[Thu Aug 25 00:46:15 2016] >Input file: TM2XMNATG.pdb >TM segments: A33-50_A62-91_A222-262_A305-329_C111-136_C167-193_B194-204_B242-251_B284-292_B344-421 MAIDEN score = 4.4407 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 ----------- ---------------- L196B-L419B 10 P40A-Q73A 10 K401B-L407B 10 A64A-T259A 6.85414893579463 I237A-A305A 2.02119419410358 Y50A-N63A 1.47318928001888 Y48A-T65A 1.40703169926203 N197B-L419B 1.3761418521677 L196B-K421B 1.18128239593553 A46A-A67A 1.15512173086609 I292B-L42A 1.13868934156626 L290B-L44A 1.1282611134004 I75A-L248A 1.12657069152668 I75A-D249A 1.09905269530494 L248B-F288B 1.06657576000424 Q41A-Q73A 1.06457791001395 Q184C-Q325A 1.0464827006906 F362B-S367B 1.01645724711095 I120C-L175C 1.01284970058835 K89A-L228A 1.00343630235422 I75A-L250A 0.947758566293086 A34A-K80A 0.890721632357617 L86A-Q236A 0.872251365077283 F362B-V372B 0.846160497612473 F76A-L248A 0.81679195390296 L86A-E235A 0.815206954771837 Q230A-A312A 0.814492671675486 L398B-D411B 0.781276226079687 H244B-P291B 0.770099062058901 P291B-L42A 0.757371419600697 L44A-L69A 0.752808213574674 S402B-L407B 0.733831605051944 V348B-L379B 0.723107408735578 P40A-L71A 0.7216287853735 L248B-L286B 0.721355745271522 D77A-L245A 0.719060354408782 L245B-L290B 0.713831723875405 A119C-R172C 0.710204928940371 L182C-Y189C 0.689674224060751 K345B-A382B 0.68838744793158 I292B-L44A 0.686636324883052 L398B-L407B 0.6790397263891 M78A-L245A 0.645968793862973 P37A-Q73A 0.640467354071105 F362B-I369B 0.637806996377574 A34A-L84A 0.637528043595039 H244B-L290B 0.63674499861391 A112C-V179C 0.628362785710483 M358B-A375B 0.617295284613892 L38A-Q73A 0.601240061109885 Q230A-L316A 0.595478378548116 L39A-S74A 0.587748709235083 G187C-R321A 0.580958186737273 D77A-P246A 0.569259588458458 D77A-H244A 0.567206306723323 V179C-Y189C 0.566710989841226 F201B-A418B 0.555585256749326 M358B-V372B 0.550751279243412 V116C-L175C 0.538532785204826 Q73A-L250A 0.527848945869732 V179C-Y190C 0.526709695322022 V122C-A171C 0.525393247286648 P246B-F288B 0.513852275984237 L86A-L232A 0.506586528642747 A351B-T376B 0.504274217929931 T203B-Y393B 0.499715756032064 S66A-G255A 0.498214381426627 T251B-L286B 0.495464252862293 L245B-P291B 0.491000256445326 L38A-D77A 0.486324932014263 M78A-T247A 0.481197705962473 L355B-V372B 0.47802309655963 V348B-A382B 0.47439417728479 D231A-F309A 0.473951475974216 M358B-S367B 0.469909821423869 Q346B-Y380B 0.463713307859507 Q181C-Q325A 0.463398065287068 E180C-P191C 0.458773659447706 F362B-D371B 0.45719785677919 L44A-A67A 0.453794737825399 S367B-V372B 0.451436472722009 V323A-R328A 0.445066908117652 Y48A-N63A 0.442218518091145 R234A-A305A 0.439377044861897 L38A-W81A 0.436581511314388 Q184C-V324A 0.43404100740061 D374B-L379B 0.432440497780517 Q73A-K80A 0.428434008414979 L182C-N188C 0.426696815218563 P291B-Q41A 0.424780815137089 S68A-S253A 0.4242997766694 T126C-A171C 0.423335063711832 L71A-S253A 0.422499207372452 A119C-L175C 0.422026774874961 A64A-S257A 0.419473468413007 D47A-A64A 0.418161808460885 Q73A-D249A 0.415035709065005 S222A-A319A 0.414676746702521 L250B-L286B 0.413439316643057 L250B-V284B 0.411844108687097 T72A-D249A 0.410648092648766 V116C-L182C 0.410274092545744 S66A-I256A 0.409201896455279 L286B-T49A 0.408935500442484 A46A-T65A 0.408189105426316 E180C-V324A 0.405977311312627 N416B-K421B 0.400810951023804 Q70A-T254A 0.39800640856561 V348B-L386B 0.397508533750735 Y344B-K383B 0.394623128199236 T49A-A64A 0.391355316616124 L223A-L316A 0.386566175364647 Q315A-H320A 0.384389864288303 A351B-L379B 0.384293419314757 I237A-Q306A 0.384151019745877 A233A-A305A 0.380657324379444 L223A-H320A 0.378907117579628 A34A-A90A 0.378456150532131 V348B-Y380B 0.374640818287618 T65A-T259A 0.373509687005702 A34A-A91A 0.369045712248443 V198B-L419B 0.368715433280773 P291B-L44A 0.368601793836146 L42A-L69A 0.365967111548257 G45A-Q70A 0.362655586962116 A112C-A178C 0.361199072107294 K345B-N388B 0.359473813342819 A67A-S257A 0.358445423227395 Q184C-H320A 0.358108820041813 A67A-I256A 0.357466800655979 Y113C-G187C 0.355086716769835 A83A-A240A 0.355049588663108 N200B-K421B 0.351709438172824 V116C-V179C 0.351285471196004 I237A-N308A 0.350699991902225 D176C-R183C 0.349946273335129 Q70A-T251A 0.348412404871132 F309A-E317A 0.340558932094819 Q225A-E317A 0.336854033882028 D121C-R172C 0.336749107628095 K401B-A414B 0.331001609379716 S287B-G45A 0.330594847148682 N200B-A418B 0.329836091195478 A90A-L232A 0.325569873272713 K345B-E385B 0.32457882389051 N115C-R172C 0.322841412538484 L69A-T254A 0.321982314611684 Y113C-L182C 0.321277807472104 R227A-L232A 0.318825566982766 L42A-L71A 0.317963848360205 K345B-R390B 0.31732251765887 Y48A-D258A 0.31468239786909 R35A-A83A 0.313712283791975 E359B-L373B 0.313628006079664 T251B-T49A 0.313293344970608 L250B-S287B 0.310921594024453 E33A-T85A 0.308996432901151 A83A-Q239A 0.308749364431055 S62A-T259A 0.308256141257174 A91A-S229A 0.308245136931942 Y189C-R328A 0.308159159541825 A119C-D176C 0.308117616228787 E359B-I369B 0.307991566638782 L223A-E317A 0.307571742432945 I237A-F309A 0.306386498079562 H320A-Q325A 0.304614371819585 P291B-S68A 0.30385822212697 L355B-L379B 0.300939434484065 G285B-S66A 0.299590494898682 N115C-R183C 0.298841851182408 G243B-S289B 0.29816973958186 S74A-L250A 0.298109820262043 Q352B-A375B 0.29752363512067 T186C-E317A 0.297182915906256 S229A-A319A 0.296806187932486 L196B-A418B 0.296361422619983 L355B-A375B 0.295427770754238 A112C-I185C 0.295228661322555 L196B-Y391B 0.29433442103719 P37A-T85A 0.291283744504547 P37A-S74A 0.290858756833763 L316A-R321A 0.289887156604739 L38A-K80A 0.288617385460945 R227A-E317A 0.288431516636486 G361B-A375B 0.287879182632859 R82A-E88A 0.287850153060476 R35A-E88A 0.28731893729971 G285B-S62A 0.285572211264639 T49A-T259A 0.284076264541193 A226A-L316A 0.283854711878926 Q306A-E314A 0.282006678860809 L196B-R390B 0.281905918064295 E317A-Q325A 0.281402467737691 Q346B-E385B 0.281211217352608 A347B-L379B 0.281079059643675 K345B-Q352B 0.280077231110281 Y125C-K130C 0.278767514116093 S62A-Y261A 0.277121039057296 S74A-P246A 0.276259140390286 D356B-V364B 0.276029584362461 N174C-R328A 0.275997742264691 A119C-A178C 0.275705496063081 L69A-A252A 0.275640381250065 P37A-T247A 0.274560685827475 S353B-K383B 0.274249676936685 L355B-D374B 0.272658271554488 D231A-R238A 0.271809922024775 H244B-I292B 0.268382067621317 L223A-V323A 0.267708644622867 L123C-L175C 0.266431687122206 D176C-V324A 0.265986715668429 S229A-N308A 0.263293925872383 S222A-V323A 0.262192279936272 R82A-K89A 0.261518818771715 P291B-P37A 0.261188559230112 L223A-S318A 0.26063788917419 Q239A-P246A 0.259788350492275 N200B-R390B 0.259625091822988 V122C-E168C 0.259413013675079 A119C-A171C 0.259238157927941 D231A-V310A 0.25694815492967 S289B-G43A 0.255956378765959 Q230A-S318A 0.254623605418399 D176C-Y190C 0.254346562754665 E168C-N177C 0.25324257892736 I75A-T247A 0.252707620041595 K202B-A387B 0.251988066671056 K345B-S353B 0.25105879097053 Q346B-S354B 0.250797053023182 A347B-Q352B 0.250426664912877 Q127C-Q136C 0.248346869715943 A64A-S262A 0.246784427482923 Y50A-D258A 0.246540658187753 Q410B-N416B 0.246016171568633 T376B-Q384B 0.245938773630472 Y113C-P191C 0.245279857770513 L71A-G255A 0.244935443867649 L71A-A252A 0.244067425412208 A195B-R390B 0.242813324921861 V198B-Y393B 0.242291867185031 A194B-L419B 0.242229608972456 A226A-A312A 0.241276082601056 N177C-R328A 0.239954015871081 N63A-S257A 0.238524653686923 D231A-A312A 0.238392321939495 Q225A-S318A 0.235085705315281 Q230A-Q239A 0.234527588393385 A178C-R328A 0.233047940637482 D77A-G243A 0.231604980241147 T72A-T247A 0.23138009930964 G45A-L69A 0.231287995840074 P246B-L42A 0.229523880298589 E359B-V372B 0.229175539024729 S74A-L248A 0.228682887770902 N408B-L413B 0.228409990761501 Q87A-Q230A 0.227711636384149 E33A-Q41A 0.225459677993118 G361B-T368B 0.225147812013732 L196B-S420B 0.224735922356881 Q73A-T251A 0.223961330598934 K202B-Y391B 0.22392646362969 Q127C-N167C 0.223814417041134 Q410B-L415B 0.223567739502295 L394B-N399B 0.22351109696292 A233A-Q306A 0.222476759187086 A112C-L182C 0.22222177563683 A226A-S322A 0.222148397374138 K202B-A389B 0.222118369007744 K89A-A226A 0.220814942720921 G45A-L71A 0.220589238926746 Y380B-E385B 0.218620661117378 K202B-R390B 0.218390820662082 Q236A-G311A 0.217508330736995 V284B-D47A 0.215413250448316 E180C-R321A 0.215311335031046 T377B-E385B 0.214854233743483 T111C-Q184C 0.214188101898654 S289B-S253A 0.213896231133776 K89A-L232A 0.213053134445882 Q306A-Q315A 0.212066676058203 Q239A-F309A 0.211155583700626 R35A-M78A 0.21007921288253 R238A-N308A 0.209495764227981 Y113C-L193C 0.209380827988292 T65A-I256A 0.207371112927561 G361B-V370B 0.206666875903135 K89A-E235A 0.206643901878193 L42A-T72A 0.206422670876217 L355B-D371B 0.206144896771171 V122C-R172C 0.205883439945458 D204B-D411B 0.205747055581349 E88A-Q236A 0.205717386079064 L44A-Q70A 0.205148888893556 Q87A-E235A 0.20475526704613 V284B-T49A 0.204620499380766 T247B-L290B 0.204367593347698 L245B-G43A 0.203066025694623 E359B-V364B 0.202654129183669 G187C-S322A 0.202566681434307 L69A-S253A 0.202196147364255 E180C-R328A 0.201395988850795 A83A-D242A 0.200357514120993 G361B-I369B 0.200229630549475 S229A-V310A 0.199084013064097 L290B-G45A 0.1976009840095 L394B-L415B 0.197192170786498 A351B-E385B 0.197172391768611 A46A-D258A 0.195917937008097 L196B-N417B 0.195021895556001 Q384B-A389B 0.194860185523265 T85A-D231A 0.194693511509374 L355B-N381B 0.193756230704512 F362B-A375B 0.193577626811524 L398B-N416B 0.192598979378191 Q241A-P246A 0.191942840054706 F114C-E192C 0.191914932717337 N308A-E317A 0.191390631529825 D47A-T259A 0.190061750734943 V364B-D371B 0.189769167488612 E33A-A91A 0.188608825119775 Q346B-T378B 0.188487427011693 T49A-T65A 0.187705532228595 L123C-N174C 0.187390440110614 A351B-E359B 0.18700364202399 F114C-N174C 0.186579079326657 A360B-T376B 0.186551434022131 A360B-D371B 0.186530624105967 L248B-S289B 0.186456005108483 K345B-Y380B 0.186321289160641 Q397B-G405B 0.186100617127963 Y344B-A382B 0.185710981232171 G43A-Q73A 0.185676370107949 K80A-E88A 0.1855603008458 M78A-Q236A 0.185297832474653 Y391B-N399B 0.185177450695582 N392B-S402B 0.185169972992209 T247B-D47A 0.185070472220006 A226A-D231A 0.184928367415631 S313A-S322A 0.184574630327728 N115C-Q181C 0.184352602135558 K345B-N381B 0.184321405945694 N197B-K202B 0.183803794992957 N115C-D121C 0.18369812909495 Q230A-N308A 0.183098930276459 Q129C-N167C 0.182667746822793 W81A-R238A 0.182274965778398 Y113C-N177C 0.182118114859641 P37A-G43A 0.181981959494191 F288B-T65A 0.18140815905718 N115C-I120C 0.180344155495519 F114C-N177C 0.179407438733186 S313A-H320A 0.179295662227639 Y344B-Y393B 0.178385191685069 Q236A-G243A 0.178342759761108 L117C-L193C 0.17811196047007 T203B-A387B 0.178005101440031 L245B-G45A 0.17781770671264 E385B-Y393B 0.177084493541244 T203B-N392B 0.177009760546019 K401B-Q410B 0.176755117621829 Y344B-Y391B 0.176696678712523 N118C-L182C 0.176371713131468 D249B-A46A 0.176139656889508 A351B-A375B 0.175235936169267 N118C-E180C 0.175154319131543 R82A-Q236A 0.175111844262458 T65A-T254A 0.17472629303691 R390B-A418B 0.174481780666485 Y50A-A64A 0.173832222290529 S363B-L373B 0.173145243120781 K80A-Q236A 0.172969010211343 K80A-E235A 0.172798657863544 R183C-Y190C 0.172662539198396 A195B-L419B 0.172581157346011 R82A-Q87A 0.172309720599064 Y344B-A389B 0.17213190863964 L169C-N174C 0.171918160773438 D249B-T49A 0.171538235440317 L182C-G187C 0.171535223678957 D176C-V327A 0.170705036419612 A178C-Y190C 0.170436804645737 Q73A-S253A 0.170362288543911 A240A-A305A 0.17029029833789 S367B-A375B 0.170216159017416 R183C-V323A 0.169981628177752 S353B-Y380B 0.169600733835462 K130C-T170C 0.167946904303242 T72A-L248A 0.167823048998505 L224A-S313A 0.167108274721313 E180C-Y189C 0.166375550272095 Y48A-G255A 0.165821471651759 A178C-I185C 0.165820611686558 N118C-L175C 0.164254355495049 R321A-S329A 0.16421476924417 F288B-T49A 0.164114444681975 Q129C-Y134C 0.164006528681858 R234A-F309A 0.162869788638183 A171C-V179C 0.162779703970353 A351B-G361B 0.161636831452177 P40A-S253A 0.161277808736119 A46A-S253A 0.161238863432168 A226A-R321A 0.160937163945948 A226A-F309A 0.160584724811815 F114C-Y190C 0.160154762608789 S289B-A46A 0.159905340300787 D356B-T378B 0.159710142155968 S350B-L386B 0.158928770695158 E409B-A414B 0.15792861513077 N174C-L182C 0.15774656089588 S354B-K383B 0.157323453686707 F201B-K345B 0.157274091604211 A312A-E317A 0.157201912950121 S287B-S257A 0.156925350620929 K89A-Q225A 0.156092240618589 T203B-N396B 0.155745076663673 Q73A-L248A 0.155382305198696 D204B-N399B 0.154830646916683 L232A-G311A 0.154646420599013 L39A-Q73A 0.154515167311397 D121C-N177C 0.154450668590826 V116C-D176C 0.154305328144188 L71A-T254A 0.154185117840865 G43A-L71A 0.154033413778151 R35A-K89A 0.153870954127936 R234A-Q239A 0.153538021516673 R183C-P191C 0.15305950622475 S350B-L379B 0.152833414035916 D204B-N417B 0.15269119450736 T247B-S287B 0.152427256907936 N177C-Q325A 0.152324384679173 F288B-L44A 0.152203804277796 Q181C-N188C 0.152118943121444 E235A-A240A 0.151928834468058 R238A-Y307A 0.151796456716904 L86A-Q239A 0.151394763963034 K345B-T378B 0.150621402955956 L69A-G255A 0.150614854011272 I395B-A418B 0.150022052512525 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