A-A174A 0.165423498406719 G140A-A163A 0.165053969682156 V324A-A377A 0.165005274049263 A150A-S210A 0.164703290277579 V211A-V298A 0.164635620145727 V341A-V355A 0.164537672939058 A150A-V321A 0.16425303517648 K233A-I239A 0.163290186744498 M208A-V291A 0.162838239557532 A161A-I203A 0.162716546402973 R319A-A327A 0.162646757265918 L169A-W181A 0.162520372708837 L158A-N198A 0.162030342855373 I203A-W240A 0.16190441219192 C283A-P292A 0.161733929549451 P170A-S369A 0.161694761256921 A128A-G365A 0.161598172169822 I282A-V291A 0.161093171685231 I203A-N236A 0.160751947205927 V329A-A363A 0.160729764698971 D195A-G365A 0.160575052171841 S210A-C299A 0.16037331729593 L164A-K189A 0.160295044464101 D195A-A243A 0.160291311537193 N134A-P373A 0.160034918103606 A243A-I250A 0.159249070381488 C127A-Y366A 0.159163531479605 T201A-A232A 0.159088055955002 L322A-C331A 0.158973500134762 F183A-V191A 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