[Wed Aug 24 17:40:01 2016] >Input file: TM4R7CATD.pdb >TM segments: A25-42_A74-95_B25-42_B74-95 MAIDEN score = -47.8167 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 ----------- ---------------- T31A-F93A 0.830324316802536 T31B-F93B 0.829809253414116 F28A-F93A 0.591958889528023 F28B-F93B 0.580685469362144 I94B-F84A 0.556381636249945 L27B-L89B 0.501314885497027 L27A-F93A 0.457701801262885 L27B-F93B 0.422254018752811 Y42A-G75A 0.406320065863288 Y42B-G75B 0.405423704917943 L27A-L89A 0.404553300310353 Y82B-I87B 0.40263810165759 Y82A-I87A 0.393415595027775 I94B-I87A 0.352643230416862 L27B-V90B 0.330215354907514 H95B-G88A 0.324647789032042 L30B-L89B 0.307368850201964 L30A-L89A 0.301287855167358 T34B-G86B 0.26827402895323 L27B-G92B 0.256241571269749 L27A-V90A 0.250629418866565 T34A-G86A 0.248487213944552 F78B-G86B 0.247777350195624 F78A-G86A 0.244383710898844 G38A-L81A 0.234057053753681 G38B-L81B 0.233505651678382 V90B-I87A 0.231257988191359 L27A-G92A 0.228674606251211 Q25A-G92A 0.221741302213891 T31A-H95A 0.220080228432979 T31B-H95B 0.218961241274056 L30A-G88A 0.214416950041146 T31B-L89B 0.210636264360677 V90B-I83A 0.210524218656172 Q25B-G92B 0.189122793212892 L35A-V90A 0.188376666092985 T31A-L89A 0.187820006349194 T39B-I77A 0.178505888573661 L30B-G88B 0.174515495218694 L27B-G86B 0.172016516744877 H95B-H95A 0.169132263688397 I94B-I85A 0.166867550899884 I32A-I87A 0.166229050379102 T31B-F84A 0.1596931254432 I32B-I87B 0.15314971223539 I94B-G88A 0.152494898909764 T31B-V90B 0.152467467086685 I94B-G92A 0.150573265890891 L35B-V90B 0.147335763672102 K76A-L81A 0.144971143434986 I32A-V90A 0.143396446515057 G92B-F84A 0.143210053278083 K76B-L81B 0.141166964821267 V26A-G92A 0.139641604622533 L27B-I85B 0.138164334144479 T39B-K76A 0.136853424818248 F93B-F84A 0.134963674904384 L30B-Y82B 0.12791724596113 T31B-I80A 0.127914668816866 Y42B-I83B 0.127255379139254 T39B-I80A 0.126187883473199 L30A-Y82A 0.126145224937977 I32B-G92B 0.124571494510272 I32B-V90B 0.124184062060125 T31A-V90A 0.123707077987286 I32A-G92A 0.122717135942267 T39B-G75B 0.121898161802587 T39A-G75A 0.120821193551783 Y42A-I83A 0.120752803122855 H95B-G86A 0.117890607350938 Q25B-L89B 0.117873971320315 L35B-L81A 0.117354744104704 I32B-G86B 0.117163001651939 F28B-F84A 0.114528419628486 Q25A-H95A 0.114023707549825 Y42A-I80A 0.11114626968837 G88B-G88A 0.111113943817597 G92B-G86A 0.110633611092965 Q25B-F84A 0.109958146994732 Y42B-I80B 0.109645102102121 S37A-L81A 0.108945525393639 I32B-Y82B 0.107771881527414 I32A-G86A 0.107394501443858 L27A-I85A 0.107105767737806 T39B-V90B 0.107085578459093 T39A-V90A 0.106656501830299 S37B-L81B 0.106626279506901 I32A-Y82A 0.105504633254843 Q25B-H95B 0.105220198089893 L27A-G86A 0.105022974068826 V29A-G86A 0.104674166167949 L35A-I94A 0.104505138235709 L81A-L89A 0.104003528047732 I36A-L89A 0.103973992100245 V29B-G86B 0.103407941885566 Q25A-L89A 0.102199001553465 Y42B-G86B 0.101476860179952 T34B-G88B 0.101256357098918 T34A-G88A 0.101211321406853 F91B-G92A 0.0993915670665038 I40A-T79A 0.0993050058532852 V90B-L81A 0.0991316809663658 Q25A-F93A 0.0989050032221943 I36B-L89B 0.0984789465596627 T34A-G92A 0.097809149676193 L35B-I94B 0.0977308807054786 L81B-L89B 0.0968138836766448 S37A-T79A 0.0952189214249661 Y42A-G86A 0.0946668855226331 S37B-T79B 0.0943600054828826 L33A-I94A 0.0938017842234385 L35A-I80A 0.0938017842234385 L35B-I80B 0.0938017842234385 T34B-G92B 0.0914756515147834 I40B-T79B 0.0913222127203346 V29B-T39B 0.0908531544792335 V29A-T39A 0.0908531544792335 L27B-I85A 0.0891653576328043 L35B-I77A 0.0884395610713558 G38B-K76B 0.0882800787923003 F93B-G86A 0.0878867823984004 G38A-K76A 0.0876985902439656 F91B-G88A 0.0865192804312223 F28B-L89B 0.0859306445190122 L89B-I87A 0.085187667371593 F28A-F91A 0.0848214047995608 F28A-L89A 0.0842627632158783 Y82A-V90A 0.0835980183522179 Y82B-V90B 0.0835557816389868 G92B-I85A 0.083289736073435 G38A-F84A 0.0829016729990961 F28B-F91B 0.0825132315312285 Q25B-V90B 0.0812195686754513 T79B-V90B 0.0810860311126476 F41B-K76B 0.0805082358352545 L35B-G86B 0.0804875952768862 L30A-F84A 0.0804199170254494 F41A-K76A 0.0799950225220034 I32A-I83A 0.0799326419836419 V90B-I80A 0.0791487814629841 L30B-F84B 0.0777798042660391 T79A-V90A 0.0777072989869261 I87B-H95B 0.0776586605252486 I87A-H95A 0.0774366378266265 L35A-G86A 0.0772291591582357 F28B-L81A 0.0768208394030343 G38B-F84B 0.0756772605004388 I32B-I83B 0.0753343117929779 Q25A-V90A 0.0750899674943608 L81A-G86A 0.073894347049186 L35A-F78A 0.071622196443851 Q25B-L30B 0.0706661582981618 I85B-V90B 0.0706566059798384 Q25A-L30A 0.0688901145802174 G92B-G92A 0.0679382955440402 L35B-F78B 0.0673509001735466 V90B-G86A 0.0668677430237876 L81B-G86B 0.0661087904669198 F28A-I87A 0.0652514461446394 G38A-F78A 0.0651636353142493 I40B-F74B 0.0649522051936051 L33B-I87B 0.0632835487972359 H95B-I94A 0.0631030942176023 L35A-L81A 0.0628912660534802 I94B-V90A 0.0625239473289376 F93B-L81A 0.0623182510969928 I80B-G88B 0.062282157444268 H95B-V90A 0.0619991232248891 V26B-H95B 0.0616541262089676 Q25B-L33B 0.0615980547881554 F28B-I87B 0.0611118024873564 T39A-F74A 0.0609117066556353 T39B-F74B 0.0606232581401507 T39B-I83B 0.0586250979134562 L33A-I87A 0.0582306053813715 F84A-G92A 0.0576604718326519 F28A-G88A 0.0573527180616633 G38B-I85B 0.0572986179848327 G38A-I85A 0.0571849861629061 Q25A-L33A 0.0570140234904972 I40A-F74A 0.0568441406044862 I32B-F91B 0.0562993923918518 Y42A-L81A 0.0557445708767261 I80A-G88A 0.0556240893269759 I85A-V90A 0.054332829087155 I36A-I87A 0.0533456934550216 T34B-I80A 0.0531603115993747 Y42B-L81B 0.052250560928373 V29A-S37A 0.0521124580796952 F91B-F91A 0.0517302135804858 T34B-F84A 0.0498943357610786 L35B-L81B 0.0494078849949577 I32A-F91A 0.0489848011590661 V26A-H95A 0.0488939604353176 F84B-G92B 0.0487617364978958 F28B-I85A 0.0486248182795621 G38B-I77B 0.0480993659298901 L81A-G88A 0.0480502294233141 G75A-I83A 0.0473408395111656 F93B-L89A 0.0470449750353463 V29B-S37B 0.0461464311590185 L81B-G88B 0.0457043278390308 G75B-I83B 0.0445254448519776 G38A-I77A 0.0443393018320055 T39A-K76A 0.0418662028080367 G38B-I80B 0.0416139061685064 T39B-K76B 0.0412812743882003 I40B-G75B 0.0406250885533814 T31B-I83A 0.0403355469625328 G38A-I80A 0.039945261099505 F28A-G86A 0.0392633997845859 G38B-V90B 0.0391619678327082 V29B-I94B 0.0391142253944157 I32B-I85A 0.0385447454717047 S37B-G75B 0.0385279100267595 S37A-G75A 0.0384954589271141 I40A-G75A 0.0375877547747274 G38B-F78B 0.0365670138687078 V26B-G92B 0.0363763399025521 T31B-L81A 0.0358951326532813 K76A-F84A 0.0355557552480694 F28B-G88B 0.0354341512872987 G38B-L89B 0.0348000922149736 I40A-Y82A 0.0344028382549078 S37A-Y42A 0.0331792486871318 I40B-Y82B 0.0328399420552921 K76B-F84B 0.0327731914733813 I85A-G92A 0.0322160182778268 I94B-G86A 0.0318415954750773 I36B-I80A 0.0308844582492522 L35B-F93B 0.0307772126741568 L35A-F93A 0.0300456445459956 Q25B-F93B 0.0295626316000872 F41B-L81B 0.0290810766085476 F41A-I83A 0.0289710359733704 I85B-G92B 0.0285875967825069 G38A-L89A 0.0281260591827146 I36B-I87B 0.0274030468387609 I36A-G86A 0.0267868706336776 L35A-T79A 0.0265909711508989 L35B-T79B 0.0265676075024448 F41A-L81A 0.0258143630000482 G38A-V90A 0.0254629656404353 F91B-F84A 0.0254621508341479 F28B-G86B 0.0244975996957528 F91B-Y82A 0.0241721550357443 S37B-G86B 0.0218891771206948 I85B-F93B 0.0218890225720152 I36B-G86B 0.0215303190698863 T31B-G38B 0.0213474570370706 T31A-G38A 0.0211244096606487 I36A-V90A 0.0208887218559719 V29A-I94A 0.0193780566753396 I77A-F84A 0.0187188136277722 I83A-F91A 0.0185837994965565 I77B-F84B 0.0182367601881654 I85A-F93A 0.0180564736598487 T34B-F78B 0.0179414496874282 T34B-F93B 0.0179226802841104 I83B-F91B 0.0178337224484098 T34A-F78A 0.0175970310986255 T34A-F93A 0.0175491401662047 I85B-F91B 0.0174632533824299 I85A-F91A 0.0173143033116087 G86A-H95A 0.0170986341215905 I36B-V90B 0.0168679289365776 G86B-H95B 0.0164203631995289 G38A-I87A 0.0163191292005247 F41B-I83B 0.016204925807223 I87B-F84A 0.0159104203381748 V90B-F84A 0.0157898818471188 G92B-I87A 0.0155310679573724 T39A-I83A 0.0151724781263365 F93B-I87A 0.014236212434968 V90B-G88A 0.0124164629029302 L33B-G88B 0.0121443239431924 V26A-G86A 0.0118635208188032 Y82B-G88B 0.0116620655649844 S37A-G86A 0.0106220641945196 V29B-I87B 0.0097710470850636 H95B-I83A 0.00936061535152749 K76B-I85B 0.00935124785947528 G38B-I87B 0.00878825845272324 L33B-F91B 0.0086279037027559 G92B-F91A 0.00804152128317703 Y82A-G88A 0.00786479901428061 G38A-F74A 0.0072490583647431 G86A-I94A 0.00561166810162872 S37B-Y42B 0.00493266709480622 L33B-F93B 0.00458030090183392 K76A-I85A 0.00426382390990332 G92B-G88A 0.00365018122838023 F78A-I87A 0.00362103243937906 L35B-I83A 0.00282731167693484 F28B-G88A 0.00256906891213671 L33A-F93A 0.00245724897347621 V26B-F91B 0.00234585744488491 F91B-V90A 0.00212371626347529 L33A-G88A 0.00177995780474038 L35B-F91B 0.00170727852009644 T79B-G88B 0.00130876848282457 T79A-G88A 0.000814343340437507 L35B-T79A 0.000273584486477185 G86B-I94B -8.08324952918937e-05 T34B-F91B -0.000355694652949046 F91B-I83A -0.00094136679746093 T39B-L81B -0.000998965221652881 T39A-L81A -0.00104309361841159 T34B-I94B -0.00241293907135542 G38B-F74B -0.00269598700970475 L30A-G38A -0.00273380801540046 F84A-V90A -0.00273646856973464 Y82A-F91A -0.00350901725128816 T34A-F91A -0.00474991459182239 L30B-G38B -0.00506421051984951 F78B-I87B -0.00542742137820973 F91B-L89A -0.00544354105963052 S37A-V90A -0.00553746714295356 T34A-I94A -0.00592970057002162 Y82B-F91B -0.00682174764752963 Q25A-T34A -0.00760872489225051 L35A-F91A -0.00799600326129957 F93B-Y82A -0.00854703214860919 F84B-F91B -0.00888674196668671 I36B-I77A -0.0089341846989015 F84A-F91A -0.00981385557436631 Q25B-T34B -0.00985034206381918 V90A-H95A -0.010514164337518 V90B-H95B -0.0105465350155343 L35B-F84A -0.0105919883042169 F84B-V90B -0.0114568683677678 I32B-I77A -0.011677857790362 T31A-I40A -0.0117653192324951 F41B-I80B -0.0122188190213892 V90B-Y82A -0.0125196218670154 T34A-I85A -0.0134993353572348 V26B-G88B -0.0135777768250387 V26B-G86B -0.0141317918746457 S37B-V90B -0.0143934776522832 T31B-I40B -0.0145857443486666 F41A-I80A -0.0156238876353134 L33A-F91A -0.015803200984891 T39A-F78A -0.0158425342248001 L35A-G88A -0.0162550914902733 V29A-F91A -0.0169084456416462 L30A-I83A -0.0177120863571849 Q25B-I94B -0.0179672997063287 T39B-F78B -0.0186169313507309 L35B-G88B -0.0197186205870414 L27B-F84A -0.0204091819784189 V29B-F91B -0.0204287886615226 V90B-I85A -0.023137867634226 S37A-F74A -0.0235613802051475 L33A-G92A -0.0237834799497554 I36B-T79B -0.0238300559009579 S37B-F74B -0.0249732520852184 S37B-F84B -0.0257147071846882 Q25A-I94A -0.0258291346952797 F91B-L81A -0.0265366342484477 T34B-I80B -0.0266791448428423 S37A-F84A -0.0279170581348387 L33B-G92B -0.0287437092651981 V26B-T34B -0.0298374427671684 T31A-I83A -0.0301097866627993 T39B-G86B -0.0301895496557609 V26A-T34A -0.0302215206931615 T34A-I80A -0.0309064305853006 I83A-F93A -0.0312660566532266 T34B-I85B -0.0318232410543198 T39A-G86A -0.0319765882166978 I36A-T79A -0.0320595201809981 I94B-I83A -0.032354485534265 F91B-G86A -0.0326602790925232 S37B-I80B -0.0326760424382731 S37A-I80A -0.0328436903314626 L89B-G88A -0.0334482737393476 V26A-I94A -0.0348119014536685 I83B-G92B -0.0357784464943762 L30B-F84A -0.0380840954201496 T39B-Y82B -0.0386333351157114 T39A-Y82A -0.0387910593362802 Q25B-T31B -0.0389911975555126 V29A-I87A -0.0399540198431776 L27A-I94A -0.0414507681697867 L35B-G92B -0.0415263805310442 Q25A-T31A -0.0420836342104274 T34B-F84B -0.0422633431844011 I32A-F41A -0.0429940283707424 T31B-I85A -0.0436519448595727 F93B-G92A -0.0442238465500258 G86B-F84A -0.0444913999966645 F74B-Y82B -0.0448762543058745 F74A-Y82A -0.0454238795895936 I83B-F93B -0.0463316284258513 Y42B-T79B -0.0466001062880372 I32B-F41B -0.0466462482388543 I83A-G92A -0.0466674227117476 I80A-I87A -0.047430662439881 L35A-G92A -0.0494137177770524 L35B-I83B -0.0498049706705395 V26A-F91A -0.050756249541883 Y42A-T79A -0.0509537999102947 L35A-I83A -0.0512560476702959 G75A-F84A -0.0514079514324484 G75B-F84B 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