[Fri Aug 26 17:14:27 2016] >Input file: TMB2FT39M1D.pdb >TM segments: 159-182_ 215-237 MAIDEN score = -26.6227 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 ----------- ---------------- A175 -V221 0.632464326565975 A175 -L225 0.451411594888656 F164 -P236 0.424431965688043 R219 -V224 0.361759079827793 M179 -G218 0.32827108515254 L178 -V221 0.318955895271127 A175 -S223 0.308804924168502 T167 -I232 0.252746119003093 T167 -T237 0.246774090049981 I171 -V224 0.229606049551549 L225 -Y230 0.21303683312737 V168 -S231 0.207507406090114 V168 -I232 0.205816008213225 T170 -I233 0.194254797818338 V163 -I232 0.189678241956215 I173 -T222 0.184399224937299 L165 -T172 0.177516836578338 L162 -P236 0.174774226441962 K160 -L165 0.172743951595493 I174 -I182 0.163749207210024 I182 -V216 0.16259677730881 I182 -G218 0.162195441887058 T167 -P236 0.150203704276008 L165 -G229 0.145843507998629 I171 -I226 0.14552869609312 G176 -G218 0.140802940142736 T172 -I233 0.137053988529172 I169 -I228 0.134649521743801 I226 -I233 0.133564899280488 A175 -F220 0.132415737173291 V181 -V216 0.130940853208671 V181 -L217 0.129017873834025 I171 -G229 0.127375640452209 R159 -P236 0.115948983698125 A175 -R219 0.115073710623528 T167 -S231 0.102117426154434 G229 -T237 0.10161399155448 G176 -I226 0.0989509309512265 A175 -L217 0.0982786003413916 T170 -G229 0.0959811830554094 L178 -S223 0.0946527593534761 I173 -I228 0.093321547406219 A175 -I182 0.091550071743105 A175 -L227 0.091087120228182 F164 -G229 0.0903348360426324 I174 -L227 0.0899436831255255 A177 -V221 0.0888805927737458 M179 -V221 0.0887875802590337 I174 -T222 0.0879339079091649 R159 -T167 0.0875524311905795 L165 -I174 0.0860481796604481 G176 -G229 0.0841825583947098 V168 -L227 0.0837081955544177 T172 -L225 0.0830469499798632 T172 -S231 0.0823864193767271 V168 -Y230 0.0810474141240831 I174 -V221 0.080738241395288 T215 -S223 0.0796000569356803 G176 -V224 0.0754571006115423 I171 -I232 0.0754055931986386 L227 -P236 0.0738404198054262 G229 -P236 0.0721460893116119 I226 -V235 0.0710553162261407 T170 -Y230 0.0707004406323424 T172 -S223 0.0702810876913906 T170 -L178 0.0693546634083004 A177 -F220 0.0691704093617922 K160 -F166 0.0674208933976326 I169 -L225 0.0668689859229961 K160 -V168 0.0664917586368969 T215 -V224 0.0664545654851958 F164 -I228 0.0659483409795074 F164 -Y230 0.0651610108961895 V161 -T237 0.0645310856098842 V168 -A234 0.0643234487694855 I182 -T222 0.061512908780192 I169 -G229 0.0603908289988899 I171 -T222 0.0597609780573212 V161 -I169 0.0587516529817602 S231 -P236 0.0586641559956318 A175 -G229 0.0560765599945974 T170 -I228 0.0553841676139486 V168 -I226 0.0548108045107929 L178 -G218 0.0546000727167151 G176 -S223 0.0542258362316499 L165 -V235 0.0538353459768546 V161 -P236 0.0510546800647651 M179 -T222 0.046813066433914 I228 -T237 0.0461292763939993 V168 -P236 0.045986524465834 F166 -A175 0.0440389001210466 I171 -M179 0.0433816013694187 T222 -S231 0.0431495211317183 A175 -I226 0.0422792799211944 I228 -P236 0.0414678977938027 V168 -V224 0.0408875386330774 I173 -I182 0.0397293447651963 F166 -G229 0.0388714434830542 I169 -I233 0.0387438334765804 M179 -L225 0.0374648127994526 I173 -G229 0.0370903562265248 I171 -S231 0.0348288141018562 M179 -T215 0.0322079070928973 Y180 -V221 0.0290094581454952 F166 -V235 0.0248102736119504 K160 -T170 0.0232187802225181 F164 -T237 0.023032324163653 T172 -L227 0.0222748132634658 I174 -I226 0.021543357188345 S223 -Y230 0.0211095815110909 Y180 -G218 0.0184324128557463 F220 -L227 0.0177770907875108 F166 -I232 0.0174857636991854 G218 -L227 0.0170100644055866 F164 -V235 0.0164565436211888 A177 -V224 0.0163908356295046 F164 -A234 0.0161266118314689 T167 -L225 0.0153835015139236 L165 -A234 0.0147268975942172 L227 -I232 0.0146675917797259 K160 -V235 0.0140510603186175 G176 -T222 0.0128630037645929 I232 -T237 0.0126505879530026 V161 -A234 0.0114485784863554 M179 -V216 0.00978751351149088 V181 -T215 0.00547033323565804 F164 -S231 0.00470161846882866 G218 -I226 0.00401190555670894 F164 -T172 0.00207539911192423 T222 -I232 9.88257355314381e-05 V168 -A177 -0.000924362804543222 I171 -Y180 -0.001745496833788 V163 -T237 -0.00287645125153047 A177 -T222 -0.00364418231115682 Y180 -T215 -0.00514390103047679 T167 -I226 -0.00527794603848308 L162 -T237 -0.00555869076364335 M179 -V224 -0.00756375219511529 I174 -G229 -0.00922350555915241 R219 -L227 -0.00931616878158259 T167 -L227 -0.00964246906900801 T170 -S231 -0.0118039829229062 V168 -L225 -0.013296684239279 T170 -L225 -0.0144340825865221 V181 -T222 -0.015656956220556 K160 -I169 -0.0167427362294115 S223 -S231 -0.0167471148908502 T172 -Y230 -0.0178276924566134 I174 -F220 -0.0190774181146596 A175 -I232 -0.0192477502010613 V224 -I233 -0.0204484998596399 V216 -I226 -0.0220512417396179 M179 -I226 -0.0223808485568249 I182 -R219 -0.0233464625464521 Y230 -T237 -0.0235375640235216 A177 -G218 -0.0239436630100993 T170 -I226 -0.0243532692363249 I173 -V221 -0.0246583264679865 A177 -L225 -0.0255703087140091 I169 -L178 -0.0260023087683097 V161 -I232 -0.0274484181861046 I169 -I232 -0.0275572565072917 V161 -V168 -0.027595080489105 I169 -P236 -0.0304599950637439 L162 -I233 -0.0321519132723669 M179 -F220 -0.0325923533452204 L227 -V235 -0.0333322346077818 F166 -I228 -0.0354996318637397 I173 -V224 -0.035931668460206 V168 -A175 -0.036194115692143 V163 -A234 -0.0378708886288939 K160 -I233 -0.0385939719648118 Y180 -L217 -0.0398016839849875 T167 -A175 -0.0408153022971485 L225 -A234 -0.0419994936128241 L178 -V216 -0.0421611443469221 I169 -S231 -0.0424529319139646 L178 -I228 -0.0424726465860115 T167 -G176 -0.0432994835392422 G176 -R219 -0.0441730688744855 T222 -L227 -0.0442375563301542 F166 -P236 -0.0464037486832041 T215 -T222 -0.0468752168366735 L178 -R219 -0.0471161760172167 L162 -I171 -0.0484632846797286 Y180 -T222 -0.0485239730469404 V181 -V221 -0.0489389063909558 V161 -F166 -0.0501980460286298 I171 -A234 -0.0506714380866971 I173 -L225 -0.0507357072728711 L165 -T237 -0.0525933507433862 V168 -I233 -0.0577188564135458 S223 -I232 -0.0584244030776144 V221 -Y230 -0.0588189884097132 T170 -M179 -0.0589483932264301 I171 -P236 -0.0591673945674929 I171 -V221 -0.0607047228898807 A175 -G218 -0.0623721482747506 F220 -I228 -0.0639774914093629 I226 -A234 -0.0647135350139854 K160 -T237 -0.066178027258613 T222 -G229 -0.0679585268311644 I171 -G176 -0.0691025469288657 G176 -L217 -0.0702855510111116 V163 -V235 -0.0708783158568389 Y180 -L225 -0.0733095133415249 L162 -T170 -0.0740172396884686 V161 -I233 -0.0760023284842664 L165 -S231 -0.0766737672569162 I174 -S223 -0.0771639953383487 F166 -I174 -0.0772219953045896 T172 -V224 -0.0781122259814109 F166 -I233 -0.0787669399338208 T172 -G229 -0.0793044508942806 V161 -V235 -0.0805219896598549 I171 -S223 -0.0806700801766598 I169 -Y230 -0.0806833841693975 T167 -Y230 -0.0811981709558465 T167 -A234 -0.0813213555990462 L178 -V224 -0.0813740415403545 Y180 -R219 -0.082505037920892 T172 -V221 -0.0825791281584891 L165 -T170 -0.0825926167622697 K160 -I232 -0.0834466907633091 V216 -V224 -0.0842593456540843 Y230 -V235 -0.0845703444086836 I182 -F220 -0.0846231212192219 I169 -A177 -0.0853959292301187 L162 -I232 -0.085573002671353 V168 -V235 -0.0863473358739357 A177 -L217 -0.087292488467126 L178 -T215 -0.0876941197431869 A175 -Y230 -0.0891331199967054 L178 -F220 -0.0919172215885981 I171 -L227 -0.0926551198571254 L217 -I226 -0.100391808436664 T172 -Y180 -0.10140820413156 T167 -G229 -0.101507921731234 L162 -V235 -0.102516920133359 L178 -I226 -0.102619782875272 V216 -L225 -0.10471714279007 G176 -L225 -0.104855356638886 L165 -I173 -0.106126195870886 T215 -F220 -0.107764463589252 T167 -T172 -0.111684040422272 G229 -V235 -0.111889620583856 V221 -G229 -0.113054983671819 V181 -G218 -0.114434849073854 K160 -P236 -0.114908579076322 V224 -I232 -0.118007750636867 G176 -V221 -0.119813710382756 G176 -I228 -0.119948074705071 I174 -G218 -0.121900136091296 L225 -I233 -0.12381712694259 L165 -I232 -0.126826697472869 T167 -I228 -0.127610541471456 S223 -I228 -0.127970053909021 L162 -I169 -0.128389729712671 T172 -V181 -0.128897697871951 M179 -R219 -0.1290915223989 V161 -T170 -0.129410384413008 V181 -F220 -0.130629811866044 T170 -I232 -0.130666725553471 F220 -G229 -0.130770502074927 G176 -F220 -0.130995054541743 I228 -V235 -0.131881852547431 I171 -V235 -0.132122168061318 F220 -I226 -0.132573112259086 R159 -V235 -0.13343602830087 I173 -I226 -0.134403215765592 V216 -T222 -0.136895168992459 K160 -A234 -0.137250143404051 T222 -Y230 -0.138193153311868 T172 -I232 -0.138307920227496 V168 -T237 -0.138494159037184 I171 -I233 -0.138629321313122 A175 -Y180 -0.139148343013812 T172 -I226 -0.140493021766736 R159 -F164 -0.141243523111857 T167 -V235 -0.142344951856101 T167 -I174 -0.14249756856031 L165 -Y230 -0.14345264531339 I173 -Y180 -0.14410229177707 V168 -G176 -0.144606239074666 V163 -V168 -0.14466059998079 V163 -T172 -0.144857778087246 F164 -I173 -0.145403532489246 Y180 -F220 -0.14623901729954 I171 -L178 -0.146815459731498 A177 -I182 -0.14857482713324 S223 -G229 -0.150269111979352 F166 -I173 -0.152305608755023 Y230 -P236 -0.152338266373886 A175 -I228 -0.154224681587448 G218 -L225 -0.154763163183942 I173 -I232 -0.156073201976906 M179 -S223 -0.160463579712137 I171 -Y230 -0.161272404415042 V221 -L227 -0.163731530159462 V163 -T170 -0.16489092677918 T170 -A177 -0.165548341553897 L162 -V168 -0.165762232154091 I174 -I232 -0.167501460997796 L165 -I233 -0.167803967287916 V163 -P236 -0.170065007428017 V181 -R219 -0.172764957475049 R219 -I228 -0.173120836962413 I182 -V221 -0.17350885087801 L178 -L225 -0.175713314752149 V221 -I228 -0.177685627754105 I174 -V181 -0.182782550421476 L217 -L225 -0.185696545222218 T215 -V221 -0.185832613263929 L178 -L217 -0.187445409924612 I174 -V224 -0.187659722722811 V224 -G229 -0.192295989834236 A175 -V181 -0.192363056778065 I174 -Y180 -0.192635414480509 G218 -V224 -0.192809431513104 F164 -I171 -0.196608995688538 V168 -I228 -0.200875814700671 I173 -V181 -0.201773166575987 V163 -I171 -0.209068967469584 I226 -S231 -0.212370490058569 V161 -T167 -0.212984309936026 V163 -I233 -0.21353979548745 L178 -T222 -0.217497340221315 M179 -L217 -0.218933070850332 T172 -I228 -0.220486155704718 I174 -I228 -0.220727174370531 I171 -L225 -0.220962672991078 T172 -M179 -0.223736925659958 V168 -G229 -0.231562772170781 T170 -G176 -0.231954702070907 I169 -G176 -0.23353986005206 V168 -I174 -0.235707473761368 I228 -A234 -0.236399506526492 R159 -F166 -0.238773768914872 T172 -T222 -0.240415929878729 S231 -T237 -0.240623516309638 G176 -V181 -0.244287810117146 T172 -L178 -0.24545006337932 I228 -I233 -0.247904592493056 R219 -L225 -0.254335814746498 G218 -S223 -0.255577388155694 I226 -I232 -0.258861719674778 R159 -L165 -0.259056817388164 L227 -A234 -0.25984266140131 K160 -T167 -0.265332026822973 L217 -V224 -0.265349158946555 R159 -V168 -0.271577879626923 V216 -V221 -0.273046726798518 L225 -S231 -0.27386317861095 I169 -I174 -0.274483356909161 L217 -T222 -0.278101212837763 I171 -I228 -0.278134475530615 I169 -A175 -0.281670104783074 I174 -M179 -0.282019863391016 L165 -P236 -0.286722019474794 T170 -A175 -0.288833088366903 G176 -I182 -0.29158619221921 T167 -I233 -0.293581679984156 L217 -S223 -0.293778746944206 A175 -V224 -0.294026829082312 F164 -I233 -0.308374484487915 L162 -T167 -0.318806810434023 T167 -I173 -0.320009085792676 F164 -I169 -0.320048853629111 F166 -I171 -0.326989090955625 A175 -T222 -0.329848673964152 V224 -S231 -0.330298469434234 L165 -I171 -0.331272662333951 V216 -S223 -0.336926374961398 F164 -I232 -0.337506017620293 I171 -A177 -0.338318378503368 I182 -T215 -0.361786467091631 T222 -I228 -0.366449350650628 I173 -M179 -0.372188551864673 T172 -A177 -0.375084017418661 F220 -L225 -0.380572628811724 V224 -Y230 -0.380629765171831 F166 -T172 -0.381981827319953 I182 -L217 -0.382499833160951 I173 -L178 -0.390530725336622 I174 -L225 -0.392341398090616 R219 -I226 -0.392920312263925 L227 -I233 -0.403471275463366 F164 -T170 -0.405729740482743 L225 -I232 -0.407853845347757 V168 -I173 -0.448680788379594 V163 -I169 -0.46344868333202 V221 -I226 -0.46692786317094 G229 -A234 -0.478340623807948