[Mon Aug 29 18:06:06 2016] >Input file: TMQ7JW12M1G.pdb >TM segments: 148-163_ 173-191_ 219-227 MAIDEN score = 27.8165 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 ----------- ---------------- C153 -D187 10 L151 -K185 7.00181029419826 I152 -I186 1.82259127795579 L151 -I186 1.21691451555052 I152 -I188 1.21220484665463 F154 -I188 1.02385498760822 V157 -F191 0.983944889843246 L151 -F183 0.890032146099363 V157 -R190 0.886900970007068 W150 -I186 0.863904948963508 Y155 -I188 0.828197219657599 T148 -F183 0.828106106023722 C153 -I186 0.703242861648694 C153 -I188 0.648177817365794 C153 -K185 0.593831361839958 W150 -G184 0.580726079942033 W150 -F183 0.554101653438008 Y155 -G189 0.505279251008131 I152 -R223 0.500441000762544 S149 -G184 0.4960997609202 Y155 -D187 0.495908238652725 S161 -V227 0.475372897018519 L151 -D187 0.474451181561033 T148 -G184 0.448246173366456 Y155 -C162 0.447705155505056 T178 -F183 0.436516340948227 L151 -D179 0.415995413103962 T156 -F191 0.389300955877793 S149 -F183 0.384158844487967 N177 -K185 0.381977137751714 N177 -K182 0.354381800291781 H180 -K185 0.342942056600368 C153 -K182 0.330644103368552 F154 -G189 0.31787650282207 C153 -H180 0.31606228086784 C153 -C226 0.304057720003208 C153 -V163 0.298949276590474 E220 -P225 0.290246966175827 F154 -R190 0.283323427339048 S161 -P225 0.278036884767216 N159 -G189 0.275461459897032 N159 -C226 0.275086020876293 Y155 -R223 0.274981525569568 S173 -K182 0.271510572377522 T156 -C226 0.268334024827089 C153 -R224 0.233036368933639 D179 -G184 0.229920889712148 T148 -T178 0.229744759495907 C153 -G184 0.226831122860752 P160 -P225 0.226341184065049 T148 -T221 0.217062179785186 C153 -R190 0.216351547178521 C162 -R190 0.209823567852069 F154 -V227 0.196062312518437 L151 -K219 0.181935251675546 S149 -N177 0.178012904184023 D187 -R224 0.177910015385529 D187 -R223 0.176983036265769 A174 -D179 0.168346248561808 T156 -G189 0.165637928559359 T148 -H180 0.160718818966405 W150 -D222 0.157951267354319 T148 -D179 0.15069667349997 W158 -R190 0.141983864250676 S149 -H180 0.141191768915938 N177 -G184 0.136859768609336 T148 -I186 0.133025872114452 D179 -D187 0.132905839362091 C153 -Y176 0.132443152335728 G184 -T221 0.12621630946017 C162 -I186 0.122564016039007 V157 -I188 0.120117199803275 C153 -N159 0.117924542650566 Y176 -I186 0.117750013862112 I152 -K219 0.117167634131126 W150 -I188 0.116424236195373 E175 -K185 0.11172843802392 S173 -L181 0.110217533053357 T148 -K185 0.109512060284762 C162 -R224 0.108116691615197 S149 -T178 0.10790126234046 C153 -P225 0.106231015670232 T156 -V163 0.102611856114867 T178 -K185 0.0999057510020709 Y176 -L181 0.0913402751804018 W158 -F191 0.0850242157537915 W150 -R223 0.0829056161807729 C162 -D187 0.0818499163973321 C162 -G189 0.0810810752930369 L151 -E220 0.0809538097429261 W158 -G189 0.079475787558156 D179 -K185 0.0784090933691756 I152 -H180 0.078000976090405 I152 -D222 0.0770030736720886 W150 -T178 0.074801429585138 W150 -K182 0.073474499915763 C153 -D179 0.0643516212184938 D179 -I186 0.0583893600473284 W150 -G189 0.0561944792750582 E175 -F183 0.0538114489956478 P160 -V227 0.0535099943493189 I152 -F183 0.0530876165447345 N159 -V227 0.0489513427433503 W150 -E220 0.048191515640476 T156 -I186 0.0476532659664843 F154 -E220 0.0457812484896678 S149 -D222 0.0457651912841371 T148 -K219 0.0438806253898514 F183 -T221 0.0427689026411695 E175 -K182 0.040355720703448 L151 -K182 0.0398452721840741 W150 -K219 0.0302931497860186 C153 -S161 0.030027842698185 D222 -V227 0.0228427015492692 I186 -R223 0.0222212668015034 T178 -G184 0.0171583890227738 S149 -I186 0.0136381205855196 I152 -D179 0.0124085072892952 S149 -D187 0.011432919233422 L151 -G189 0.00625800820596822 S149 -K219 0.00495301755636168 V163 -V227 0.00403630422764611 C153 -F191 0.00399267489228006 I152 -V227 0.00107575345004651 V163 -C226 -0.00376189979062147 W150 -Y176 -0.00591587712313157 C162 -I188 -0.00710729629117934 N159 -D187 -0.00853872843498849 Y155 -S161 -0.00880072484653346 I152 -P225 -0.00980015297319048 L151 -C226 -0.0119494097427795 E175 -H180 -0.0136456306194743 F154 -K185 -0.0152453891091726 T156 -V227 -0.0186123784041907 F183 -D222 -0.0190465315516608 Y155 -V163 -0.0211448071394829 N159 -I188 -0.0212526083689983 Y176 -G184 -0.0217455638385275 E175 -G184 -0.0230645381968677 R190 -P225 -0.0232892505189652 F154 -S161 -0.0235609985118939 K185 -E220 -0.0245175268215676 S149 -D179 -0.0255766818579723 S173 -T178 -0.0262022733163927 S173 -F183 -0.0290811795388766 T178 -I186 -0.0318637007813791 W150 -D179 -0.0326166374357833 C153 -T221 -0.033348953969611 A174 -H180 -0.033966533859326 N159 -R190 -0.0346444765344116 I152 -K182 -0.0360690385828488 C153 -F183 -0.036579443315615 T148 -K182 -0.0379656670947424 L151 -N177 -0.0382493514820794 T156 -P225 -0.0387205377532904 F183 -E220 -0.0407999922789513 W150 -D187 -0.0415195238724838 F154 -D222 -0.0416996490399972 F154 -V163 -0.0473281541852861 W150 -L181 -0.0485924343781612 Y155 -K185 -0.0507151283710643 I152 -G184 -0.0510184440364441 L151 -Y176 -0.0517645528546238 T156 -R224 -0.0518135523705785 T156 -D187 -0.0533461744704855 I152 -C226 -0.0540741711698329 E175 -V227 -0.0562462870577165 A174 -F183 -0.0572274847552769 A174 -K182 -0.0578516660247295 I152 -R190 -0.0578736350020845 L151 -R224 -0.0583805957876908 L151 -I188 -0.058879327726225 G184 -E220 -0.0598779853487157 T156 -R190 -0.0602010044004642 I188 -P225 -0.0617485468205867 S161 -R224 -0.0620962066818382 L151 -T221 -0.0651689801693802 I186 -F191 -0.0667944727785263 P160 -C226 -0.0674585546448938 N177 -F183 -0.0681191937684201 I152 -Y176 -0.0732028661338693 S149 -E220 -0.0734004828595824 F154 -C226 -0.0736425884588865 F154 -N159 -0.0753453801085955 L151 -H180 -0.0760149208643407 S173 -D179 -0.0771581228209717 W150 -T221 -0.0803811641357868 Y176 -D187 -0.0809630664076479 L181 -I186 -0.0814363353721985 L151 -P225 -0.0842324495160254 S173 -K185 -0.0859385862436932 V157 -V163 -0.0860615776748714 L151 -L181 -0.0880915450208271 K219 -R224 -0.0881401954122696 S149 -R223 -0.0918245249510383 F183 -I188 -0.0925243101501425 E175 -L181 -0.0936792821517161 I152 -F191 -0.0987712814387791 P160 -R190 -0.100441721880682 I152 -L181 -0.100971861260947 N177 -I186 -0.101211047819326 Y176 -K185 -0.102141882012282 N159 -P225 -0.11010021269135 C153 -D222 -0.110702932295276 L151 -V227 -0.110909125175169 V157 -D187 -0.111696135622332 S149 -T221 -0.111951782782637 L151 -D222 -0.11854932224729 C162 -C226 -0.121040823763789 I186 -E220 -0.121073887557579 F154 -G184 -0.124843802758755 W158 -D187 -0.128243138495292 S149 -K185 -0.128401190071958 C153 -W158 -0.135340939195554 W150 -N177 -0.136839394522847 Y155 -F191 -0.137043052394098 F154 -P160 -0.138363650355863 Y155 -I186 -0.138446695431443 L151 -T178 -0.139349732210202 L151 -E175 -0.139555714184743 C153 -P160 -0.143506149010166 Y155 -V227 -0.145100326907973 N159 -F191 -0.146653800914088 Y176 -K182 -0.149058525543684 Y155 -R224 -0.150237509992889 I188 -R223 -0.150529257932541 Y155 -P225 -0.15150672431905 C153 -V227 -0.153496913115017 I188 -E220 -0.155530331146216 W158 -V227 -0.157075432783879 I188 -R224 -0.166287357428285 W158 -I188 -0.170255546133094 I152 -T221 -0.170586070468441 Y176 -F183 -0.17258106943302 S173 -H180 -0.181668227876094 W150 -R224 -0.186120199707071 S149 -K182 -0.190646611363814 I152 -G189 -0.192141608476094 I152 -E220 -0.192239982069903 Y155 -P160 -0.195221338774202 F154 -R224 -0.195272459183788 C153 -C162 -0.197166987055746 L151 -R223 -0.197996275321968 C153 -G189 -0.202307572576273 V163 -D187 -0.203959361425539 W158 -V163 -0.206650090012386 A174 -L181 -0.214008699374239 T148 -E220 -0.216171494596246 I152 -C162 -0.220753112472011 L151 -G184 -0.22169867811328 I152 -K185 -0.228475114445841 Y155 -C226 -0.230394377438863 F154 -F191 -0.234791117895053 T156 -S161 -0.237883040604292 F154 -R223 -0.238846037256744 V157 -G189 -0.242466166126585 F154 -P225 -0.255042372792242 C162 -P225 -0.272076361012393 I152 -D187 -0.291506186582602 S149 -L181 -0.293534101197599 T148 -L181 -0.295329650338267 W158 -C226 -0.300553257859983 C162 -V227 -0.302594460885664 F154 -C162 -0.3058051372577 T156 -C162 -0.308167295459515 F154 -I186 -0.308428366080008 H180 -D187 -0.308489133665339 T156 -I188 -0.326129790000637 W150 -H180 -0.342474265113591 C153 -R223 -0.358467138469994 I152 -R224 -0.363464418332185 W150 -K185 -0.371868299339805 C153 -E220 -0.401155838840189 F154 -D187 -0.438799488461899 H180 -I186 -0.462391050454374 S161 -C226 -0.511910182818549 V157 -C162 -0.523855540104924 Y155 -R190 -0.632874692293856