[Thu Aug 25 00:45:08 2016] >Input file: TM4K3CCGG.pdb >TM segments: A159-169_A249-256_A259-265_A311-318_A328-334_A350-357_A366-372_A433-440_A454-461 MAIDEN score = 166.9103 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 ----------- ---------------- L438A-V457A 10 V366A-I439A 10 L252A-L264A 10 N332A-N352A 10 Y316A-A331A 10 S261A-N315A 10 K370A-S435A 10 A368A-E437A 10 I357A-I367A 10 L436A-V459A 10 G265A-S311A 10 W314A-I333A 10 F254A-Y262A 10 S330A-S354A 10 I440A-T455A 3.56382346171387 W314A-N332A 2.8310097219362 I357A-V366A 2.01392387203815 I367A-L438A 1.25718790597365 T251A-L264A 1.20860289691317 T251A-Y263A 1.139284643999 I367A-I439A 1.09799005698607 E437A-V457A 1.0322951339905 V366A-I440A 1.01922933557883 I439A-V457A 0.971934425434767 I440A-R454A 0.914970279755395 L264A-F312A 0.738051848663622 L438A-S456A 0.727201860471469 L264A-S311A 0.723439249878595 N332A-T351A 0.722128829618972 G355A-I367A 0.704703863315815 W314A-A331A 0.692600005339929 I333A-N352A 0.68269572520592 F312A-I333A 0.669870958087492 G371A-S435A 0.644083355031208 S261A-G313A 0.642536100625311 N332A-F353A 0.632067202982808 Y262A-F312A 0.628442919847098 L252A-Y262A 0.595053640515793 S330A-G355A 0.575070038368983 V366A-L438A 0.573383192837707 Y356A-V366A 0.57089906586592 S354A-G371A 0.56974245282572 N352A-G372A 0.561563407460855 T369A-L436A 0.557071775581516 S330A-F353A 0.552729005543463 Y263A-W314A 0.552617151512048 F353A-T369A 0.544376464761763 G328A-I357A 0.533169521925865 N318A-G328A 0.527648442383189 L436A-V457A 0.519427322310205 N315A-I333A 0.516300866302103 N332A-G350A 0.512242423497452 F353A-G372A 0.495248096443682 S435A-V459A 0.493917570035656 W314A-S334A 0.490469329867045 A434A-V459A 0.484183970251343 L438A-F458A 0.476687992657307 A331A-T351A 0.466270238925852 L436A-F458A 0.466016968442071 F254A-S261A 0.449709489174096 G328A-S354A 0.402678084862692 G355A-K370A 0.396852352154092 Y356A-I367A 0.385888119018659 S334A-T351A 0.37825365482875 I439A-R454A 0.377935445022549 Y263A-G313A 0.377917826908774 F254A-N260A 0.365802061867757 L264A-G313A 0.359290859034981 N260A-W314A 0.357543216826472 A368A-L438A 0.353300796252384 F312A-S334A 0.353217000782032 P255A-W314A 0.352598579970211 Y316A-G371A 0.350283275086718 I357A-A368A 0.330333286559204 G250A-L264A 0.324408547845922 P255A-N317A 0.322766949458338 G250A-Y262A 0.319430222799756 S330A-A368A 0.318789457822215 G355A-A434A 0.315262863020578 T351A-T369A 0.309739002334329 A368A-S435A 0.307638271264913 F254A-Y263A 0.301342469919762 Y356A-G371A 0.300762482871331 N260A-N317A 0.299356068336084 N259A-N318A 0.298079828965832 L438A-T455A 0.290602140473865 A331A-F353A 0.283746387373577 G355A-G372A 0.281640113923279 G350A-N433A 0.281118820815729 G265A-F312A 0.280485067666723 G313A-N352A 0.276419525507982 Y316A-G350A 0.275942276699109 Y263A-G350A 0.273439595628718 N315A-N332A 0.268778266663787 N315A-G350A 0.265427833661733 G253A-S311A 0.254585133056805 V366A-V457A 0.254206979319527 I367A-E437A 0.254180481085912 N259A-G328A 0.254086529764784 G328A-Y356A 0.251855251270218 N315A-S329A 0.241278240189372 Y263A-F312A 0.235652913036385 G250A-F312A 0.233961177708856 P255A-Y262A 0.231816154581701 T369A-T455A 0.222109286639231 S329A-S435A 0.217049927343723 G313A-I333A 0.215502341830846 G253A-W314A 0.21550018336006 I440A-S456A 0.213286572738356 K370A-A434A 0.212388453324767 F353A-K370A 0.210917301622993 N332A-G355A 0.208536698427215 N259A-G313A 0.199846125229668 W314A-N352A 0.19973590244041 S261A-W314A 0.198740141130315 G265A-S334A 0.198014005459021 L252A-N315A 0.197640122510772 K370A-L436A 0.192790600126641 T369A-A434A 0.192411022491926 L252A-G265A 0.189620113301705 Y356A-A368A 0.187726097354064 I440A-V457A 0.187049751495572 I357A-T455A 0.18594371608491 N352A-K370A 0.177769942959526 G372A-L436A 0.177226255860369 Y262A-N317A 0.175859911495984 L264A-N315A 0.175606037548625 G355A-L438A 0.174779369801024 E437A-A461A 0.173566385207643 N315A-T351A 0.173234176492104 F254A-N317A 0.172235100759221 K370A-L438A 0.171189602906954 S249A-Y263A 0.171079385423821 G328A-I367A 0.17076394261051 I439A-T455A 0.159865888736466 S334A-G372A 0.156990561307577 N260A-I333A 0.156786542822452 N260A-S354A 0.156062076028732 G372A-A434A 0.152713070351271 Y262A-Y316A 0.151971253784833 S329A-G371A 0.149330252646188 G253A-L264A 0.148400586783469 N259A-N352A 0.145107093319427 S330A-G372A 0.143099376760009 Y262A-W314A 0.140504739460854 Y316A-Y356A 0.139908585347371 Y356A-I440A 0.138950875302604 A368A-R454A 0.137667556489351 V366A-S435A 0.13741003405463 S329A-N352A 0.137352219760725 A368A-L436A 0.136515226318454 I357A-K370A 0.136023089344297 A434A-V457A 0.134962296879751 A331A-G372A 0.134217096846136 G328A-V366A 0.133492560271981 A368A-D460A 0.132985415739685 S261A-N318A 0.131012397293958 I367A-L436A 0.130816176467143 N332A-K370A 0.130154042061069 G250A-G313A 0.125257002426387 L436A-D460A 0.123409349945587 N260A-N352A 0.122421746461657 L252A-I333A 0.121521883193076 S354A-N433A 0.119691456298773 F254A-F312A 0.117666693915807 N318A-N352A 0.115893068288796 T251A-S261A 0.115600782060641 S354A-L436A 0.115538687555883 L264A-S334A 0.115309702286595 T369A-S435A 0.115046358569503 G253A-N315A 0.11487761056381 V366A-V459A 0.114546566895121 T369A-S456A 0.114353284996007 N332A-N433A 0.113725965052228 G355A-V459A 0.113640226379684 G372A-V459A 0.11281425804826 A331A-S435A 0.112226238663597 G355A-T455A 0.109785744214845 S354A-A461A 0.106985680832453 A368A-I440A 0.106442874373363 G313A-S334A 0.105997082767935 I367A-V457A 0.104495115120425 Y356A-L438A 0.104258332814516 T351A-A434A 0.101044014269655 G265A-I333A 0.100771500673759 G313A-T351A 0.10014386602006 N332A-T369A 0.0983618984676928 L438A-D460A 0.0964925617473602 S311A-G350A 0.0961642520383328 A368A-I439A 0.0954140956237808 I333A-G350A 0.095073022600074 N318A-T369A 0.0938698577836212 F312A-G350A 0.0938512990062046 G350A-A434A 0.0913894372646062 V256A-S261A 0.0890534053115272 G328A-K370A 0.0870068708070835 N315A-S334A 0.086587829541223 N260A-S329A 0.0865098605682655 Y262A-N332A 0.0861575417563163 G371A-V459A 0.0860782160048998 V256A-Y316A 0.0859812111347718 S329A-T351A 0.0855603548260018 T351A-S435A 0.0855596647691037 G371A-E437A 0.0851452901234242 F312A-N352A 0.0849033579230509 S329A-I367A 0.0833178215274195 S261A-G350A 0.0806601908427667 Y262A-A331A 0.0802276855685546 N260A-S334A 0.07972792743701 K370A-V457A 0.079563299113945 G371A-D460A 0.078408677073976 V256A-A331A 0.0770592309161779 F254A-A331A 0.0768304603016006 N260A-S330A 0.0767040658800635 G355A-V457A 0.0762689804023335 V256A-N317A 0.075958785363428 N315A-S354A 0.0754463870691402 V366A-S456A 0.0751961686526066 I367A-V459A 0.0750323783456635 A368A-A461A 0.0749335805386191 S354A-V366A 0.0715671340870911 N317A-I333A 0.0713519943866558 A368A-N433A 0.0712766112051302 G328A-E437A 0.0704847529795547 N318A-N332A 0.069841437036555 Y316A-N332A 0.0696897868529547 S330A-I367A 0.0644195107267782 Y262A-N352A 0.0631925890928979 Y356A-S435A 0.062846158995653 T369A-A461A 0.062754698754067 V256A-Y262A 0.0625083422106414 N315A-G371A 0.0624271190722232 S261A-S334A 0.0624067751857005 N260A-G328A 0.0617308203525245 Y316A-S329A 0.0617068681790833 F312A-A331A 0.0608573086778312 A434A-A461A 0.060504364624272 N315A-G355A 0.060174849755996 G313A-S330A 0.0601321775578452 Y262A-N315A 0.0577566426802978 Y356A-L436A 0.0577355391812784 N317A-F353A 0.0565642372950293 T251A-G313A 0.0564896082474502 N352A-S435A 0.0563689013985478 G355A-I439A 0.0558761440503963 K370A-E437A 0.055137422628055 F353A-D460A 0.0551256205839397 S261A-N352A 0.0546585183186423 I440A-V459A 0.0528000098889088 T369A-I440A 0.0525387507067327 N259A-G355A 0.0508348513183652 S261A-S329A 0.0505836951960315 L252A-N260A 0.0491543741936464 S435A-F458A 0.0475985392483533 Y262A-G313A 0.0472176141115472 F353A-E437A 0.0465867287106496 P255A-S261A 0.046145181996927 S249A-F312A 0.0450399598427529 F254A-I333A 0.0441313773630023 G253A-N260A 0.0439159359606318 F353A-I367A 0.0436624930661287 A331A-Y356A 0.043599868271297 N317A-G371A 0.0432731801531618 N259A-S354A 0.0429828020854879 N315A-F353A 0.0409878145960733 A331A-N352A 0.0404515214745498 E437A-F458A 0.0383737575961929 F254A-G265A 0.0377136167046528 A331A-A434A 0.0375320753281172 G253A-Y263A 0.0371426673122381 Y316A-N352A 0.0370707011702449 S330A-G350A 0.0369129058727773 I357A-V457A 0.0348824702672887 S354A-A434A 0.0343616827887878 K370A-F458A 0.0308473224372308 N317A-N332A 0.030145478971499 Y316A-S334A 0.0279473274837929 N317A-Y356A 0.0249927464496484 I333A-G372A 0.0237319120977149 I333A-G371A 0.0236131418657801 T369A-R454A 0.0217916823990096 Y262A-S330A 0.0192686914123135 S330A-S435A 0.015172582492494 N260A-N332A 0.014858105198568 S334A-G371A 0.0148512310727535 T369A-V457A 0.0140137580720578 N259A-N332A 0.0135269291463073 A331A-T369A 0.0130105373349139 N317A-G355A 0.0118724357022353 N317A-N352A 0.0117263848666476 N259A-I333A 0.0115476950780549 V256A-G313A 0.0109759505136569 F254A-S311A 0.0104740591962875 G328A-G371A 0.00992874910700012 Y263A-A331A 0.00983847230171975 S334A-F353A 0.00974708795383207 T351A-G371A 0.00910349603330118 S330A-N433A 0.00824171683272645 L438A-V459A 0.00777436713590696 V256A-Y263A 0.00777024322855491 F353A-A461A 0.00754432027712726 N259A-W314A 0.00732065125363723 Y263A-N332A 0.00727451988626378 V256A-N318A 0.00612731675935363 N317A-T369A 0.00603778800152899 G328A-L436A 0.00393996326299328 Y356A-V457A 0.0031179894421598 P255A-F312A 0.00273719095786751 G355A-D460A 0.00227531442970316 G372A-D460A 0.00165238345500174 F353A-A434A 0.00101462831004184 S329A-K370A 0.00090592001692924 Y356A-T455A 0.000710776028421289 S330A-L436A -0.000888171273860573 S435A-T455A -0.00118054545109647 G265A-G313A -0.00196155663734884 G328A-L438A -0.00222604201469578 Y356A-R454A -0.00252255587861883 A368A-V459A -0.00275619784626158 G350A-K370A -0.00413069011858958 N352A-A368A -0.00459864740181969 F353A-G371A -0.00471947881352364 A368A-F458A -0.00487760601194132 E437A-S456A -0.00493463095927726 Y263A-N315A -0.00512053092081866 P255A-G313A -0.00637793526875552 N259A-Y316A -0.00782382452185804 N317A-T351A -0.00817252618966524 L252A-F312A -0.00819334527800564 K370A-N433A -0.00830654397867825 T369A-V459A -0.00833970027428954 Y263A-S334A -0.00838978310783434 W314A-G372A -0.00894243425197105 S354A-E437A -0.0105115366401067 S261A-I333A -0.0107340585364426 S261A-S311A -0.0109357317997869 A368A-T455A -0.0110351505905069 S329A-E437A -0.0110766912557114 G313A-F353A -0.012524153882413 E437A-R454A -0.0133791832716004 G328A-N352A -0.0137509878889084 S261A-S330A -0.0143377929109265 S354A-S435A -0.0144979839827557 I367A-R454A -0.0151786178578766 I367A-A434A -0.0156587094256827 Y316A-G355A -0.0163915020021096 V256A-W314A -0.0169193049869198 I367A-F458A -0.0171996634994303 I357A-S435A -0.017735731368508 I333A-S354A -0.0188132848985125 T251A-S334A -0.01912849676311 G328A-S435A -0.019658294399965 I440A-F458A -0.0201348314313794 A331A-N433A -0.0201466071940553 K370A-S456A -0.0209172069983103 W314A-S329A -0.0210497363538567 S435A-A461A -0.0212614785539054 N260A-G313A -0.0212747974587764 S261A-T351A -0.0212806215462336 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-0.0458110549049806 K370A-I439A -0.0465598183147611 N260A-F312A -0.0466560063193402 V366A-F458A -0.0491931700970101 G371A-F458A -0.0514407444495714 T369A-D460A -0.0522647840142696 S354A-I439A -0.052489331881608 N352A-A461A -0.0531240796962444 L436A-T455A -0.0552426822682506 I357A-I440A -0.0553885973157069 N318A-S330A -0.0559665912468901 I367A-D460A -0.0561005767136988 L438A-R454A -0.0562397387379789 S329A-F353A -0.0582824517114755 Y262A-S311A -0.0601835457837428 I439A-S456A -0.061531452624715 S261A-A331A -0.0622708503464215 I357A-L436A -0.0624387003320606 Y316A-S354A -0.0628361825810506 N318A-A368A -0.0633472028795357 F254A-N259A -0.0640997845691369 Y262A-G350A -0.0642106716004478 F312A-N332A -0.0653042713334551 Y263A-Y316A -0.0654103150829801 T251A-S311A -0.065823565866693 E437A-T455A -0.067684841833044 W314A-G371A -0.068443753447637 I357A-L438A -0.0688879890367149 V366A-T455A -0.0693234028159813 N352A-A434A -0.07011551662921 A331A-S354A -0.070356119774093 N332A-A434A 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