[Thu Aug 25 00:08:21 2016] >Input file: TM3PL9CGG.pdb >TM segments: A10-23_A55-71_A105-131 MAIDEN score = -3.6224 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 ----------- ---------------- L122A-Q127A 0.875833188911091 T20A-F121A 0.808697689539724 K112A-A117A 0.804683112868956 M17A-A114A 0.68410521998025 W15A-A117A 0.66019688735648 R14A-I111A 0.580815690625423 S56A-I61A 0.5703409492281 V65A-Y70A 0.5119206522377 A16A-F121A 0.505457974027093 W62A-V67A 0.478658301410165 L10A-I111A 0.47748664109772 W15A-A114A 0.455427494344789 F55A-L60A 0.438309304571604 T20A-A117A 0.433765851949367 G13A-I111A 0.411823624065137 H12A-A114A 0.408914661668182 L10A-A114A 0.390582499759132 I105A-E110A 0.365511562693246 I63A-I68A 0.353382734941105 A19A-F121A 0.350724542363126 M57A-V67A 0.336433635386711 L10A-R115A 0.33296953785884 Q107A-H113A 0.332734862690207 L10A-W15A 0.321826304845668 G13A-A109A 0.319914849930626 A16A-L116A 0.316216593519188 G13A-H113A 0.312137192893663 A19A-A114A 0.311848257304653 G22A-A117A 0.308679703658679 A23A-A125A 0.304300729160444 A16A-R115A 0.303050887567978 L18A-A23A 0.300267780247989 G13A-M118A 0.300214526097417 A23A-G123A 0.29417553719728 T20A-G120A 0.293035057706893 I11A-A16A 0.292310738357926 A16A-G123A 0.292262455004983 M17A-A117A 0.290220938099968 E110A-L116A 0.286944034616669 I11A-A114A 0.281017086771199 H12A-R115A 0.26729411831881 A19A-A125A 0.260119007112189 A16A-V119A 0.258627926657883 G13A-R115A 0.255763204981624 R14A-H113A 0.254989960015382 A19A-G123A 0.247361758871779 A16A-A117A 0.243176189532133 G13A-Q107A 0.239651134026676 F55A-E64A 0.231883501136678 R115A-G120A 0.230340233403745 M118A-F124A 0.21902514245771 W15A-G120A 0.201461293701761 A117A-L122A 0.200060064519674 R14A-A19A 0.19847372988113 R14A-A117A 0.198175208708438 R14A-K112A 0.197999399262219 Q107A-K112A 0.194393770595104 I63A-G69A 0.19101131655122 I61A-L66A 0.190285724480024 H12A-T20A 0.182718678824327 M17A-G123A 0.176797525082588 G22A-M118A 0.167796988730465 G13A-A23A 0.166997851470778 T59A-I68A 0.16563560158425 A16A-I111A 0.165600839320741 I111A-L116A 0.164331247613464 G22A-A114A 0.161636831452177 G13A-A117A 0.161486699141214 I61A-G69A 0.14750076776229 T58A-I63A 0.145735596233869 I61A-Y70A 0.142706039451624 G22A-F121A 0.139843482480705 A16A-G120A 0.139345243028954 R14A-A109A 0.137561481132233 A16A-M118A 0.134955212955473 T20A-H113A 0.131623977247026 F121A-V126A 0.130539146059701 A16A-A114A 0.129608835988113 K112A-G120A 0.128764410668928 W15A-L21A 0.12753946161697 I11A-Q107A 0.124923222150348 G22A-F124A 0.122771810028144 A19A-L116A 0.116902713801236 W15A-A23A 0.11343023797237 L10A-L106A 0.113080461558087 A23A-Q127A 0.112686681339514 I11A-K112A 0.111848432735099 A16A-L21A 0.111239619553077 T59A-V67A 0.110469288458119 A19A-R115A 0.106789606753157 L21A-L122A 0.106605426166161 L18A-L122A 0.105631271502542 T20A-A114A 0.102328102064979 T59A-G69A 0.101753679784165 H12A-M17A 0.101531622357782 I61A-V67A 0.100953574846959 L21A-A114A 0.0977394065163338 T20A-A125A 0.0968685763686802 G123A-T131A 0.0944603576689973 H113A-M118A 0.0927913939028224 A16A-F124A 0.0900336374594612 L66A-I71A 0.0895072561001622 G13A-G123A 0.0888206961962883 G22A-G120A 0.0880674081448021 G13A-L116A 0.0876843898089206 L21A-V119A 0.0863054502858978 I111A-A117A 0.0861021638008936 M17A-F121A 0.0833637664404598 F121A-Q127A 0.0829285811242437 T20A-R115A 0.0828354282228754 A23A-G120A 0.0808253584158232 A16A-A125A 0.0805852238433533 I11A-H113A 0.0791943179080707 M17A-A109A 0.0772136156017557 F55A-W62A 0.0768152167002683 L10A-V119A 0.0744785763219117 R14A-E110A 0.0737419541433368 V119A-F124A 0.0732503181852495 L18A-E110A 0.0705510087954282 A23A-A117A 0.0681838252475266 F121A-T131A 0.0672807411596794 I11A-F121A 0.0657060183009071 L10A-A19A 0.0656695027230845 R14A-V119A 0.0628944498598458 E64A-G69A 0.0595587451351663 H113A-G123A 0.0590361719954815 L116A-F121A 0.0569133406181805 L10A-L108A 0.056436457004013 R14A-L108A 0.0564042589254616 H12A-G123A 0.055239856432358 L106A-I111A 0.054815351312123 R14A-Q107A 0.0540073860647166 M17A-L108A 0.0528553162469458 H12A-M118A 0.0525719266115821 L10A-A109A 0.0523374644200605 I105A-H113A 0.0523332084850239 M17A-H113A 0.050845475072723 I61A-I71A 0.0490724406961665 W15A-K112A 0.0485629457022794 L108A-A117A 0.0481322772581936 A23A-M118A 0.0468000465776859 T20A-M118A 0.0455873210906191 T20A-Q127A 0.0450475167414854 L21A-G123A 0.0431071415877984 A19A-A128A 0.0427872931021658 A19A-H113A 0.0421555291693152 T20A-K112A 0.0398675876649514 G22A-L122A 0.0396871035305941 A23A-A128A 0.0387413961857965 A19A-V126A 0.0370581873179097 G13A-L21A 0.0370321123140234 L18A-H113A 0.0367771052607289 V65A-I71A 0.0358952331137736 W15A-I111A 0.0357341304435987 H12A-G22A 0.0352138728347364 A19A-V119A 0.0348362584675233 M17A-E110A 0.0328834256106394 H12A-V119A 0.0274580853024444 H12A-L122A 0.0272316842125584 H12A-E110A 0.0258795506271143 R115A-G123A 0.0250075255662265 L18A-I111A 0.0239846241493051 R14A-R115A 0.0239750291901457 M57A-E64A 0.02383930368686 Q107A-L116A 0.0227913071535824 A16A-A109A 0.0210733368892395 G13A-G22A 0.0207396720405482 L10A-G120A 0.0203094900156031 G22A-A125A 0.0166992454040241 L18A-G120A 0.0153373043053868 G22A-G123A 0.0148660565383911 G120A-A129A 0.0141892677543534 W15A-R115A 0.0136937970746418 G13A-T20A 0.0135600272609995 L21A-H113A 0.0131991144843958 R14A-G120A 0.0124507333477615 A117A-A125A 0.0117883224732284 A109A-A117A 0.0117876252276463 I11A-I71A 0.0116989658479962 V126A-T131A 0.0102870402824493 H113A-V119A 0.0102699253220369 G13A-F124A 0.00999908764674196 Q107A-A117A 0.00981294019146861 A23A-L116A 0.00885895922215241 A117A-Q127A 0.00818079857954879 A114A-G123A 0.0081558943229818 H12A-L108A 0.00785676368970556 W15A-V119A 0.00777490376223078 L10A-E110A 0.00686855959859489 I11A-A19A 0.00570534424824043 E64A-Y70A 0.00371992515135044 H12A-G120A 0.00351253615914104 T20A-A128A 0.00313881316367359 A19A-Q127A 0.00298877540409981 L106A-A114A 0.0021062652329551 L18A-L116A -0.000921382037309293 L21A-A125A -0.00153363389962635 L116A-A125A -0.00249966966071113 M17A-G120A -0.0031301435042459 T20A-G123A -0.00346964733034483 R14A-F121A -0.00360429746593671 S56A-L66A -0.0046736646308323 K112A-M118A -0.00488284111084436 W62A-I71A -0.00635545113253588 E110A-R115A -0.00731726924931131 G13A-L108A -0.00803943516784322 V119A-Q127A -0.00884055969335273 G22A-L116A -0.00892386443149107 L18A-A125A -0.00970351753250576 L18A-F124A -0.00990583147824564 A23A-F124A -0.0100998676677251 G13A-G120A -0.0101952728763752 A114A-L122A -0.0103110521683671 G13A-L122A -0.011131046952515 G120A-A128A -0.011241123861808 H12A-A109A -0.0125538539963168 L108A-H113A -0.0145214320427307 I105A-A114A -0.0165044200648726 A23A-V126A -0.0202968727116701 R14A-G22A -0.0211233052827151 M118A-V126A -0.0223366672235623 H12A-F121A -0.02233715273807 M57A-L66A -0.0235515845410372 T58A-V67A -0.0243491474004274 L10A-L116A -0.0251094552037489 E110A-G120A -0.0255540802564744 L60A-G69A -0.0268581728487676 A23A-V119A -0.0274130046832226 A19A-M118A -0.0286723349344151 I11A-V119A -0.0289675138387953 M57A-V65A -0.0310621997072458 L10A-A16A -0.0339016485872872 L108A-A114A -0.03595644483955 I11A-M17A -0.0367339536436759 G123A-A128A -0.0388396319570337 A19A-A117A -0.0403706478331882 M17A-Q107A -0.0404597287952784 M17A-F124A -0.0407675336178368 S56A-E64A -0.0415588581863071 L10A-F121A -0.0425700305653702 I11A-T20A -0.0428790031068746 T20A-V126A -0.0433816744254414 W15A-F124A -0.0445809457538884 M17A-A125A -0.0456131852966113 T58A-I68A -0.0456798257163 I111A-G120A -0.0459518112180586 I11A-A109A -0.0460425814179981 G13A-L106A -0.0500240783532506 T20A-F124A -0.0507453137009035 V119A-A128A -0.0514981804779389 L108A-L116A -0.0538563198876378 A117A-V126A -0.0547766391932258 I11A-A117A -0.0551757043998169 W15A-A109A -0.0567962064282599 L21A-M118A -0.056906569636638 L122A-T131A -0.0580651817127116 A109A-A114A -0.0609119340983373 W15A-A125A -0.0611591877832911 S56A-V65A -0.0630491952821646 R14A-T20A -0.0635445765703535 A109A-M118A -0.0636471597720386 G22A-V119A -0.0637122207826133 I11A-L108A -0.0676548562276498 L122A-A129A -0.0687998025037828 S56A-W62A -0.0699982289900065 L116A-L122A -0.0704387201843701 M118A-G123A -0.0717886128209946 Q107A-R115A -0.0724809826523982 M57A-W62A -0.074612838356493 L21A-A117A -0.0758349755530956 T58A-L66A -0.0767238330159081 W62A-G69A -0.0809006204858811 W15A-T20A -0.0813866154805291 L10A-H113A -0.0821924641031337 E110A-M118A -0.0826625646844548 R115A-F121A -0.0840510086987223 W15A-M118A -0.0880475140524775 F121A-A129A -0.0889017118570807 I11A-L18A -0.0889578307917653 L106A-K112A -0.0891630327013688 L60A-I68A -0.0911722530280449 M17A-G22A -0.09350339664753 A19A-L122A -0.0951100924473787 G120A-Q127A -0.0957174704470605 W15A-G123A -0.097779816287078 A23A-L122A -0.0980465440658849 M17A-L122A -0.10005936948014 A19A-K112A -0.100829267992132 L18A-G123A -0.104435061386969 I11A-G120A -0.106956633544197 R115A-F124A -0.107155441776186 H12A-A19A -0.109722564044318 L18A-A117A -0.11155809764154 M17A-I111A -0.11278927797642 L21A-F124A -0.114123474830273 F55A-I63A -0.114692345431679 A114A-F121A -0.115687105331688 I11A-L116A -0.116840565700009 L18A-V119A -0.118833207300755 G123A-V130A -0.121939076384914 G13A-A19A -0.122024815733578 I105A-I111A -0.122605353843387 L106A-R115A -0.124434867903464 H12A-L18A -0.126292267926933 L21A-G120A -0.128733644683841 L122A-V130A -0.129055886619863 T58A-E64A -0.132823286830641 L18A-R115A -0.136378772619683 R14A-L21A -0.137833727976567 L60A-V65A -0.137870319656297 V119A-A125A -0.138262032162199 L21A-F121A -0.138784423461938 W62A-Y70A -0.139416107030973 H113A-F121A -0.139564806709582 L122A-A128A -0.140314618590525 F121A-V130A -0.140612142800751 L18A-F121A -0.143308457563575 G13A-L18A -0.144235093982482 G13A-F121A -0.145293477341531 G120A-A125A -0.145696695517478 R14A-M118A -0.148376476329142 L116A-F124A -0.148726126784193 M17A-R115A -0.149303830960263 W15A-L116A -0.149898650523873 A16A-E110A -0.150433554690486 W15A-I68A -0.152725470946327 A19A-F124A -0.152784529097318 A117A-F124A -0.152981843656272 A16A-L122A -0.153230988503106 G120A-V126A -0.153443908342982 L21A-R115A -0.155025381851048 I11A-I68A -0.157030830341694 L10A-K112A -0.159114097909336 T59A-E64A -0.159943601731918 L21A-L116A -0.161155424955368 E110A-A117A -0.162386066569122 A19A-G120A -0.162626640045852 R14A-L122A -0.164267189462402 R14A-L106A -0.165944496678783 L18A-A114A -0.166015825217248 M17A-K112A -0.166961101314846 L116A-G123A -0.16862697872889 W15A-G22A -0.169552378646133 H12A-K112A -0.171696349543331 T20A-V119A -0.174001169649782 W62A-I68A -0.178318984899459 M118A-Q127A -0.178548413216597 R115A-L122A -0.180629868753251 F121A-A128A -0.182629365123136 W15A-E110A -0.18300192524835 T59A-V65A -0.183713331610151 R14A-A23A -0.183836335948321 L60A-V67A -0.184127665298336 E110A-V119A -0.184620948392526 I63A-Y70A -0.186025585804191 L18A-K112A -0.187224492965408 L10A-L18A -0.187946804549947 A109A-R115A -0.189079469031823 I11A-E110A -0.191157636250933 E64A-I71A -0.194933484216584 L108A-R115A -0.19667587200993 M17A-L116A -0.198400722710952 A16A-A23A -0.199770766840056 I111A-V119A -0.20122527242199 M118A-A125A -0.202903589266486 H113A-G120A -0.203432815651028 G13A-V119A -0.205170076143709 A117A-G123A -0.206430393275532 Q107A-A114A -0.207768942514929 M17A-M118A -0.208425959190232 I63A-I71A -0.209248426039407 G13A-E110A -0.210476397830496 F124A-V130A -0.215746049173822 A16A-G22A -0.217446610878262 M57A-I63A -0.219060381043484 L106A-H113A -0.221651868393194 A125A-T131A -0.222356171923357 L10A-Q107A -0.223233493429155 T20A-L116A -0.22402564813754 T20A-L122A -0.229742030790976 I11A-R115A -0.237362111413587 H12A-L116A -0.243472672833279 K112A-V119A -0.243769693821154 A109A-L116A -0.246255243837599 G123A-A129A -0.251187173007001 H113A-L122A -0.254256949705854 F55A-I61A -0.254399838619886 R14A-L116A -0.257097743462513 H12A-L21A -0.257121580987204 S56A-I63A -0.263083980534163 L60A-L66A -0.26508551513054 W15A-L122A -0.26680243469227 T58A-V65A -0.266923596710687 A114A-G120A -0.270102969517036 G13A-K112A -0.271038019165132 L10A-A117A -0.271148396085078 A23A-F121A -0.272996426174211 R14A-A114A -0.276877118524329 V119A-V126A -0.282494646124503 L10A-M17A -0.283729766653699 L18A-M118A -0.283736074054749 T59A-L66A -0.285906885765356 K112A-F121A -0.302409693403828 M17A-V119A -0.304935387809061 L10A-M118A -0.305605199570242 I105A-K112A -0.328353237724563 I111A-M118A -0.338334627701221 W15A-H113A -0.352398385246324 A16A-K112A -0.354659326531121 A125A-V130A -0.35614267045575 I11A-M118A -0.358718411268212 A16A-H113A -0.362366472402571 I61A-I68A -0.368901502081973 A114A-V119A -0.370283829547796 I11A-I111A -0.377077242943757 W15A-F121A -0.395192727002423 F124A-A129A -0.395934152501322 M17A-A23A -0.402000064562616 H12A-A117A -0.412069326514491 H12A-Q107A -0.417695056454326 F124A-T131A -0.42296879386102 H12A-I111A -0.515018128167732 G13A-A114A -0.560192858939001 H12A-H113A -0.750840791182983