[Wed Aug 24 18:19:10 2016] >Input file: TM3KDPATD.pdb >TM segments: A86-110_A120-140_A284-305_A310-333_A766-788_A793-815_A838-862_A912-933_A935-968_A980-1002_B28-53_G28-47 MAIDEN score = -89.2670 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 ----------- ---------------- T774A-A846A 10 K767A-C930A 10 V922A-S988A 2.33030700671797 K767A-K931A 2.00778709900879 M845A-I850A 1.57225773738623 I946A-L45G 1.23034543219411 L89A-I134A 1.22347357463038 I850A-I991A 1.20416188253114 I853A-I991A 1.20012105811549 I320A-I780A 1.15142742509648 Y771A-C930A 1.06446757072879 I777A-Q854A 1.06143541773356 I929A-E996A 1.00961863164223 L96A-I321A 0.970717834548198 I777A-M852A 0.958049633778749 W98A-V133A 0.950177620071577 V922A-F985A 0.944757419754872 A323A-I780A 0.917176689690514 L795A-H912A 0.89440623678124 I853A-Y987A 0.891058406396684 F952A-V40G 0.890998656446194 L961A-M967A 0.885847974516978 V921A-F985A 0.863507762934604 Q854A-I991A 0.849335829753484 D808A-V920A 0.842311781514947 T918A-A984A 0.822165909966795 E327A-D804A 0.811383518357966 L103A-I318A 0.81025185910257 P782A-P794A 0.804915215123923 L329A-I769A 0.772745384207298 W32B-L37B 0.768090521801676 L329A-D804A 0.765849484424709 S814A-L947A 0.757375352097341 P326A-L773A 0.756368134965273 P782A-L793A 0.754656690549817 V937A-E996A 0.750266300092546 V810A-E953A 0.74892727014254 V132A-E327A 0.742612152871788 C964A-L31G 0.741024535603132 F93A-V325A 0.740684801986818 E779A-I800A 0.736025864775105 L97A-V322A 0.735614585661316 L96A-V325A 0.735395076794157 L89A-V133A 0.732465208431361 F786A-L793A 0.731815564787015 P811A-L927A 0.725639380174345 T861A-F915A 0.719628639960566 L97A-V325A 0.719569783995808 T861A-T918A 0.706504208026435 V322A-E327A 0.698408801072716 F105A-L123A 0.695174856219177 L97A-L129A 0.690165236948077 L856A-F50B 0.687853108507002 L795A-F915A 0.687355662485865 V322A-T797A 0.686521568896449 F949A-G41G 0.682654813584851 T807A-V920A 0.6821916496866 E327A-L801A 0.676229553409181 T799A-F916A 0.674441352777821 L97A-V133A 0.67361013688415 F952A-F38G 0.67178107018291 I929A-F992A 0.667329711759569 I843A-G848A 0.666910214633765 L773A-Y847A 0.666460503896423 C802A-F916A 0.664225492876411 T289A-V325A 0.660472673713162 I850A-D926A 0.657957303760371 L815A-L947A 0.657727733929344 F284A-V838A 0.654920368375822 F949A-L45G 0.641647829258106 F960A-A34G 0.627357993903315 F960A-G30G 0.627324614165258 F960A-L31G 0.620824690588375 T918A-F985A 0.619417139745003 L815A-C930A 0.618560881513337 A956A-F38G 0.617024184704157 K766A-V838A 0.615747379199385 L856A-Y987A 0.615034084165339 A959A-L31G 0.613559921993089 F300A-A313A 0.608842804178193 V917A-W981A 0.608637436892776 D808A-E954A 0.608397831981581 F860A-C983A 0.603765655486097 E779A-A855A 0.598623242874995 C930A-D995A 0.593806562378616 S814A-G950A 0.592888422739716 C104A-L123A 0.591505531940459 T932A-V937A 0.588933304110136 S140A-L330A 0.583854250662359 V291A-N324A 0.579857601831566 F90A-M95A 0.578507799105427 F93A-I285A 0.57175336595099 A956A-F33G 0.570613028260886 K767A-A812A 0.567964708356328 F860A-A984A 0.566873960072551 P811A-L951A 0.56118983036805 S936A-L1000A 0.560789327151801 P811A-L947A 0.55777632815605 L97A-S130A 0.555572989787602 W98A-L129A 0.545720548117913 A101A-V128A 0.54454132495233 C104A-L125A 0.54276326145653 P794A-H912A 0.541898412054991 F859A-F915A 0.541032797877817 F949A-L42G 0.527995352862688 Q854A-I919A 0.52766788763167 Y771A-L927A 0.526619751396099 F300A-L317A 0.519766654488405 S768A-S814A 0.516707164060154 P794A-F915A 0.51329740568262 V917A-A958A 0.511917679207617 W924A-L951A 0.511713519450657 Y862A-F915A 0.511381976411588 F299A-L784A 0.511375802795149 A101A-V127A 0.504027422519944 F316A-F783A 0.498654561002117 S775A-G851A 0.486712215119925 L795A-F916A 0.484352138744453 Y963A-L31G 0.482804111701478 I288A-N324A 0.481322715186407 A107A-N122A 0.479944431277603 L125A-V798A 0.478435106506868 L304A-A313A 0.478261644664402 S775A-I803A 0.476931540966838 V920A-A958A 0.475574025577352 Q854A-Y862A 0.474495451004189 V322A-I800A 0.474179209907007 F783A-L795A 0.472796477096506 K766A-C930A 0.471773595608704 L795A-I800A 0.471513183481882 V333A-S768A 0.471474305156338 F860A-F50B 0.468940589257915 P778A-G851A 0.468129748763428 L97A-I321A 0.467738769689992 T774A-M845A 0.465388559653942 P782A-L795A 0.464709767280345 C104A-I315A 0.464580776648797 I110A-L311A 0.464255293165059 V921A-T955A 0.462540860783132 I777A-A855A 0.462386012343201 L311A-F316A 0.462321082464683 L990A-D995A 0.460654951244599 P778A-I919A 0.46032019763274 I853A-L46B 0.46004874338409 I777A-Y847A 0.459219398405681 V291A-G296A 0.459054325860832 T799A-H912A 0.458953462006515 G100A-V322A 0.458665045536919 L103A-V314A 0.45800207270949 K931A-Q939A 0.454805198350554 A323A-T797A 0.454688300816935 I850A-D995A 0.454588984869853 Q923A-K931A 0.454002452767939 M942A-I948A 0.45367096780752 K766A-Q841A 0.453593136505424 L957A-A34G 0.452382397711606 I288A-V325A 0.449513974677954 V920A-T955A 0.446949642138099 Y108A-D121A 0.446644466689586 T781A-A855A 0.444266091196061 P778A-G858A 0.443695365955608 K767A-P811A 0.443523216051342 F93A-T289A 0.442064415764624 E779A-L795A 0.439902994880516 F949A-I44G 0.437754768707023 N122A-I315A 0.437406079074839 T955A-A34G 0.435053261069796 Q854A-Y987A 0.431350970101244 W924A-S988A 0.429906371657717 G92A-T289A 0.429199988629136 F783A-L793A 0.425445718396243 Y771A-A846A 0.424461320397538 N776A-Y847A 0.41641598718461 F93A-E327A 0.416312651474683 V928A-V937A 0.413505398266643 E779A-T918A 0.411182079985948 C104A-D121A 0.410488878620097 W98A-S130A 0.406653067045944 G328A-T772A 0.406533155136198 N324A-I777A 0.405325576232061 V297A-L302A 0.400467739841644 S814A-I946A 0.4001986382137 I946A-I44G 0.400053208735943 P794A-F859A 0.399523246035894 V293A-S298A 0.399247820423653 T913A-S962A 0.399006707539278 W924A-M942A 0.396984649718846 A925A-I991A 0.39630381879195 A292A-I321A 0.392976167279412 T861A-A984A 0.390237101511932 W98A-V132A 0.389971192482179 V921A-W981A 0.389893658620172 A770A-L842A 0.387561578571453 V322A-L801A 0.387355506852441 L96A-V322A 0.386690961290691 I948A-I44G 0.385614016688124 V838A-I843A 0.382892975323226 A812A-L927A 0.380138904803883 A958A-A35G 0.379264883147923 S962A-M967A 0.377418323315227 S775A-I919A 0.377390204945495 A958A-A37G 0.376226976976092 I948A-G41G 0.376147065245006 T799A-T913A 0.376126534007465 V810A-E954A 0.375772775968095 T332A-I813A 0.375541537723327 C930A-K943A 0.375098869541707 V922A-L989A 0.373150230929133 P811A-K931A 0.372258713918758 H912A-M967A 0.370749587026655 L97A-V132A 0.369477860894679 C964A-G29G 0.368128481906718 L329A-M809A 0.366836060899633 S775A-P811A 0.366144278068386 T332A-T772A 0.363767116475256 C104A-N122A 0.361606779066975 F93A-C138A 0.360224502821163 T772A-C802A 0.359581280817626 E327A-L805A 0.359190757344294 A925A-L989A 0.357797960187108 I102A-S130A 0.357104760363137 V40B-C45B 0.356670622860547 I102A-G126A 0.355606098808858 V917A-W980A 0.355436673277276 A101A-L125A 0.355435504793878 C45B-T53B 0.355348777227996 F300A-I305A 0.353379163735906 L89A-S94A 0.35236761229468 F90A-W98A 0.352065600086533 S94A-H286A 0.346675114489293 K34B-Y39B 0.346420547945809 L801A-G806A 0.345210066785043 Q940A-K999A 0.344257743178243 C104A-V314A 0.342271617260273 L304A-W310A 0.341145547589544 G857A-V922A 0.338488572142094 Q923A-S988A 0.337669573600384 F916A-A958A 0.337108058990182 I320A-F783A 0.336722125466107 Q940A-E996A 0.335733322071232 T332A-A812A 0.335067186246678 G319A-F783A 0.333347679700991 I803A-F916A 0.331714886870291 T772A-E779A 0.330265314023819 V291A-M845A 0.330134768490072 M845A-V40B 0.330021400648977 I318A-T797A 0.329516393735482 Q923A-E953A 0.329081546725024 Q88A-S140A 0.328187047167284 G100A-A292A 0.32783366118921 S775A-A846A 0.327573604614234 T807A-T955A 0.327106687816572 P326A-S768A 0.326836836406613 T807A-A958A 0.325464241381208 L96A-T289A 0.324930739723523 M845A-G851A 0.32456778220229 Y847A-M852A 0.323850331765266 P778A-L856A 0.323826476757793 I777A-C802A 0.32358075916614 L97A-E327A 0.323493315454686 G848A-A855A 0.322931648606284 M809A-V921A 0.321443485555179 C983A-I51B 0.321123058039866 T799A-T918A 0.320403147555672 I803A-M809A 0.320395414692172 T774A-D926A 0.319761620297818 E953A-A37G 0.319099480969947 Y771A-V921A 0.318839191470826 S844A-K34B 0.316727550984664 D808A-V921A 0.315807326881647 T136A-L330A 0.314876533090394 Y987A-G52B 0.314601573499127 V810A-L947A 0.314073115580464 G100A-L129A 0.31177269826609 V325A-Y847A 0.310123136399677 I800A-F916A 0.309816562085049 C138A-T332A 0.30973359536414 G858A-A984A 0.3087336012739 M809A-V928A 0.30732716734501 F299A-I787A 0.306694041578313 I803A-V920A 0.305351227981696 Q849A-Y987A 0.303353560066864 V325A-C802A 0.303220132492281 V132A-D804A 0.302719816663597 F300A-F316A 0.302296864916779 C802A-T955A 0.301905123630656 D121A-M967A 0.301073726926077 T289A-E327A 0.300298172057075 G851A-S988A 0.300175429843887 L856A-A47B 0.298980373036851 G328A-S775A 0.298495351033671 A812A-L947A 0.298177799384279 C802A-D808A 0.29780677088901 S775A-Q923A 0.29749807668692 Q854A-S988A 0.296448476937913 W981A-P986A 0.294964644278152 I929A-V937A 0.294317933340139 N324A-N776A 0.293881701048904 E840A-Q849A 0.293051488710179 C104A-I318A 0.29281103886469 S962A-G29G 0.292758630637999 T774A-P811A 0.291394136627911 G100A-L317A 0.290945818332563 V922A-I991A 0.290766804360854 V333A-I813A 0.290349173812622 K766A-Y771A 0.290074901773335 A323A-F783A 0.289935122095345 P326A-T797A 0.289703984604683 F284A-N839A 0.28944943707983 S962A-G968A 0.288917123786474 V133A-E327A 0.28810392475893 I853A-C930A 0.287625803499453 L842A-G851A 0.287067115727922 Q854A-A984A 0.286413799478122 R933A-E996A 0.285983585995353 L129A-G319A 0.285830168206449 W98A-T289A 0.285395400499711 S775A-A812A 0.284757160606709 A855A-F860A 0.284684518644697 F139A-L330A 0.284357765257385 N776A-G851A 0.283781218572549 G92A-E327A 0.282971927109529 I320A-L784A 0.282208491082288 V322A-V798A 0.281954451227895 L96A-A292A 0.281430283309043 K767A-S775A 0.281300211239775 T772A-D804A 0.280690693557377 Q923A-V928A 0.279340146418304 L96A-G319A 0.279217148797862 N122A-G796A 0.279159787505019 G91A-C138A 0.278369787886732 M852A-V993A 0.27784339237248 T772A-D808A 0.277748616135866 D804A-V917A 0.277115401841423 G109A-N120A 0.274660133475982 Y963A-N28G 0.274527569659121 G857A-I919A 0.273919503270861 S768A-C930A 0.273597974087002 V922A-D995A 0.273521553850133 S775A-Q854A 0.273396676955848 D808A-V928A 0.273271199535371 L103A-I315A 0.271365070447138 P778A-T797A 0.270830104417853 M852A-Q923A 0.270678451436778 L856A-G52B 0.270239340592363 L97A-G137A 0.269573986024234 E840A-G29B 0.269312186966307 F105A-N122A 0.268349930085316 A855A-A47B 0.266999251682374 G30B-L36B 0.265483379198316 K767A-T932A 0.26453833853461 Y124A-L129A 0.264144853303272 T913A-C983A 0.263809063734099 S962A-L31G 0.263618285948402 E953A-L42G 0.26274800224019 K767A-I929A 0.262378584372704 A292A-V325A 0.262375269659552 T774A-T781A 0.262146425950096 G328A-M809A 0.262094204402507 C930A-N944A 0.261968377195268 G796A-G858A 0.261200334284721 S130A-G137A 0.259909334064821 A770A-I843A 0.258614366719198 V293A-I321A 0.258486219887502 C802A-M809A 0.25841746313969 G92A-S140A 0.258364582439126 M809A-W924A 0.257647651122346 P778A-Q923A 0.257118562999507 Y771A-Q923A 0.257040416538533 V322A-E779A 0.256932592490082 T913A-C964A 0.256800991582905 C930A-V993A 0.25570009104577 C138A-E327A 0.254614932027335 G857A-G48B 0.253808754869222 G91A-E327A 0.253158068609657 T913A-T955A 0.253138029005909 F300A-G319A 0.252543436844784 C802A-E953A 0.251959161318231 Q854A-Y43B 0.250253770082827 P914A-Q923A 0.248936564642371 M845A-R933A 0.24862111941292 A956A-A35G 0.24821670200926 G858A-W981A 0.247820457636415 T774A-T918A 0.247038165469087 V128A-V798A 0.247036466978455 Q841A-T28B 0.247027513322072 N944A-S47G 0.246776780260984 Q854A-P914A 0.246644136127107 P794A-Y862A 0.246284107152171 G100A-A131A 0.246238131401502 L125A-G796A 0.244756627110479 A107A-I315A 0.244509287836678 T774A-T807A 0.244428515904735 E779A-P914A 0.243296703525099 N776A-G858A 0.243059049713913 H286A-E327A 0.24255372728346 L795A-T861A 0.242103901694299 G857A-F916A 0.241467275637693 N324A-S775A 0.241362541947275 P782A-T918A 0.241024340267717 G848A-F38B 0.24050664385171 T807A-L927A 0.239950218001968 M95A-H286A 0.239336275928478 V993A-R998A 0.239305277040761 T955A-L36G 0.238848412975752 N776A-C802A 0.238740305149402 G296A-I321A 0.238636956768437 L793A-T799A 0.238604626890803 F915A-Q923A 0.237772810606954 T772A-Q854A 0.237163164608861 I777A-G851A 0.235709879032052 G857A-G52B 0.235461302906954 Y108A-V128A 0.235307299697189 L106A-N122A 0.235092724253205 P914A-L961A 0.234322072532428 A101A-I318A 0.232939346651895 Q849A-Y43B 0.23281209586445 L295A-P782A 0.232600521969423 P778A-Q849A 0.232229436299888 W98A-G137A 0.232142771588993 Q841A-G29B 0.23192375443542 Y39B-C45B 0.231464465399303 N324A-G851A 0.230425716636424 P811A-F949A 0.229804950209783 Q849A-R933A 0.229651316410078 I800A-V920A 0.229575776250953 G858A-I919A 0.229377724862531 A855A-I919A 0.229275467133911 P778A-T861A 0.228946995611415 L125A-S130A 0.228549139272316 L795A-T918A 0.228203364655298 G857A-W981A 0.228194656593532 Y847A-F42B 0.228118697927747 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