[Wed Aug 24 18:20:13 2016] >Input file: TM3QQ2CGD.pdb >TM segments: A2-15_A67-78_A80-90_A117-125_A134-141_A167-174_A189-196_A201-209_A218-228_A231-243 MAIDEN score = 274.8035 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 ----------- ---------------- L205A-Y225A 10 L172A-L192A 10 G193A-E204A 10 V70A-L90A 10 L170A-W194A 10 Y220A-G240A 10 R124A-P136A 10 N218A-R242A 10 R13A-W235A 10 S222A-H238A 10 V87A-S119A 10 T9A-A239A 10 S11A-F237A 10 E224A-S236A 10 D85A-E121A 10 L120A-V140A 10 E139A-R169A 10 M141A-L167A 10 R89A-A117A 10 Q15A-N232A 10 T195A-R202A 10 R191A-G206A 10 Y76A-L84A 10 V209A-A221A 8.91862069897905 R169A-W194A 7.07415266852774 W194A-R202A 3.24445360606092 A226A-I233A 2.23734744256515 V203A-A226A 1.85888673732831 A7A-Y241A 1.37351067518385 A207A-Y223A 1.34861248353792 V140A-L167A 1.30007268193308 H69A-R89A 1.29563576846543 W118A-M141A 1.09702858752072 L84A-E121A 1.09305281878561 H69A-L90A 1.03164167802177 E12A-I233A 0.987218789517794 W194A-V203A 0.981749599235466 G72A-L88A 0.928286487308502 F10A-F237A 0.905222590586917 Q14A-W235A 0.903023477623093 R202A-A226A 0.894597973595584 A226A-W235A 0.88362637969291 L88A-W118A 0.852154579851155 V87A-W118A 0.829862194499805 L192A-L205A 0.815473035981931 D85A-L120A 0.771468548825988 T86A-L120A 0.757740906128541 T9A-F237A 0.735811457653361 V77A-L84A 0.727211119916484 V87A-L120A 0.721180434421335 L68A-L90A 0.670553682425769 F10A-A239A 0.669336309171671 E224A-I233A 0.668290371256708 L170A-L192A 0.662556148951113 L172A-A190A 0.660385043640424 E12A-F237A 0.657359612183976 E224A-F237A 0.651144939519197 R13A-S236A 0.643238522620528 Y73A-L88A 0.637709600746604 S222A-S236A 0.635673925990279 G168A-W194A 0.631160456681612 W118A-V140A 0.628689939232461 A207A-E224A 0.617700218655459 A134A-F174A 0.606708024647365 L205A-Y223A 0.601446027965397 R8A-H238A 0.60141648689086 E224A-W235A 0.601208061057908 L192A-E204A 0.600782599258286 G122A-P136A 0.592444530966958 L120A-A138A 0.578422920095577 E204A-A227A 0.573277176882112 Y189A-G206A 0.567092517499694 E12A-W235A 0.562595019750336 W6A-Y243A 0.56198843487043 V70A-L88A 0.556539542913329 E135A-L172A 0.542107829849787 E135A-F174A 0.518259239793737 L219A-Y241A 0.516958450466373 R191A-L205A 0.50475793220799 A74A-V87A 0.502916585420655 Q15A-P234A 0.498570153494295 F174A-R191A 0.491443594185016 G201A-I231A 0.489253249281742 S11A-W235A 0.488552093800173 R202A-I231A 0.484520414738763 L90A-A117A 0.473779780718344 G4A-R242A 0.464015143966759 V209A-L219A 0.462688108868867 G71A-V87A 0.453558221661641 A74A-L84A 0.451094651203507 G78A-Y83A 0.446831265208584 A7A-R242A 0.440640795968228 N218A-Y241A 0.438574205770754 V77A-Y83A 0.436587160546061 Y225A-I233A 0.425276600153985 A75A-Y83A 0.424564602625088 A226A-I231A 0.424024878466051 Q14A-P234A 0.422784863164705 R125A-P136A 0.415432204345343 G171A-R191A 0.413793166672104 Q14A-I233A 0.404309919727333 Y83A-G123A 0.390452779121114 L170A-R202A 0.387826903800955 P136A-L172A 0.379588614606413 L88A-S119A 0.367993051043653 V203A-A227A 0.364510287653754 A138A-L170A 0.364186128759329 L205A-A226A 0.361938293792895 L120A-M141A 0.361905230053649 Y73A-D85A 0.359802922956439 L120A-R169A 0.357473895237734 R169A-G193A 0.353880131562636 E135A-G171A 0.352986057997039 Y225A-W235A 0.351585781357716 S119A-M141A 0.351282646378721 G3A-Y76A 0.351132678342918 A74A-T86A 0.350385866282789 Q15A-I233A 0.349504239080579 G171A-Y189A 0.342556286637005 G123A-A138A 0.340997561369714 M141A-W194A 0.339778457971364 A190A-A221A 0.336322959828349 L84A-G123A 0.335582558722582 T86A-E139A 0.334036889787971 Q137A-E204A 0.325561487050338 G206A-E224A 0.319324189902236 S222A-F237A 0.309311589483629 R8A-Y243A 0.308973263771472 E139A-G193A 0.305543393546293 A75A-G123A 0.304688834931012 P5A-Y73A 0.303742117026339 P136A-Y189A 0.301991856840862 A2A-A75A 0.301794699347697 Y76A-R125A 0.299275927378172 P136A-W194A 0.298030639411691 E121A-G168A 0.296715466621962 M141A-G168A 0.293752431253618 P5A-Y220A 0.293572715643944 Q196A-E204A 0.290728448292823 L170A-G201A 0.28985925677665 E204A-P234A 0.28853584215491 G122A-L172A 0.284063164462392 A226A-P234A 0.283546887160499 Y73A-V87A 0.283177266938125 G3A-Y73A 0.281447226940992 E135A-G193A 0.280170825217405 A134A-L172A 0.279550386920494 L219A-A239A 0.278946486612048 Q14A-E224A 0.276010259952079 Y189A-G208A 0.275277280802383 F174A-A190A 0.27265468424771 A138A-G171A 0.27188115358272 G71A-S119A 0.269017279287727 R191A-A226A 0.263852771197471 R173A-Y223A 0.263290236138653 G80A-R125A 0.261938121373252 R13A-I233A 0.259407400557539 Y189A-H238A 0.259293116425922 E204A-H238A 0.255583001809346 W118A-G168A 0.255390767406417 R13A-A227A 0.254917702979065 S222A-P234A 0.254826254701762 G193A-R202A 0.253665799183751 A117A-M141A 0.251641732971117 S119A-L167A 0.25062375732167 N218A-G240A 0.249950396976647 E135A-R191A 0.249680039777334 G208A-S236A 0.24832446922123 G122A-E139A 0.245538786139475 Q15A-Q196A 0.244938246500866 A134A-R191A 0.243299982359144 G201A-Y225A 0.243263815213147 G193A-A207A 0.240420139442703 R89A-M141A 0.23806644826074 Q14A-F237A 0.23655521327156 Y83A-R125A 0.235930223114074 G171A-Q196A 0.233109005819237 L192A-V203A 0.232601148739352 G208A-F237A 0.232110596425987 W194A-E204A 0.231015811076455 Y83A-V140A 0.230774402251178 S222A-A239A 0.23047085382043 T195A-V203A 0.230356618160521 R13A-I231A 0.230202061073935 G72A-D85A 0.229995928391891 Q137A-F174A 0.229555444184905 A75A-L84A 0.229308715083715 A75A-S119A 0.229041891621685 G168A-Q196A 0.225823695330682 R173A-Y189A 0.225513827282857 Y223A-F237A 0.224866210287128 P5A-N218A 0.223637312734876 E121A-G171A 0.223185960259951 A190A-L205A 0.222401670384671 G71A-W118A 0.221940293768523 G3A-N218A 0.221104263562443 F174A-Y189A 0.221026818044276 V87A-E121A 0.21925494454126 A227A-S236A 0.218735038935879 R8A-Y220A 0.217065542697946 G72A-R89A 0.214967499466738 Y220A-R242A 0.213710470178855 G123A-L170A 0.209363083245893 Y83A-G171A 0.207420978025342 A221A-G240A 0.206820057810125 G81A-Q137A 0.206586163226163 T86A-G123A 0.206527084847606 E121A-E139A 0.205221613700139 L167A-G201A 0.204374230230302 P136A-G168A 0.204016478788494 W194A-G228A 0.202638338062096 A138A-G193A 0.201462938784352 R13A-Y225A 0.200741242198091 L170A-V203A 0.199909226026267 L170A-T195A 0.199518090068516 P5A-G71A 0.198921536788967 F174A-V209A 0.197145792985007 R191A-Y225A 0.1949977430754 W194A-G206A 0.19400444170215 E12A-A239A 0.193814647578239 H69A-V87A 0.193373084224408 L172A-G193A 0.193345605932077 Q196A-R202A 0.193224193635635 G208A-Y225A 0.192823711804934 Q137A-R173A 0.189719579269477 S119A-G168A 0.185345152174897 S222A-Y241A 0.183562301519734 R8A-A221A 0.179684558545824 G72A-L84A 0.179340818160974 Y76A-S119A 0.17787507383572 G171A-W194A 0.177489784002743 G81A-G171A 0.177330469282528 G72A-T86A 0.176077106786131 G3A-A75A 0.175461376811989 G206A-H238A 0.174221247972599 A75A-T86A 0.174200019417898 G206A-W235A 0.174008947336664 Y220A-S236A 0.173320159955037 G193A-P234A 0.172363852250409 S11A-A226A 0.171959672686914 G171A-Y225A 0.17016850229437 R191A-V209A 0.169366689911042 S11A-Y220A 0.169182493010644 R202A-P234A 0.169173412249327 Y83A-S119A 0.165561411995561 W194A-Y225A 0.165217322805275 V87A-V140A 0.164933187964206 R8A-N218A 0.164832440420388 Y189A-E204A 0.163726512400086 R8A-S222A 0.162687489438271 L84A-P136A 0.162629664507099 G81A-R125A 0.162333462792448 E121A-P136A 0.162147906648402 G171A-A227A 0.161636831452177 Y223A-W235A 0.161517240159259 E139A-R191A 0.159707177141087 R191A-S236A 0.159171130511743 G4A-G240A 0.15899076782267 G171A-G206A 0.158763688297348 R191A-G208A 0.156542555096689 G123A-G168A 0.155768467730592 L192A-G206A 0.15576149742493 L88A-A117A 0.154967421128258 W194A-G201A 0.154533270558098 E224A-A239A 0.154451686686619 Q15A-G201A 0.153765168069135 Q15A-S236A 0.153621368151872 S11A-Y225A 0.151496520060305 T9A-L219A 0.151286182344702 A227A-I233A 0.149716965347979 A2A-R242A 0.149595316655507 G71A-L90A 0.148747653140932 Y76A-E121A 0.148718572157724 G208A-G240A 0.147378524729262 T195A-L205A 0.146403242460698 R89A-E121A 0.145943673500939 E121A-E135A 0.145782818598678 T195A-N232A 0.144856875656553 G193A-L205A 0.144486266846806 E121A-R169A 0.144084227306747 E139A-W194A 0.143114500337885 A138A-R173A 0.142508476673709 V87A-E139A 0.142348824190099 S11A-A221A 0.142231925791867 L192A-G208A 0.142217564484705 E204A-N232A 0.141202507395582 G78A-P136A 0.141177501460925 R125A-A138A 0.140990339021272 Y223A-G240A 0.140406314536575 Q137A-G171A 0.138858846230113 L170A-G193A 0.138215259677046 A7A-A239A 0.136853453010018 G193A-V203A 0.135194060999989 Y189A-E224A 0.134375868738164 L84A-L120A 0.133962196386831 G208A-A239A 0.133911495004918 A190A-G208A 0.13349613478965 E224A-I231A 0.133207229034971 Y225A-H238A 0.132486127095115 A190A-Y225A 0.132259372989922 A74A-A117A 0.132189671955899 Y189A-Y225A 0.131485798696738 F10A-H238A 0.131125016966376 A74A-R89A 0.129925682586994 Q14A-R202A 0.129698473633235 Y73A-Y83A 0.127610451669158 A221A-R242A 0.126686174986601 A2A-Y76A 0.126147799345169 Y83A-A134A 0.125943246042938 A207A-A221A 0.125728781878744 E135A-G206A 0.125609542312953 A74A-Y82A 0.12437990177091 R13A-G228A 0.124325123441972 G193A-I231A 0.124239361569964 L219A-G240A 0.123585935113668 A2A-A74A 0.123005090884794 R169A-T195A 0.122924870451026 Y76A-A138A 0.122732360341585 A74A-G122A 0.122254769998433 V203A-Y223A 0.121322273313337 R191A-A227A 0.121248274333019 A134A-G193A 0.120509557621573 S119A-Q196A 0.119607462140234 L84A-V140A 0.119508615525553 E121A-M141A 0.119437487669693 L172A-G208A 0.11928178133805 E135A-G208A 0.118800783143254 A207A-W235A 0.118595536547778 L172A-R191A 0.118462960828467 R191A-A221A 0.11814761028985 P136A-G193A 0.11624417817386 G80A-G122A 0.115854942612159 W6A-G240A 0.115555651336749 Y82A-A138A 0.115420972027322 G72A-E121A 0.115347231240468 L170A-Y225A 0.115139800422273 G81A-A138A 0.115069656100513 Q15A-E224A 0.115024477271959 A75A-E121A 0.11414298536311 A74A-E121A 0.114041746972247 Q137A-R191A 0.112819349876834 A134A-G206A 0.112602409178991 A226A-H238A 0.112537911441957 G80A-E135A 0.111289344467774 G3A-V77A 0.110441591559605 R8A-R242A 0.109017290710104 G193A-G228A 0.108993906339246 R173A-W194A 0.10791221672879 G122A-L167A 0.106777508103844 G4A-A74A 0.106502970544653 G122A-A134A 0.106218598617902 R191A-Y223A 0.106097737992768 V70A-S119A 0.105682746479545 G3A-A74A 0.104442988986673 N218A-Y243A 0.104089946164932 G171A-L192A 0.103599749578336 Y76A-P136A 0.103531562473083 F10A-G67A 0.103221846736945 G168A-A227A 0.102603969906665 E204A-E224A 0.102551997257565 G171A-G201A 0.10218090388947 R124A-Q137A 0.101038121863637 E135A-R169A 0.100189723818276 G80A-R124A 0.0990830102098572 V87A-L167A 0.0986711363042554 S119A-E139A 0.0977279442785661 F174A-Y223A 0.0977148374715036 E12A-E204A 0.097137719432497 A74A-W118A 0.0955754536749929 A2A-G78A 0.0951696586725967 L192A-S222A 0.0949726979808698 V209A-S222A 0.0937692453491805 L170A-A226A 0.0932405809940882 Q137A-Q196A 0.0930649447203291 Q137A-L167A 0.0928871453347155 R169A-Q196A 0.0928716139596415 R169A-R202A 0.0924153387021084 P5A-A74A 0.0910258770205954 G81A-R173A 0.0909334724703634 L170A-G206A 0.089799338123612 Y82A-A134A 0.0894996811662205 R125A-E135A 0.089009940331779 Y189A-L219A 0.0886592184920438 F174A-G206A 0.0886272246582958 P5A-G240A 0.0881117285598567 F10A-Y223A 0.0875900601636292 L120A-P136A 0.0874859995112942 G81A-E121A 0.087448518864166 T195A-I233A 0.0871015863454362 A75A-L120A 0.0869556895123909 A7A-V209A 0.0868221565237626 E12A-I231A 0.0862777862870998 A134A-L192A 0.0859448478978835 G171A-G208A 0.0853913856999098 G168A-E204A 0.0848408212325027 G206A-Y220A 0.0845976780439077 Y83A-E139A 0.0844262979307924 A75A-G122A 0.0836011901303326 V77A-G122A 0.0828821235145227 L120A-L170A 0.0821148429778544 A138A-T195A 0.0814215919360008 S11A-G206A 0.081357160234357 G168A-G228A 0.081272868500633 G122A-G168A 0.0809136588963342 G201A-A227A 0.0805688505922708 Y225A-N232A 0.0803709846917413 R124A-G171A 0.0799024816809348 G78A-E121A 0.0797558231243261 R124A-L192A 0.0797529905040525 W6A-L219A 0.0794146137601306 R8A-G71A 0.0791689106375126 S119A-R169A 0.0790921376592673 G78A-L84A 0.0789628414403065 V203A-S236A 0.0777832567300596 V77A-E121A 0.0775328132030664 A75A-G80A 0.0765047436646684 L170A-Q196A 0.0762724106968935 Q137A-R202A 0.0758087829214487 A207A-A226A 0.075659364942072 Q137A-L192A 0.0755123128501165 Y73A-E121A 0.0754323957793033 L88A-L167A 0.0735801338202391 G193A-G208A 0.0731092508989905 A7A-V70A 0.0725137323580816 G78A-G122A 0.0723615464798655 Q14A-I231A 0.072327721214652 P5A-Y241A 0.072315965687892 W194A-I231A 0.0712570373752146 E139A-R173A 0.0712416262743618 L172A-R202A 0.0701965458611742 R169A-V203A 0.0691688071765961 F10A-L219A 0.0690073896886112 W6A-N218A 0.068376668356056 E135A-E204A 0.0669218395159784 Q137A-G206A 0.0664115807377388 Y189A-Y223A 0.0661093663409102 R173A-R191A 0.0657196380623332 T9A-R242A 0.0656557612599047 A138A-Q196A 0.0654943770205861 E139A-E204A 0.0652622733283414 Q137A-A190A 0.0647345440429605 F10A-P234A 0.0644112431587532 R202A-E224A 0.0638711297609298 Y220A-Y241A 0.0638188039126755 R173A-V209A 0.0637967660850471 E224A-P234A 0.0635086797161728 Q15A-Y225A 0.0634952741035457 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