[Wed Aug 24 18:51:21 2016] >Input file: TM2X55CGD.pdb >TM segments: A11-21_A47-57_A61-73_A105-118_A122-135_A168-182_A184-199_A217-233_A235-248_A260-272 MAIDEN score = 468.4694 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 ----------- ---------------- Y222A-K246A 10 S245A-N262A 10 T134A-F169A 10 W196A-S219A 10 K124A-Q179A 10 T63A-K114A 10 N65A-N112A 10 L118A-A125A 10 I226A-F242A 10 E186A-G229A 10 Y109A-E133A 10 S194A-Y221A 10 K237A-Q270A 10 W56A-L64A 10 K192A-G223A 10 L111A-Y131A 10 S170A-R198A 10 N188A-N227A 10 I174A-F193A 10 T224A-Y244A 10 T128A-G175A 10 Q132A-M171A 10 Y247A-N260A 10 V197A-S219A 10 T243A-T264A 10 Y180A-L187A 10 A14A-D53A 10 S21A-Y263A 10 L50A-T70A 10 S16A-K51A 10 R67A-D110A 10 E241A-T266A 10 L190A-V225A 10 T12A-S55A 10 Y230A-V238A 10 L176A-F191A 10 V13A-Y271A 10 W69A-E108A 10 M19A-V265A 10 L20A-V47A 10 W69A-N107A 9.10374066502004 N107A-R135A 7.92208215384494 T17A-A267A 6.28704367288833 G126A-A177A 5.80728674521026 G130A-Y173A 3.72850833424894 G18A-I49A 2.33082818592669 I54A-A66A 2.096868680976 K246A-K261A 2.03199401503799 T128A-I174A 1.54856276376024 M19A-V47A 1.53176496779574 A189A-V225A 1.33898076905174 I49A-T70A 1.20699584109756 T12A-I54A 1.16921225785687 L190A-T224A 1.15445143881284 G115A-I127A 1.12781188537054 I127A-L176A 1.1171180832957 I49A-W69A 1.07898773777316 K114A-A129A 1.07476351449 M19A-I49A 1.07094116354078 M171A-W196A 1.04822603910984 L50A-W69A 1.04817262143294 F11A-W56A 1.02868535035663 F185A-Y231A 1.00511233733173 L187A-N227A 1.00248931345786 I49A-L72A 0.954199646874168 V113A-I127A 0.950665442780062 D184A-V232A 0.94739470654802 A236A-R272A 0.922169082969756 L176A-L190A 0.899924933352696 F169A-V197A 0.896310181456748 Y230A-F239A 0.877172093867056 V13A-D53A 0.870275616151048 F242A-V265A 0.862109105624159 T17A-L50A 0.840286898307401 F61A-K114A 0.834068832270313 T63A-V113A 0.831993551543025 F61A-W116A 0.82660691705308 L117A-K124A 0.82600324740026 I54A-L64A 0.816985847114042 L190A-I226A 0.800805036409199 A14A-K51A 0.798649367657854 K124A-A177A 0.78917832813301 V13A-I54A 0.786698692784328 F191A-V225A 0.777208820449696 W196A-G218A 0.761939937551734 L20A-V265A 0.745062069249132 M19A-T264A 0.743873990357305 L20A-T264A 0.739099043238632 N122A-I182A 0.729682082834156 W69A-A106A 0.721743354855451 T243A-V265A 0.714694637812526 S55A-L64A 0.713665807340645 F239A-L269A 0.701813923963854 H105A-R135A 0.700929264141306 N188A-I226A 0.688818520017651 V238A-L269A 0.685072910476676 A177A-F191A 0.682240192542291 N65A-L111A 0.678007113808615 L111A-A129A 0.669751597694788 Y180A-F185A 0.664372378377911 L64A-V113A 0.662924754990364 V225A-F242A 0.659843858393901 V225A-E241A 0.654607079301583 I174A-F191A 0.648223312989779 D110A-E133A 0.646576470406718 L176A-A189A 0.645826639434321 F242A-T266A 0.634463145898219 R198A-S219A 0.628330787973438 S16A-G52A 0.626805682665542 A240A-V265A 0.623914951238785 Y173A-K192A 0.622138115393656 I226A-A240A 0.619421520049619 V197A-D248A 0.617134062877176 F169A-A199A 0.614531967045277 F242A-Y263A 0.607740961065199 F11A-Y271A 0.590779533774429 W116A-K124A 0.580319952620682 F11A-S55A 0.575851826921744 Y230A-K237A 0.571276305236923 P172A-D195A 0.566401145467491 F239A-T266A 0.561045578276626 I54A-R67A 0.560613866310494 W56A-L62A 0.545444255633343 K237A-G268A 0.544482633758781 G223A-K246A 0.540444865559403 V13A-L269A 0.53214232383875 F191A-T224A 0.517028155806647 A228A-V238A 0.514600754990083 W69A-Y109A 0.514322032352798 F61A-L117A 0.512177155140437 S170A-W196A 0.488177618983428 P172A-F193A 0.485654944127667 W56A-T63A 0.481181045559595 A73A-H105A 0.474003130533256 D57A-L62A 0.473073038417565 L20A-I49A 0.471579263605904 W196A-S217A 0.466055356085722 R135A-F169A 0.460971453552416 V238A-A267A 0.456859269834185 V197A-S217A 0.456795150167938 T224A-F242A 0.456653359376022 M19A-A48A 0.45628696482585 W56A-N65A 0.453609874873735 E133A-M171A 0.444675682396191 E241A-V265A 0.444114498446792 A15A-L269A 0.439029117596995 Q179A-L187A 0.436807867851854 V232A-K237A 0.434653905565089 V47A-S71A 0.434279212263951 D110A-Q132A 0.430857297311375 T128A-A177A 0.427282164050077 K51A-N107A 0.427264222859386 F11A-I54A 0.426142022317071 V47A-A73A 0.421779327938532 Y131A-S170A 0.420414147434838 I54A-N65A 0.419146696508783 S16A-L50A 0.416216548307442 T128A-F191A 0.411776416190165 G223A-S245A 0.410304669841195 N227A-K237A 0.409941366738814 Y221A-S245A 0.409007088046289 T17A-T266A 0.406804139992712 Q132A-K192A 0.405921995531364 L62A-V113A 0.404243033395759 K51A-Q270A 0.400503601706149 V13A-Q270A 0.397775167294034 V197A-Y221A 0.397423333532631 Q132A-K246A 0.393939244083901 A236A-Q270A 0.392563102676474 G229A-K237A 0.392212384736947 S219A-Y247A 0.391916307118892 S21A-H105A 0.389705856296666 A228A-E241A 0.387224981310175 A240A-T266A 0.3855203401032 G52A-W69A 0.381370710895914 N107A-T134A 0.373741675000016 A189A-I226A 0.372326671670373 K114A-G126A 0.370000005962272 Y244A-K261A 0.367220857325551 T224A-T264A 0.364003525970412 Y173A-G218A 0.358519093547275 T12A-D53A 0.356375529091578 W116A-I127A 0.356023439892377 L62A-W116A 0.355115530952097 L118A-Y123A 0.353577012645252 L20A-A48A 0.352054715091011 Y131A-G223A 0.349941842075243 T70A-E133A 0.346646372994756 T134A-S170A 0.345127552659378 F193A-Y222A 0.342947002502784 A240A-G268A 0.339529566512929 G229A-A240A 0.339390957832058 V225A-Y244A 0.336529631510878 F185A-Y230A 0.334095741374444 A236A-L269A 0.332183712467138 P172A-S217A 0.331954559520484 K192A-R220A 0.330307634625267 G126A-Y180A 0.326745288502938 G130A-M171A 0.32599838259774 D57A-V113A 0.325941007241583 N227A-F242A 0.323975430664328 T224A-S245A 0.32337617186316 M19A-Y263A 0.322871475267124 S55A-T63A 0.322030281773406 T128A-T224A 0.320893947243939 A48A-T70A 0.320618291506211 Q132A-Y244A 0.320593272307676 G115A-Y123A 0.318316746580055 G175A-F193A 0.31792182095891 G229A-Y271A 0.317319301518476 G52A-E241A 0.316175299229679 F193A-G223A 0.312837896909192 V13A-Y230A 0.311364383565382 A177A-G223A 0.309366266457854 L50A-L72A 0.308780918841108 Y230A-R272A 0.308592086297198 I226A-E241A 0.305534174993054 N112A-Y131A 0.30405689319119 A15A-Q270A 0.30284192880043 Y230A-Q270A 0.302384896503462 K51A-E108A 0.29760913599667 A125A-L176A 0.296609863283762 A129A-S194A 0.296472032844433 D57A-L64A 0.29520045813259 G115A-G130A 0.294559081142922 E241A-A267A 0.29391469284613 F239A-Q270A 0.291118628292052 L64A-G130A 0.290348362191878 G130A-Y222A 0.290106034031805 D53A-Y271A 0.284657087379442 G223A-N260A 0.284561461134281 L72A-A106A 0.2815079437095 A189A-T224A 0.281399048720552 A15A-L50A 0.279965561903186 G126A-N188A 0.27970507828987 G229A-N235A 0.279392424741341 E186A-Q270A 0.279339206037284 G52A-N107A 0.27902007341787 M171A-V197A 0.275657472987649 R67A-M171A 0.274738071390444 E186A-T233A 0.27445014753429 G130A-L176A 0.274276498632408 T17A-V265A 0.274259232403225 S194A-S219A 0.274004028207303 P172A-K192A 0.272508771129771 N112A-G130A 0.272399900098451 Q132A-Y173A 0.27219864545226 P172A-Y247A 0.271820717292077 A14A-L269A 0.27166680651854 S16A-L269A 0.270912467491121 T17A-I49A 0.269724808674255 D110A-V225A 0.268664005963685 V232A-V238A 0.264526546503439 R181A-A228A 0.264209267988246 R135A-A199A 0.263752198798545 T243A-T266A 0.263663427334301 G130A-G223A 0.263339642543504 G175A-F191A 0.262609666866656 E186A-V238A 0.26241025599034 N227A-F239A 0.261737413263163 G18A-A267A 0.261615613263234 L64A-N112A 0.260666805206736 L50A-G68A 0.259647806782819 L62A-K114A 0.257814536817349 Q132A-Y247A 0.25501782356497 R135A-M171A 0.254609522578902 R67A-Y131A 0.254211062915666 Y109A-R135A 0.25370279610193 M19A-T266A 0.253042669900527 K114A-A189A 0.251224739379761 A129A-G175A 0.251057965063733 T224A-T266A 0.248410408248877 D53A-L269A 0.247850464404865 Y173A-D195A 0.246544632329338 F11A-R272A 0.246387520377374 Q179A-N227A 0.246261141291572 W116A-G175A 0.244694961840909 T70A-T243A 0.244085091915528 T17A-Q270A 0.244012396725185 G130A-F191A 0.242936972385289 A106A-R168A 0.242672080747263 D57A-T63A 0.242517670266532 T233A-L269A 0.241922844003803 W56A-V113A 0.241064608026832 L62A-T128A 0.2396509265448 K192A-S219A 0.238592997879116 K51A-E241A 0.238504967893608 S170A-K192A 0.237831928056042 G130A-I174A 0.236693217288446 N122A-L187A 0.235208348485718 W196A-Y221A 0.233887613093391 W56A-K114A 0.233071039886022 L118A-G126A 0.231797198368504 S21A-V47A 0.231643319735286 A14A-A240A 0.231487688392992 N188A-G223A 0.231248991614899 T17A-L72A 0.230850692262606 Y222A-F242A 0.230232158705834 Q179A-F191A 0.230082455786192 L117A-A125A 0.229318708351882 Y131A-F191A 0.229296282400853 N65A-G115A 0.229268690962281 G52A-A66A 0.229189430674235 A15A-R67A 0.229016334802029 N112A-G126A 0.227571165628667 K192A-D248A 0.225921248634104 Y222A-D248A 0.225349473833313 L64A-T128A 0.225068676508852 A199A-K246A 0.22494322850719 W196A-K246A 0.224834764992193 A66A-L111A 0.224491040784433 D110A-K192A 0.224320154904635 W56A-G115A 0.223667024258145 R168A-D248A 0.223431806873195 G52A-N112A 0.222851670500558 W69A-T243A 0.222272079443717 K192A-Y244A 0.221653410831029 Q132A-G223A 0.221137524082512 Y222A-Y247A 0.220524650633132 E133A-R198A 0.219844199936145 E186A-Y231A 0.218744437573303 F169A-R198A 0.218142098687061 L118A-K124A 0.216895373640453 E186A-K237A 0.216660656310681 L117A-G126A 0.216555275870361 K114A-A177A 0.215033410633717 F242A-T264A 0.214567427668093 S21A-T264A 0.213219816433984 F11A-A66A 0.213044002585434 E108A-N260A 0.212024087981272 D110A-G130A 0.211867645230522 A15A-A267A 0.211861677408407 G52A-T264A 0.211488755638227 A106A-Y263A 0.210998369700621 R135A-Y247A 0.210720021048404 V225A-T243A 0.210110749244516 K192A-Y222A 0.209874933376722 D53A-V238A 0.20850015727689 V113A-T128A 0.207965398746493 T12A-Q270A 0.206934927106763 Y180A-N188A 0.206337086492131 R220A-Y244A 0.206295317914616 A48A-Y263A 0.206278903985758 N227A-Y244A 0.20608734347824 G68A-N112A 0.204973423994348 T17A-G268A 0.203199097919975 L20A-N262A 0.202395050093718 T63A-G175A 0.202037932886737 L187A-A228A 0.201625964891342 D184A-Y231A 0.200985332580344 R67A-V113A 0.200395492554389 Y230A-A236A 0.199074778713497 E108A-T264A 0.198966538841912 G175A-V225A 0.198870486465671 R198A-N260A 0.197684112083428 A125A-F191A 0.197205098388837 E241A-Q270A 0.196457641523113 R181A-N227A 0.195712513565876 Y180A-V238A 0.195303443062214 L62A-G115A 0.195206094014755 T17A-I226A 0.195102933029438 T63A-G178A 0.194950355283724 L50A-G268A 0.194095197124998 D53A-Y109A 0.194033523788844 G68A-Y263A 0.193984445807802 G18A-T264A 0.193809609427616 G115A-Q179A 0.193293075442904 D57A-R272A 0.192978830630943 Y131A-S194A 0.192750350945888 N235A-G268A 0.191983764021928 F193A-R220A 0.191537535472846 R198A-G218A 0.190280939325336 N188A-T243A 0.190079858452429 F191A-Y222A 0.189047092503294 N112A-Q132A 0.188301824326946 I182A-G229A 0.187820810039154 I49A-V265A 0.187474959118017 A14A-I54A 0.187410600728256 T224A-T243A 0.18710926630168 W69A-T266A 0.185788617873156 A66A-Y109A 0.184954884824812 T224A-A240A 0.184390711642691 E133A-Y221A 0.184113116859758 P172A-S194A 0.183808764399422 N112A-F193A 0.183182234139762 G18A-F242A 0.1830012802579 Y230A-E241A 0.182697986970085 M19A-G52A 0.182428890114354 L176A-K192A 0.182423939397136 G18A-A106A 0.181859937703642 S16A-Y271A 0.181218508972658 Y131A-W196A 0.180905334935427 G52A-L64A 0.178987168156174 R135A-D248A 0.178933948002717 A236A-Y271A 0.178920722413667 G115A-L190A 0.178354814158448 L62A-K124A 0.178314230389625 R168A-D195A 0.178264277097841 K114A-F191A 0.178248602744926 S194A-Y244A 0.177958450717948 D184A-R272A 0.177925409480697 D110A-R168A 0.177564613029031 Y109A-S245A 0.177484711014102 Y109A-G223A 0.177379372080106 N112A-S170A 0.177064858154186 I127A-G178A 0.176646084162332 K114A-L190A 0.176141611548724 S21A-Y247A 0.176029824488121 S71A-Y109A 0.175937775747768 F191A-T243A 0.175712448781373 S71A-Y263A 0.17563989533522 E133A-Y247A 0.175601096743303 G115A-A125A 0.174837574256111 G178A-L187A 0.174344322573551 Y222A-Y244A 0.173415658294457 A228A-T264A 0.173172495612437 G115A-Y173A 0.173096886820555 E133A-Y222A 0.173048896325072 A66A-G130A 0.17278391266388 G126A-Y173A 0.170936404218872 P172A-V197A 0.170916300900903 V232A-F239A 0.170674066671405 N227A-T264A 0.170253164366874 F61A-A177A 0.169792890466455 R135A-Y263A 0.169650682676727 Y180A-Y231A 0.168772687186571 T17A-K237A 0.168407397054977 A15A-A236A 0.16831744356857 V113A-M171A 0.168249548066694 S21A-R135A 0.168023488951213 W196A-Y247A 0.167952132022034 T17A-F242A 0.167421918757908 L187A-G229A 0.166846231113418 G68A-A240A 0.166840362035841 V47A-V265A 0.166566642482225 T134A-T224A 0.16640087985503 I49A-H105A 0.166072714519173 G18A-A73A 0.165660311214356 G18A-L269A 0.164890243545782 W56A-R272A 0.164611954803134 R168A-S219A 0.164585904516661 E108A-Y244A 0.16450924688023 G229A-V238A 0.16424811461472 A14A-G268A 0.164145128845783 A48A-G268A 0.16256488188078 V13A-A267A 0.162449356986055 E108A-Y263A 0.16181732563681 D110A-T128A 0.161621354237291 A129A-P172A 0.160181269920871 S71A-N262A 0.159691993373405 T17A-D53A 0.15911662762907 T63A-D110A 0.158529424894454 S21A-N260A 0.158497981886477 R67A-Q270A 0.156827549563339 R168A-W196A 0.156412017572507 L187A-I226A 0.156213909326295 H105A-E133A 0.155511067492805 S55A-K237A 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