[Fri Aug 26 16:26:10 2016] >Input file: TMQ9BRQ5M1D.pdb >TM segments: 57-82_ 93-120_ 146-173_ 192-207 MAIDEN score = -31.6061 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 ----------- ---------------- C101 -E165 10 Y146 -A207 2.30663921165808 V115 -W151 1.05281463732526 L105 -L161 0.875145147374249 F98 -L168 0.770781258798847 V108 -L157 0.728966426708007 L105 -F162 0.68095230352559 A75 -V106 0.62931307479494 V115 -A150 0.623057320933686 V108 -T155 0.620228853308588 A75 -F162 0.602954471102164 F98 -E165 0.600824882905989 A75 -E165 0.594337707069252 F111 -W151 0.589302110102103 S64 -L113 0.57367985396339 M76 -T102 0.56078255871282 S68 -L110 0.555158659026143 S64 -S116 0.52505509976449 L71 -F162 0.524101095243319 C101 -L161 0.523921564337781 V147 -A207 0.478323764054996 A69 -H109 0.476749801548998 L105 -E165 0.463378480193763 V106 -G158 0.423960370061669 V115 -E148 0.4203215459241 M76 -H109 0.418712258633105 M79 -W171 0.397271617181299 K60 -E148 0.393122006427717 R66 -L113 0.389502839505474 S68 -T155 0.385470832918326 S68 -A112 0.382850662713852 A97 -A198 0.379152295106295 S65 -S116 0.368301719566648 S68 -L113 0.36294293027769 V172 -R192 0.361573336332701 C101 -A164 0.350780649144457 M79 -T102 0.34956349249522 T102 -L161 0.348457313626037 F74 -C101 0.34520067971798 A97 -L168 0.336035402636444 S72 -V106 0.335079399253004 A75 -T102 0.334743080546805 F111 -E148 0.332459833387797 A97 -G195 0.327860521206514 R58 -L120 0.327648690534384 S64 -T155 0.324649458883097 K173 -R192 0.32460117103533 A63 -A112 0.324290877395005 S64 -A112 0.323211314090366 K60 -R66 0.322090890377862 F98 -V169 0.321990784833982 A75 -A164 0.321453646106605 S72 -L105 0.317661552404536 C101 -F162 0.315492154738564 V115 -V147 0.310593220303965 V104 -L161 0.310147290228565 W171 -P194 0.309774647218784 A75 -S99 0.309423041651865 A69 -L110 0.309254674013162 L149 -A207 0.309056291518822 G73 -A107 0.305377586904569 L94 -R192 0.305202214452409 A69 -L113 0.301366690366578 K60 -A150 0.301296886034262 V147 -P206 0.297584346819955 T67 -T155 0.295811284457191 W151 -P206 0.294094002091454 L61 -R66 0.291263113051183 G73 -G158 0.290463412264295 L70 -G158 0.287986226199241 R66 -L71 0.283380761790579 L119 -V147 0.279766099837031 S68 -G152 0.273336061288207 R66 -M114 0.268112565777797 S99 -A164 0.265866064198821 G93 -W171 0.260734199366987 S72 -A112 0.259098746942497 L113 -S154 0.256426759258178 K60 -S154 0.255238984098566 A69 -A107 0.253629848335507 L105 -L157 0.245346380809721 W151 -T159 0.243299288818728 G73 -F162 0.240899632404837 C101 -T159 0.239939693703354 F111 -S154 0.237495509613344 T117 -E148 0.234014534583628 E148 -P206 0.228777971210116 L119 -E148 0.222786995032335 S116 -W151 0.219286386725584 A63 -G152 0.214342754257713 F111 -A156 0.211599596536593 T67 -G152 0.211493591528587 S99 -V172 0.211082368005266 M79 -V104 0.209962426703304 S57 -G152 0.209604056835796 V80 -S99 0.208079383258533 L168 -K173 0.208044813682372 A75 -H109 0.206975214688077 V82 -G170 0.205693721913709 T67 -W151 0.205039213263806 S57 -V147 0.203212398819657 A75 -L105 0.202942567005322 L95 -P194 0.200720515934847 A59 -S116 0.196451888170174 K60 -A156 0.193305162037573 L113 -G158 0.191530311897171 A75 -F98 0.191062906678113 L61 -T155 0.189962691313813 V104 -H109 0.189499609708967 S57 -M114 0.186694377882713 L95 -V172 0.186452428258423 M114 -L149 0.186437462923744 S68 -V115 0.185548159517516 G93 -S99 0.184006795939148 K62 -L70 0.18398017879865 H109 -T117 0.183797538839664 G93 -G170 0.18376350079809 S65 -L110 0.183728042816237 T103 -T159 0.182719103318666 S57 -L120 0.179898794093875 L110 -G152 0.178545261381038 H109 -E165 0.178415672437002 V169 -R192 0.178031536774595 L95 -G195 0.177884154450437 M76 -L168 0.177172703410711 S64 -L157 0.174586662981371 T67 -T117 0.17379787913099 A78 -F98 0.173311110759927 S64 -A150 0.173267298168069 T67 -L110 0.169476316957173 M79 -V167 0.167773646849732 H109 -M114 0.166905251578823 S116 -Y146 0.166614437424335 A75 -G158 0.165584294814439 T117 -A150 0.164447248672906 T103 -T202 0.161709431992792 C101 -L168 0.16080040716585 K62 -T155 0.1586113138219 M79 -V96 0.158086097500254 A63 -V115 0.157259292307406 A100 -V169 0.156154266646213 A112 -A150 0.154720148653833 A107 -F162 0.154200231515353 T103 -T155 0.15357911811392 H109 -C118 0.152975434791681 G73 -V80 0.152746118291716 K60 -L149 0.151598771829396 M79 -L161 0.151433599643897 G73 -L113 0.150204572143614 T117 -T155 0.148628572820791 A63 -T117 0.147261621976155 L61 -V115 0.144942700662398 T102 -T155 0.144897849670337 V115 -S154 0.144670414194418 S65 -L120 0.144138840876743 V104 -V167 0.141655298899743 F111 -V147 0.139661918994141 R58 -C118 0.139333847574393 C101 -L157 0.139218845923323 A97 -R192 0.138774519195194 E81 -V169 0.138019361959828 G152 -L204 0.137639319212072 S68 -V104 0.137294968740883 S72 -V80 0.136310143488523 S64 -G158 0.136281536518833 V115 -F153 0.13503538583103 S72 -T155 0.13467891581748 S68 -V108 0.134639603915383 S72 -C101 0.13431798148282 V82 -S99 0.134172774597939 S65 -A112 0.132894824324611 L119 -W151 0.132373137908405 A75 -A107 0.13218563420757 V82 -V169 0.131414620891256 H109 -S116 0.131057851006956 S72 -V166 0.130323546643897 S57 -V115 0.130218460817887 M76 -G158 0.129894781882079 M76 -A107 0.129487058748699 L120 -V147 0.129449778081151 V169 -V193 0.129369289134782 V77 -V82 0.129020418853125 V108 -S116 0.128884359687734 A69 -T117 0.128334982063244 G73 -E165 0.127485654682725 V96 -V200 0.125996538623337 R66 -A112 0.125273508461266 G158 -T202 0.124625511761299 A69 -S116 0.124290212950632 L95 -A100 0.123414272058859 A69 -M114 0.123154052575625 A97 -P199 0.123009806645848 A75 -V108 0.122867202476055 S99 -V167 0.12265042868573 V104 -A201 0.122415043029636 L113 -L149 0.120564742799969 S116 -A156 0.119975476511943 L94 -G170 0.119920953887679 A78 -F162 0.119833969425368 L70 -T159 0.119136140828619 S65 -A150 0.118363866325507 A78 -V167 0.118158749550602 A63 -H109 0.117677168972732 V106 -A156 0.117189362905625 S64 -A107 0.116761933778258 F98 -F162 0.116291169016947 T102 -F160 0.115275466376633 S64 -C118 0.114897366882336 L119 -L149 0.114524033484323 G73 -V104 0.114438756904451 S154 -T202 0.113839679433065 L157 -A201 0.112767643702746 E148 -A207 0.111814241831454 A112 -Y146 0.111405149492365 S154 -A164 0.110990868334187 V96 -A198 0.110421403463739 L113 -L157 0.109725978173717 A100 -G158 0.109713044774999 L113 -L120 0.109611034133577 S65 -V108 0.108689460831909 R66 -T155 0.108301499751529 F74 -V166 0.108231750073728 S64 -T159 0.107690801861937 L61 -S116 0.107456845184144 L105 -V166 0.106888287669866 L70 -L105 0.106677428838293 A63 -W151 0.106124890248073 A112 -G152 0.106020085335558 V106 -A164 0.105826351593926 S65 -V106 0.105812545266643 A97 -G170 0.105043281976932 M114 -Y146 0.104914285884382 V104 -T155 0.10430506023078 F98 -K173 0.104163893066922 L61 -L149 0.103924834867958 K62 -C118 0.103672347491529 V77 -L105 0.10347910185126 A69 -V115 0.103116337695192 C101 -V200 0.1031088470982 S68 -T117 0.102380426929344 V104 -T202 0.102245055528981 C118 -S154 0.102219255978888 R66 -G158 0.102076045315087 F160 -E165 0.101552122395366 S65 -E148 0.100972835902879 S64 -L149 0.100942917970887 S72 -A156 0.0999297183833443 M76 -V108 0.0992531734989459 V106 -L163 0.0991977557402413 V115 -P206 0.0987102043800836 M76 -V106 0.098310421803947 L168 -V193 0.0982223428029041 A107 -S203 0.0981425374193059 A63 -F111 0.0973773408268719 S72 -A164 0.0971053448419066 L71 -V108 0.0969946172074945 R58 -T117 0.0969162018310908 A107 -T202 0.0966623472432744 K60 -V147 0.0963832150402681 A59 -R66 0.0953574838438414 S99 -V166 0.0952924405742763 C101 -S154 0.0952583089992329 A78 -A164 0.0936436254769886 A107 -G152 0.0934001756235947 S99 -L161 0.0928568951802617 E148 -A156 0.0920522657874239 L94 -A198 0.0914913561039064 F153 -T202 0.0913501401473608 G152 -A207 0.0910553110966554 T103 -V167 0.0908531544792335 A69 -V77 0.0905412743186242 V80 -K173 0.0904978757869457 A112 -W151 0.090282976781733 T103 -F160 0.0901839309353024 V108 -L163 0.0898155286099482 K60 -T155 0.0894380056173625 L61 -L110 0.0893967827632647 S116 -G152 0.0884018044269776 Y146 -L204 0.0882394669425937 L113 -A156 0.088147463698659 G93 -A198 0.0879275840044338 S57 -Y146 0.0874925027952926 A75 -L110 0.0874786083557768 G73 -T103 0.0870338124886769 L94 -A164 0.0865241447974334 T117 -W151 0.0863919608370161 V104 -L157 0.086270967526735 A63 -A156 0.0859330439931218 A100 -A198 0.0857283363491286 F111 -T159 0.0853039701905058 S65 -T159 0.0852204447009165 W151 -A207 0.0851458371663787 V115 -G158 0.0848430156665865 F111 -L120 0.0846096983985716 H109 -E148 0.084317188341033 S68 -T103 0.0837059517793838 L113 -A150 0.0835640897721035 V104 -L168 0.0835578253969445 T103 -S154 0.0833338399694022 L110 -L161 0.0829263841533789 S68 -T102 0.0829132802455397 M76 -A100 0.0828288603407221 S64 -T117 0.0824504787800402 L70 -F160 0.0820665724674043 L110 -T155 0.0817212516340993 T117 -S154 0.0814015723688011 V96 -P199 0.0813947886089768 K62 -T117 0.081263310585129 A75 -A100 0.0802637259835786 V104 -A156 0.0799681227065161 C101 -G170 0.0793001867884815 W151 -A156 0.078688043532674 V82 -K173 0.0784971286530229 L95 -V166 0.0780522903033454 C101 -A198 0.0777805944287397 T67 -A156 0.077709879308963 A100 -T202 0.0775710444595434 S116 -F153 0.0775431394746429 S72 -S99 0.0770702820636213 L105 -V169 0.0770512708261855 A69 -S154 0.0768705298131342 S64 -G73 0.0768654809362765 V147 -T155 0.0766047737747702 T155 -E165 0.0762665875055824 L94 -V166 0.0762536545221097 W151 -S205 0.0758775462359045 S68 -L161 0.0755530021354289 L94 -G195 0.0755395646915149 R66 -S116 0.0751206262673486 A107 -V115 0.0750776425673019 L163 -G170 0.0750074344732763 T102 -V167 0.0749416642039555 A97 -E165 0.0746028702569728 R58 -S65 0.0743613798348747 A78 -L95 0.0741127324476878 L105 -V167 0.0740365035312983 C101 -H109 0.0739536892220531 L70 -V108 0.0735598481374408 V167 -R192 0.0734380793517602 S65 -A156 0.0734256117134819 L71 -A164 0.0733743486524059 A112 -T159 0.0733485585908671 R58 -L113 0.0723846764256102 A78 -L168 0.0723411376262444 M79 -A97 0.0722498762706512 A156 -A164 0.0718539798233992 M114 -G158 0.0716284595009684 L120 -A150 0.0712397424278954 L119 -F153 0.0705882088890215 L94 -V172 0.0700695234248627 R66 -L110 0.0699471116898462 S116 -T155 0.0697278353704363 F111 -L161 0.0695530667646262 V166 -W171 0.0694409164290919 T67 -L105 0.0688829585158177 S65 -G73 0.0687263536169969 A107 -A156 0.0687069269303793 L94 -K173 0.0683735987965424 T117 -V147 0.0678633740223132 S68 -S154 0.0678458383168753 F74 -L168 0.0672570818701432 V108 -S203 0.0671271604724986 E165 -W171 0.0666004878856157 T103 -L157 0.0663290245382342 S99 -W171 0.0662662170342274 G73 -E81 0.0662169565699358 R66 -T117 0.0659575502383803 S68 -G158 0.065876355540087 A100 -L157 0.065644501024768 A112 -L204 0.0655948468433614 E81 -E165 0.0654680183054842 G93 -V193 0.0653795898782192 S99 -A107 0.0651576905917857 A100 -A201 0.0642823038757556 V104 -V200 0.0637334251743322 L71 -T103 0.0633477888735514 S72 -M114 0.0631795868893612 A112 -L120 0.0630158134009888 L61 -G152 0.062745944068352 A164 -R192 0.0626784132568765 F74 -L110 0.0625289768769579 F98 -R192 0.0621316271816585 L149 -L157 0.0617152211204051 V104 -T159 0.0613792413275427 V82 -L95 0.0611540946479758 A75 -V82 0.0609282705484255 G73 -T155 0.0607564757304706 F74 -F160 0.060677083087965 F153 -A207 0.0605225169321573 A112 -T155 0.0598354781174294 C118 -L149 0.0597542616057272 A75 -V167 0.0588273828157124 T67 -V106 0.0584314667939072 L70 -A112 0.0561807366909681 A100 -L197 0.055576562391779 T67 -F162 0.0553645945433692 E148 -F153 0.0551549015122994 L119 -P206 0.0549689160965396 T103 -G158 0.0547245805875041 L94 -T102 0.0543372983522943 L70 -L161 0.0541386689271537 L113 -G152 0.053896215665775 W151 -S203 0.0537576910476365 G73 -V108 0.05369971282515 G93 -L168 0.0536346654820985 L110 -L157 0.0535232124428298 T67 -F111 0.0535164605327605 A100 -L163 0.0528756981523046 F111 -T202 0.0525010827298598 S64 -E148 0.0524658078864784 A150 -S203 0.0523211225661004 G73 -V82 0.0522321880129211 L71 -A107 0.0518434352395423 L95 -L197 0.051785089221736 L71 -L113 0.0511638708145528 S99 -V104 0.0511075143885567 L70 -M114 0.0506679114431778 T155 -L163 0.0505481312372718 A100 -F160 0.0505448098433119 A97 -L161 0.0499247240730183 F74 -T159 0.049695256440645 V104 -V169 0.0492924876552845 M114 -F153 0.0490194664598348 R58 -V115 0.0485173117453594 A97 -V193 0.0482753631632828 L110 -F162 0.0479740182694481 K60 -F111 0.047817748989841 T67 -F153 0.0473479221408266 A78 -L163 0.047287611430332 L70 -A107 0.0471221373040054 M79 -E165 0.0467963945332492 A78 -V104 0.0464130463887882 L157 -T202 0.0463374770518854 A100 -F162 0.0462563995020888 M76 -L161 0.0461290004025297 S65 -G152 0.0457356951256855 V80 -A100 0.0453724689570052 L70 -T155 0.0444144323127356 M76 -L110 0.0441684248404681 L120 -W151 0.0440168313662568 G152 -P206 0.0437361562568226 S99 -G170 0.0435395626427528 S64 -L119 0.0435203880681134 L110 -A156 0.043183245544741 K62 -L119 0.0431541113160918 V147 -L204 0.0418352775342088 F98 -V172 0.0416599573641747 W151 -G158 0.0415191734278637 A112 -L161 0.0414676515095467 E81 -S99 0.0414599312381538 A75 -L168 0.0404641273862092 A63 -F153 0.0401741470312622 V96 -G195 0.0398551837128425 L95 -K173 0.0388872452367908 V172 -P194 0.0385423417628568 A97 -A107 0.0382604054010005 T67 -S154 0.0376988886977996 G93 -C101 0.0373424926545916 F74 -T103 0.036952589968807 S64 -V108 0.0368897396953698 S57 -L149 0.0366139388002797 L110 -T159 0.0364514085860641 V108 -V147 0.036412752390472 A112 -P206 0.0364079735779699 S57 -A112 0.0363879429019978 R66 -T159 0.0360974462028052 S72 -L157 0.0360858160526902 G170 -V193 0.0360382250782818 V104 -F153 0.0358079644777507 M79 -A107 0.0355022074014166 L95 -V167 0.0349317256230499 A100 -L105 0.0347055840384218 A100 -V200 0.0345653947616027 F111 -L149 0.0345141539400826 A97 -L163 0.0344788406725747 K60 -C118 0.0342290058823833 V80 -L95 0.0336764904866582 A107 -A150 0.0333612102652712 M76 -C101 0.033281240457363 L110 -F160 0.0330506366516534 A63 -T159 0.0330295166494008 L61 -A150 0.0326331918578076 V96 -V166 0.0325898490001215 L95 -A164 0.0325573514806857 S116 -L149 0.0324005956747001 K62 -V115 0.0322318713510109 S65 -G158 0.032217406310956 A97 -L105 0.031865481875756 G73 -T102 0.0315705879130133 M76 -T103 0.0315459715651891 L110 -F153 0.0315441857554277 A75 -V104 0.0308747242336391 K60 -V115 0.0305084527145216 A69 -T102 0.0299933551113205 S72 -L163 0.0297706315935463 R58 -E148 0.0293721197713652 L149 -G158 0.0287419653718528 V77 -V166 0.0282676794232604 T102 -V172 0.0277851705475876 M114 -G152 0.0276776938291496 F74 -L105 0.0276621698735016 C101 -L110 0.0276555257824107 S65 -L119 0.0274669562192103 Y146 -S154 0.0273458826541101 L71 -F111 0.0273164035370628 V96 -E165 0.0272325499462642 K62 -E148 0.0268949652054802 V80 -L105 0.0268410952548834 W151 -F160 0.0268199181783926 S57 -S116 0.0265354534994415 S72 -V108 0.0262997507556504 A150 -G158 0.025775419556533 M114 -A156 0.0256867105464114 K62 -W151 0.0256394928852127 A59 -G152 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