[Mon Aug 29 17:54:03 2016] >Input file: TMW2T239M1G.pdb >TM segments: 90-102_ 116-131_ 164-178_ 210-226_ 251-283_ 321-335 MAIDEN score = -32.8969 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 ----------- ---------------- T174 -Y270 1.16106592510473 T169 -C215 1.08000818821882 F164 -V220 0.981646636943106 V171 -F265 0.973144522508368 L168 -E211 0.92850306158637 V171 -I266 0.82588988011453 I167 -V219 0.80720521186384 L274 -E279 0.756662383150978 I170 -T331 0.745079108881709 N96 -I122 0.717469491059458 F93 -L125 0.706666741953314 F178 -I273 0.670908897449596 A165 -V219 0.62055542737708 R177 -L327 0.614525475219042 F164 -V219 0.612914428034668 G131 -F164 0.5936564129869 T174 -F265 0.589405294090882 L173 -L327 0.575850780934514 V171 -E176 0.553783327638938 F164 -D222 0.547490015202045 M280 -K325 0.539554472913105 Y226 -F251 0.537636442696769 A283 -R321 0.537303362589686 A283 -M322 0.534514155603341 R177 -I324 0.522698428790447 S123 -L168 0.520533462788652 F93 -D124 0.520144310809639 F116 -L173 0.505362878470427 E211 -P262 0.487111011174302 D222 -F251 0.480921889784234 V256 -L261 0.479418126519325 I91 -N96 0.454521907478926 M280 -R321 0.454150430596611 C269 -E279 0.443424578003328 R177 -V323 0.439892327143039 C126 -G131 0.438786750380075 L168 -R218 0.428022096342217 C215 -V220 0.420114242572845 V100 -I122 0.418965356629394 E211 -T258 0.416498894092871 R218 -V257 0.413077433219393 L168 -C215 0.410238538949676 T99 -A118 0.400127042001433 E279 -T329 0.3998555008123 L168 -V219 0.397102519203044 T169 -E176 0.390438542146382 F93 -I128 0.389541847951476 L125 -V130 0.388324250064582 R272 -L277 0.388291453488088 F212 -K217 0.388137112232133 I170 -I266 0.387138438856756 P221 -E252 0.384251054954482 F178 -R272 0.382963688987962 E211 -K217 0.374098740397761 L120 -T169 0.373296825592601 G131 -S166 0.367190254084318 K214 -P262 0.353431534600096 V171 -L263 0.341613750350846 G92 -L125 0.335709732936015 V171 -M255 0.334383426494417 R177 -K325 0.331105056040566 D124 -I129 0.327604574203109 L127 -S166 0.32278270015933 G95 -A118 0.321086020817915 Y270 -S328 0.320491414124917 A175 -C269 0.317800889518775 N278 -M326 0.311051700366172 I167 -R218 0.302502657598888 Y270 -R321 0.300899885901258 L263 -Y268 0.300541248561498 T174 -L327 0.298765568054255 F93 -I129 0.295563176151735 I273 -N278 0.294012987964345 L213 -R218 0.293970034820059 R210 -K217 0.293271359162473 T254 -P262 0.292432596164989 C126 -V219 0.292221679233661 L127 -A165 0.290722285777574 C224 -E252 0.288073904515507 V97 -L125 0.280309542087077 C269 -N278 0.27825115317035 C269 -T276 0.271288882330992 A165 -K217 0.270553049826654 A165 -R218 0.259959769249824 C215 -E252 0.25977758087565 V260 -C269 0.256923574117492 V267 -R272 0.25673621408335 V267 -M326 0.255991412879252 G131 -L168 0.255011992503264 E279 -R321 0.254530250207495 G95 -L117 0.253733215528811 N96 -A121 0.25368658356525 C126 -E211 0.252082598509133 L173 -P262 0.249190604063682 T174 -T331 0.249119414154727 R177 -N278 0.246971972988265 I167 -C215 0.246683843652294 G92 -I128 0.242184627617198 T169 -L263 0.242106809253459 T169 -L327 0.241959099276853 E211 -F216 0.241180853833709 R177 -Y270 0.240800277250426 C269 -T331 0.239660095767674 I170 -V333 0.233044218037882 Y270 -A332 0.232909909682106 N96 -L117 0.231054630291716 R218 -E252 0.230384633963178 C215 -V256 0.228924989195875 N278 -S328 0.228007152116401 N96 -L120 0.22715866696892 L277 -K325 0.225041678083363 C126 -F216 0.222464403051049 C215 -P262 0.221105098340918 E252 -V257 0.220080110020279 F164 -Y226 0.219662162881469 Y270 -V323 0.218734944223436 C215 -C224 0.217113091443202 S123 -S172 0.216215809691134 G131 -C215 0.215374167943017 V171 -E211 0.211575133887018 S166 -P262 0.208734076763905 L168 -P262 0.208204062220275 V100 -F116 0.207387829785867 A283 -V323 0.201895627733659 A282 -M322 0.201458371947419 I167 -T331 0.201456203879017 C126 -T169 0.200308503123093 V97 -I122 0.199982592350386 L117 -S123 0.198874367208275 F216 -Y226 0.19845399115891 D124 -L168 0.197950934660703 I170 -V330 0.195359239354461 V219 -F251 0.194674891511326 V257 -P262 0.194365634503719 V219 -F259 0.1935868741056 S119 -S166 0.191383902283643 I266 -T331 0.190167289378862 L120 -L125 0.189442958658747 V171 -L261 0.18846255280845 A175 -T331 0.188185191343138 R177 -V271 0.186639271546097 K214 -L261 0.185308672800932 L173 -M322 0.184084399224939 C269 -L277 0.183302936533754 F116 -T174 0.181451456771788 V97 -S119 0.180056294239468 F164 -F216 0.180038450735959 A175 -I324 0.179521695700362 D124 -A165 0.176269346794649 F178 -N278 0.176061212945411 V130 -I167 0.172487088797634 I273 -T329 0.172461212336726 K217 -E252 0.169565358882899 C126 -F212 0.169037636163798 G92 -I129 0.168851344883993 T174 -E211 0.168497037141813 E211 -V219 0.167469996167994 T169 -T329 0.167439803929604 R177 -M322 0.167085456180913 Y270 -M280 0.16691051588731 E176 -K325 0.166015177872851 S172 -Y270 0.165961620870689 V271 -E279 0.16386150681564 T174 -T276 0.161920367612268 F216 -F259 0.161159882694077 D222 -T254 0.160725774001856 V260 -F265 0.160296607436459 L168 -K214 0.160119767394047 N96 -I129 0.159272321816276 R177 -C269 0.15919428337903 A165 -F223 0.157566334417563 F164 -F259 0.157305391979246 G95 -L127 0.156712433112284 C269 -L327 0.1557202403727 L261 -C269 0.15489106787701 T169 -E211 0.15447035151183 I91 -I128 0.154422672855749 S119 -R210 0.153585941444539 C90 -C126 0.153285877230396 S166 -M255 0.150279739120394 E252 -F259 0.150137562621093 C90 -L125 0.150023832092403 E176 -E211 0.149743603591184 L277 -I324 0.14969185607716 T169 -F334 0.148863451943027 I170 -A332 0.148649858056977 V130 -V219 0.146674605516208 G95 -I122 0.146150333144886 G92 -L117 0.145322533998383 A175 -V323 0.145225176109979 A118 -I170 0.14439256216883 L168 -M255 0.143034187972937 V171 -S328 0.142662686292267 L173 -Y268 0.142625455381172 N96 -L125 0.140461464390753 I266 -M326 0.139457564684061 V97 -V130 0.139110844256548 T174 -P262 0.137415163910243 N96 -S119 0.136097739054851 L168 -I266 0.135891776926917 V219 -V260 0.135745398218259 V102 -S119 0.135157961357807 S166 -V220 0.134946636162672 A281 -M322 0.134685537970866 R177 -A275 0.134332800924942 L274 -L327 0.134071235264511 S328 -V333 0.133999021754424 T174 -T258 0.13379683304339 S172 -M326 0.133575737362211 L263 -S328 0.132820462946244 I170 -P262 0.132475676646951 K214 -F259 0.132468272711755 A281 -K325 0.131868065516363 F216 -P221 0.131598334932163 S172 -V267 0.131071667934223 M322 -V330 0.130254351447647 R218 -P262 0.130008548905856 S172 -V330 0.127862732840763 T99 -L120 0.126547212053348 S123 -V219 0.125987610729215 G95 -L120 0.1252656803359 F212 -V220 0.124550315150902 R210 -C215 0.124534993950536 L117 -V330 0.124492505947321 L98 -I128 0.124246191013982 A165 -D222 0.124107112813981 K214 -V256 0.121459985833744 C90 -I129 0.120777531251655 R218 -G225 0.120704137239448 T169 -F259 0.119865656809418 S166 -K217 0.118042472888743 A118 -E211 0.117560890324175 A275 -S328 0.117540099129857 I170 -L327 0.117390336775668 R177 -T276 0.116927328075603 S172 -T258 0.116590681649178 A121 -L173 0.116209055576912 L274 -S328 0.115871819604792 T169 -R218 0.115342999877829 V257 -V267 0.114877152638099 L168 -V220 0.113785199646905 V171 -V333 0.113631530078874 V271 -K325 0.112681534977972 L173 -I264 0.112589927948978 A175 -R210 0.11253438312037 S123 -A165 0.11169326268848 A275 -R321 0.111474161572297 I122 -G131 0.111465487635477 L261 -V267 0.111025964847331 L117 -L127 0.110777199405264 L101 -L117 0.109161397540932 T174 -K325 0.108531147809425 M280 -L327 0.108323551925012 L120 -L173 0.108180244400716 K325 -V333 0.107881476038298 K325 -V330 0.107708880559246 R177 -R272 0.107562218134021 S172 -C215 0.107019507185334 G225 -E252 0.105499093720665 I122 -A165 0.104963620162804 V257 -L263 0.104509729853099 A165 -F259 0.104223232275939 V94 -L127 0.104202957798012 C215 -F251 0.103167247451561 F164 -G225 0.102861203924806 A175 -L277 0.10261293272136 R218 -T258 0.102476523236413 S172 -C269 0.101954914224517 V271 -L327 0.100943327167996 S172 -I266 0.100877278643498 C90 -G131 0.0993127885608001 R177 -I273 0.0988034986228126 R177 -I266 0.0987813890443334 G95 -I129 0.0983141798704948 L213 -V257 0.0981569445781993 V94 -I122 0.0968286791857942 N96 -I128 0.0965016484330361 S166 -E211 0.0964869386379181 I170 -Y268 0.0956000115091422 A118 -L173 0.0955856242597928 L120 -L213 0.0954968371694749 S166 -F335 0.0942158325587723 I122 -I167 0.0941845373296593 E176 -T276 0.0941287843135434 L263 -I273 0.0938017842234385 L261 -I266 0.0932841485850857 F164 -T169 0.0930666391443074 F116 -E211 0.0930012678121326 L117 -L125 0.0927715972451022 M255 -V260 0.0926090335590173 K214 -D222 0.0917684370247882 L125 -S166 0.0916919644454661 L263 -V330 0.0903345233153008 L98 -L117 0.0900973483047942 V257 -I266 0.0900581939499678 V102 -L117 0.0894015676858873 L120 -V171 0.0893883575959631 Y270 -M322 0.0892309715421558 I170 -C269 0.0880177093620522 T174 -F334 0.0877982600001013 A175 -I266 0.0877629752659921 I122 -E211 0.0876805196054118 L261 -F335 0.0872796103373039 F178 -V267 0.0865869032064213 L120 -L327 0.0865549581436151 F265 -S328 0.0863586278171642 I128 -S166 0.086335747912103 N278 -L327 0.0856629326330509 L263 -V333 0.0855448134737249 E176 -L327 0.0853121166876765 R272 -E279 0.08491692625394 T169 -S328 0.084871613622496 I167 -I266 0.0842597078913996 L277 -A282 0.0837041430105696 S166 -T331 0.0834725595967783 V171 -L213 0.0832939048190626 L117 -C126 0.0830708252188188 C269 -I324 0.0830133677579368 V102 -L120 0.0828670892216052 F259 -T331 0.0827138882189686 L263 -L327 0.0822693976374538 G92 -S119 0.0814260846155463 L168 -L327 0.0807408771392657 S123 -E211 0.0801138158059906 A275 -I324 0.079986276654024 L263 -A332 0.0794934685336344 E176 -Y268 0.0793831899737691 F212 -T258 0.07908093087556 C269 -A275 0.0790163557716625 V94 -L120 0.0788485382638475 L173 -R321 0.0780546366035163 A165 -L213 0.0777867441414699 T276 -S328 0.0770042650731426 L120 -V130 0.0769009123348026 S166 -K214 0.0762213834006187 A121 -I170 0.0759327115973232 T169 -V219 0.0758844523537581 L168 -V257 0.0751242558880622 S166 -R218 0.074893070399829 L117 -L168 0.07468473421231 I91 -L120 0.0737229832252027 I167 -L261 0.0722161210558951 V130 -F164 0.0717645168423671 E279 -M326 0.0715718583852649 R218 -V260 0.0711010049847938 L117 -F212 0.0708915606238265 G92 -G131 0.0702863480743803 G95 -C126 0.0701674162020369 G92 -V100 0.0697554154716649 R177 -T329 0.0690901335712141 A121 -V130 0.0690864094931571 E176 -Y270 0.0686422039445629 F116 -A175 0.0685704739893671 T258 -F334 0.0684233347100489 R218 -L253 0.0676993921134807 I273 -A281 0.0676304139696615 I266 -R272 0.0675276462781671 L117 -V323 0.0671359668712626 K217 -V256 0.0670147240260597 L127 -F212 0.0669112540267136 E211 -R218 0.0666523138790769 K217 -F251 0.0665999864656424 I170 -L263 0.0665180918993525 A175 -R272 0.0659154821662682 L125 -L168 0.0657027779715511 I266 -S328 0.0654385944100846 V94 -T99 0.0653928083137174 V267 -L274 0.0652848338155634 M280 -T329 0.0652007812076723 P262 -V267 0.0647630871427083 L168 -A175 0.064529511345949 S123 -K214 0.0644966269913718 I264 -F334 0.0643118377928852 R177 -T331 0.0643046541746188 M255 -L261 0.0641326156821171 T174 -R321 0.0640041520089858 R321 -T329 0.0639956871445174 V219 -T254 0.0634837598054956 I170 -V260 0.0634459962295413 V256 -V267 0.0634168801990107 L120 -I129 0.0632318874645914 L274 -R321 0.0630891064076113 N96 -G131 0.0629249704572906 A118 -I128 0.0627650383161376 S172 -I264 0.0626138074094196 A283 -S328 0.0624960614667591 C90 -V97 0.0623545342253629 A275 -M280 0.062322799473546 I167 -P262 0.0622269439946039 F178 -T331 0.0621660559403838 T169 -V220 0.0619247235754976 I170 -K214 0.0618630099719488 L263 -T331 0.0617667746991 L120 -R210 0.0616169635671215 L127 -V219 0.0615648557188804 L168 -V330 0.0613611411710071 F164 -K217 0.0612614864866443 T169 -K217 0.061044135147784 V171 -I324 0.0609205207694741 L120 -F164 0.0607406162513557 F212 -P221 0.0605064065086677 S172 -L263 0.0603148464637133 A118 -S172 0.0597269764894754 L127 -C215 0.0596865322119671 E176 -F265 0.0595901869643525 F178 -I324 0.0591954235963175 R177 -V267 0.0577339486683601 S119 -K214 0.0573002725481668 L168 -T331 0.0570455284112326 V323 -A332 0.05689397533909 D124 -F212 0.056801939562412 V260 -Y268 0.0567287379540342 V171 -V323 0.0561835158213002 L173 -I324 0.0556958848815903 Y268 -S328 0.0555668459148153 D222 -M255 0.0554597772247893 A175 -R321 0.0553715443887803 I167 -V257 0.0553563736063358 F93 -L127 0.0552642002682262 L173 -A332 0.0552292216663384 V102 -I122 0.0551628333460394 G92 -V97 0.0549499683490122 F178 -P262 0.0546393996355681 L117 -I324 0.0546380599487306 L120 -S172 0.0546122242286124 C90 -V130 0.054188083171093 R177 -L274 0.054152105216962 I324 -V333 0.0536299737021455 R272 -I324 0.0535422735706388 L253 -L261 0.0534477283088917 I167 -F223 0.053095550577686 N278 -V323 0.0525526575242234 A175 -F265 0.0522232380667909 A175 -E211 0.052178849151213 I170 -R210 0.0520779045234141 T174 -F335 0.0516503569467917 G95 -S123 0.0516236405229527 G92 -V102 0.0509342301289989 I273 -M280 0.0508903384925903 L120 -L127 0.0499291532553257 F116 -I324 0.0491333018790474 C215 -L261 0.0487393427474849 R177 -R321 0.0486903744105283 A175 -S328 0.0486139952307134 A121 -L327 0.0482196009017493 A121 -A165 0.0480463670061478 M255 -F265 0.0480358701286654 S172 -L261 0.0480184162680319 I91 -V333 0.047786290187406 L168 -L173 0.0476758966054778 F164 -M255 0.0474900327909102 T169 -I264 0.0474311470096764 N278 -T329 0.0472185434622521 L101 -S119 0.0469694826979214 A118 -R210 0.0468261573143893 F93 -V130 0.0467139183165042 L277 -R321 0.0466700880796127 L125 -F164 0.0466416228333202 F116 -M326 0.0464649664508416 K214 -T254 0.0464063540104132 A281 -L327 0.0459760842925916 A121 -G131 0.0454747748538411 A121 -L168 0.0453273098024118 V267 -T331 0.045245727907318 T174 -M322 0.0449528636877047 A121 -T169 0.0447626330269033 I170 -M326 0.0446663956999345 L274 -A281 0.0437226762169578 L277 -A283 0.043693452053815 A282 -S328 0.0433298120805707 S166 -D222 0.0432428191807918 K217 -F259 0.0430125373635999 G95 -V330 0.0426327200507268 R210 -P262 0.0422874638966011 S123 -C215 0.0416098867741352 C90 -A121 0.0411422421781347 L120 -S166 0.0409071485378063 G131 -I167 0.0408109193086155 F116 -T169 0.0393364451866294 G92 -S166 0.0388748461380575 F178 -M326 0.0385602407896779 F259 -I264 0.0378883853187553 V97 -L117 0.0377756115675272 P221 -L253 0.0376835238716424 M326 -F335 0.0375283353492759 A282 -L327 0.037337020354091 A118 -V330 0.0370994500088022 A118 -L168 0.0365835299582598 C215 -M255 0.0361477050442566 F212 -P262 0.0357516112781258 L173 -Y270 0.0353965206768265 E176 -R321 0.0349156912026336 A118 -T169 0.0341148013787995 M326 -T331 0.0335533586235135 A283 -L327 0.0331431473704717 L261 -Y270 0.0331405220830963 R177 -V330 0.0330923352558584 N96 -F116 0.0329937049519042 S172 -R177 0.0329157856958253 R177 -E279 0.0327099066534187 R210 -T258 0.0327005867166972 T174 -L277 0.0321757765328299 S172 -L213 0.0320978236950653 E279 -M322 0.0320137630703343 R177 -M326 0.0319055229375964 V220 -V257 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