[Mon Aug 29 17:25:51 2016] >Input file: TME5SQR1M17G.pdb >TM segments: 27-41_ 62-79_ 95-122_ 159-175_ 189-209_ 248-265 MAIDEN score = -30.0692 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 ----------- ---------------- V95 -C174 10 L97 -E171 1.2720412077508 M35 -V67 1.26572457968877 C31 -S70 1.18295355981546 I207 -W254 1.10047086836773 F208 -W254 1.02937031954932 F27 -V73 0.983154351468658 C111 -G164 0.95176567805018 W68 -F112 0.91671454856519 L97 -C174 0.91457613110756 L192 -L197 0.892543832222422 I193 -V198 0.863105954380807 C31 -T71 0.81872943333676 D66 -L117 0.781983141618483 L197 -T264 0.768948843882557 L97 -L107 0.725184537257752 V119 -F159 0.695083727333621 Y122 -F159 0.692882321431053 T71 -F112 0.676778791701839 V72 -F112 0.647960553248069 L107 -Y173 0.62756824763263 F27 -A74 0.600350339281057 V95 -G172 0.581810384429359 T69 -A116 0.578877113770991 Y122 -L203 0.578403856462993 W68 -A116 0.57634558534487 S118 -I199 0.575395495881401 G110 -Y173 0.573195410953516 N38 -I64 0.560819392807032 F99 -E171 0.542358919185095 Y204 -W254 0.538393632235857 I32 -S70 0.534650986563115 M200 -F261 0.533150511008894 M35 -T71 0.527359512564746 L107 -R168 0.506803351539004 L203 -F208 0.493928213490134 L197 -F261 0.493555816198052 C31 -D66 0.49307890552855 C194 -I199 0.491828319670273 V41 -A63 0.485869184909597 C111 -C174 0.482375035095173 Y167 -L195 0.468960677296246 V72 -G110 0.464371022770356 Y204 -S257 0.463768271506779 V95 -L175 0.458829594244335 L39 -V67 0.45862599727987 V34 -D66 0.455449723338845 E171 -C194 0.450604137051322 C111 -E170 0.447339527524903 L197 -C265 0.445484275857222 C31 -V73 0.444216292768732 E100 -C174 0.430397992223945 V28 -V73 0.410992152412069 T98 -M104 0.403491324501216 Y122 -A160 0.396892281840625 M35 -D66 0.395880722227685 S65 -L117 0.395344459897455 T98 -G172 0.381575539519109 W68 -V73 0.37643651708364 I64 -N120 0.374840411772944 L97 -R168 0.372402784290657 I32 -A74 0.369309648616377 G166 -C194 0.369204601115883 T69 -L114 0.366831880400649 H121 -L203 0.356803387971097 E163 -L195 0.355780891694796 G172 -L191 0.354792090559751 G106 -Y167 0.354646545725728 G106 -L175 0.352926000833293 L196 -T264 0.348055023478154 L114 -G164 0.338838569363792 Y167 -Y173 0.336686276117026 H113 -H121 0.33229952239016 F159 -C194 0.332176890390021 L115 -E163 0.328270798917798 F27 -I32 0.326950812149745 G110 -E171 0.326211659080816 L62 -V119 0.321583653758203 C174 -I193 0.321416138651263 W68 -H113 0.320089790202897 H113 -C174 0.315797673810377 Y167 -L191 0.31490189210909 V28 -M77 0.314020537270039 N120 -P256 0.311509661031901 V41 -D66 0.311433170482114 G110 -G166 0.310968102459054 S118 -L196 0.306065990379154 D66 -H121 0.305410213964453 F112 -C174 0.305332479414842 T69 -L115 0.30239494546294 L114 -A160 0.296204350145008 C194 -C265 0.294977784698795 R103 -C174 0.29012385392582 M35 -C40 0.289024047442952 L39 -A63 0.288886801095844 I64 -C111 0.286874325109602 E170 -L191 0.286308098768894 T71 -T109 0.285076659580655 G101 -G106 0.275060140376721 L203 -G253 0.272251849559009 L203 -S258 0.263496844474115 G106 -E171 0.262571971530249 L97 -S169 0.262358259183737 S76 -G106 0.260963448985674 L191 -L196 0.260310086082632 E163 -L196 0.258198847175405 Y122 -S257 0.25334930508924 V202 -C265 0.250717268831187 L115 -S161 0.250095599913747 H121 -P256 0.249995387887405 S76 -G105 0.249464999861627 M200 -S257 0.246935376687317 S201 -P256 0.246048146386782 H113 -Y167 0.245348501360463 C31 -V78 0.243691962129238 M104 -R168 0.242402209106967 L97 -T109 0.241121347310786 S201 -F261 0.240488617944039 L192 -T264 0.239257630046911 H113 -S161 0.238551947795862 F112 -Q165 0.235813414351234 V95 -E171 0.234340075085882 A96 -E171 0.233836957800357 F112 -E163 0.233571909707315 L33 -T71 0.23330637732622 R103 -Y173 0.233243357177382 L62 -T249 0.232904701989383 A74 -F79 0.231664362688966 G110 -S118 0.229754771785066 L97 -G106 0.22838237383837 V67 -V72 0.227405872941569 L97 -Y173 0.226849235702063 F99 -G105 0.225924020701838 Y122 -S201 0.224806707909671 T71 -L108 0.224134189128715 S65 -S257 0.223366437525021 V34 -S70 0.223334675026291 C111 -A116 0.22219657517935 S118 -L195 0.218470870973381 W68 -G110 0.216148747258773 I32 -C40 0.215098693190091 I102 -C174 0.215089660063717 T98 -C111 0.214536533157152 A116 -F159 0.21282203025071 S118 -S258 0.212645349881788 F112 -Y167 0.211616929290439 H121 -S258 0.210763711159627 S118 -V202 0.210003703183839 I193 -T264 0.208391380665119 V36 -V67 0.204357471756998 H113 -A160 0.203325998242387 L191 -M200 0.20281158982586 T98 -L107 0.20053715685885 T69 -H121 0.200093048800719 T69 -T109 0.198006453035767 F27 -V72 0.196050592325722 H121 -V255 0.194227101410541 C111 -Y167 0.192930328899033 V73 -T109 0.19291519730816 T69 -L108 0.192121670965632 C174 -L192 0.191457022849551 T69 -A160 0.191227563879163 S118 -Q165 0.190130580707033 T69 -L117 0.189034014760757 V75 -G110 0.187179906432421 S65 -A160 0.186975054321124 C31 -F112 0.185353021104026 C40 -W68 0.185079733287796 G164 -L191 0.184059542129617 S118 -Y167 0.182847828722099 E163 -Y173 0.18129701499326 S76 -H113 0.181070183893184 L117 -P256 0.179939218311185 H121 -C209 0.178086987808823 A37 -T69 0.177336191905447 F208 -F250 0.176540191287195 M35 -S76 0.176380372556324 N38 -L62 0.17561522067838 V95 -E100 0.175526597652043 C209 -L251 0.174564143406284 M104 -S169 0.174505732221813 A96 -I102 0.173975618158385 E100 -Y173 0.17348644233311 S118 -Y204 0.173377481135693 L115 -N120 0.172667793720896 S118 -V198 0.171953497919733 L97 -C111 0.171261648644076 L196 -S258 0.170920869877773 H113 -L196 0.17087779630363 N120 -Y204 0.170054979536967 L114 -H121 0.169909471935108 V119 -V202 0.169497685932792 C111 -L162 0.168520518266206 L108 -C174 0.168150813615228 C111 -R168 0.167627084963684 L62 -S257 0.167206775020746 G101 -L107 0.166875186726234 L115 -A160 0.165806048792844 V95 -M104 0.165429926501403 F27 -T71 0.16430508939919 S118 -P256 0.164049456236278 H113 -F159 0.163816392308986 C31 -L39 0.161734728008968 L33 -W68 0.160098158068214 V34 -V67 0.158213189344746 L203 -W254 0.158018866252911 Y122 -S161 0.157635036073039 H121 -E163 0.157252516226789 Y173 -C194 0.157040378908947 Y122 -Y204 0.155933195009726 I193 -C265 0.155732732266122 A29 -V75 0.155719804236607 A96 -E170 0.155166703131513 G105 -G172 0.154624496918877 T71 -H113 0.151720243412579 I193 -I260 0.15146163384619 S169 -L195 0.151307233713848 L115 -G164 0.151225831612451 A96 -R103 0.150148003352953 L39 -I64 0.149785016900016 E163 -E171 0.148182108901845 G110 -L192 0.147058209274837 V34 -L39 0.146939104669517 V202 -V262 0.144083636761897 V202 -V255 0.143908368127472 R168 -C194 0.14265989301545 N120 -W254 0.142095995527851 T71 -C111 0.141646900658063 Y173 -I193 0.141326265639606 L115 -Y173 0.141141577752103 S169 -C174 0.141080766134524 Y167 -I199 0.138825291906928 H121 -V259 0.138431040989025 V36 -I64 0.137968167171673 I32 -V73 0.136215622076805 C209 -S258 0.136166167042811 P256 -T264 0.135525528405511 V119 -S257 0.135214117101826 T98 -L175 0.134539944235568 R103 -G110 0.134327183983295 C40 -S70 0.133041286113396 T98 -G164 0.132928679869418 G105 -H113 0.132673955925318 S201 -V255 0.132128191141159 A63 -Y122 0.131663211075016 L114 -G166 0.131057148533359 N38 -A116 0.130896830694146 L39 -T71 0.130791555078979 I199 -L263 0.130460633500381 C40 -S65 0.130243092971952 V36 -V75 0.129116397350811 V73 -L117 0.128835141400608 I64 -L114 0.128832817188097 M200 -C209 0.128006340524242 V72 -L114 0.127791574219527 N120 -T249 0.127755524602912 V73 -L108 0.127722737182939 Y122 -L195 0.126014702930383 I102 -E171 0.125846046660588 W68 -S118 0.125773339198514 T98 -R168 0.124365659411048 A74 -A116 0.124362112459516 G106 -G172 0.124324102305782 V34 -M77 0.123904916259981 G110 -L195 0.123522749245794 Y122 -E163 0.12327170561733 V34 -A116 0.122668102579595 T69 -F112 0.122300924421787 L114 -I260 0.120757351442389 C194 -L203 0.120659166607537 L107 -E171 0.120592694269405 C174 -L195 0.119427200526365 Y122 -L197 0.119272260681832 T69 -S76 0.118086616054691 L117 -L192 0.117873290057422 A160 -S201 0.117803086907143 N120 -E163 0.117659305032386 L162 -L196 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