[Wed Nov 23 04:08:36 2016] >Input file: TMQ9UBS5E15D.pdb >TM segments: 111-127_ 151-168_ 186-205_ 230-252_ 292-321_ 323-339 MAIDEN score = -35.6796 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 ----------- ---------------- E317 -I329 1.29546685273348 A308 -K318 0.939204334116793 F112 -V164 0.889506429687713 K318 -I329 0.83408952503671 F293 -T339 0.832738414441896 W188 -L245 0.819717232440623 L307 -I319 0.801535423008554 L196 -L299 0.772870190323708 T203 -N320 0.76034812417871 K318 -A328 0.736153177050804 S195 -L237 0.721306520941475 K297 -L335 0.718555046991949 L192 -Y296 0.677849146527682 S119 -G156 0.648396029700907 L301 -C336 0.628587372674811 A162 -L196 0.613846130202258 L300 -V332 0.590968827867908 S116 -L159 0.578943750479955 I123 -V155 0.575206427496635 V115 -A160 0.573902917712036 Y198 -L237 0.572273931566384 A162 -F194 0.564829457170915 S195 -L299 0.561271299946497 I205 -S315 0.558709463188174 A308 -Y330 0.557601260863289 L111 -P166 0.545476177759716 G304 -Y330 0.544124641184184 I123 -A154 0.542340861821489 L301 -L337 0.538994319325123 L230 -V325 0.528634691141036 T203 -D321 0.521096373609964 V115 -L159 0.520949620067856 A154 -Y198 0.520084458013168 F112 -L167 0.514836523230133 S200 -L303 0.507723668380707 L300 -C336 0.489358707850293 G304 -K318 0.486773712825854 S119 -S158 0.485526246580543 K318 -M327 0.475582162851562 S119 -L159 0.454667709502445 E317 -G326 0.452429880413808 E317 -V325 0.444011772760819 I292 -K297 0.442143182467542 L159 -F194 0.440452899919179 L307 -T316 0.427503611328896 F194 -L237 0.420878565745661 L190 -D241 0.417996831481608 T203 -I319 0.398464307128579 V115 -A162 0.395672072687676 K312 -N320 0.39427429217616 V115 -L190 0.392640622506099 S195 -M240 0.391670879258737 C157 -K204 0.386591232078551 A308 -I329 0.382470661682638 M201 -I319 0.378898453354248 F202 -I319 0.368603704286574 L189 -G295 0.361409130172215 L300 -L335 0.359278750633863 W188 -V242 0.356779775116173 L187 -T244 0.353753071816811 K204 -I319 0.350566579076437 S158 -F194 0.348862958608131 S119 -A160 0.342913732823417 Y198 -G239 0.341737186159495 Y231 -V325 0.341315376334544 S116 -A160 0.337584050991031 V234 -D241 0.336091959307733 S116 -A163 0.335631430505686 G199 -L303 0.335507517944362 L192 -L299 0.326345260342445 G191 -Y294 0.325260894403807 K204 -K312 0.324016927482424 S114 -A160 0.321941324218106 G304 -E310 0.321919969215664 K204 -A308 0.32056043117134 G326 -A333 0.31872377200446 F194 -D241 0.317342431499665 A154 -G199 0.313679758360856 G191 -M240 0.310162700912395 V117 -C157 0.306944196547309 L159 -Y198 0.305846824028605 A154 -S200 0.301486002904638 L111 -L167 0.29953582346591 V242 -Y294 0.298800417915075 L196 -L303 0.29694424590165 S114 -G193 0.294328998250586 S119 -G191 0.292636840454708 L159 -G199 0.28986138600765 G295 -L302 0.289181838438335 L111 -A163 0.288460922865465 G122 -S195 0.28717952941928 G197 -G295 0.284688083592396 M201 -V238 0.284006063006951 W188 -W248 0.283868696735959 A154 -L159 0.281977276481292 L187 -G295 0.281692025340992 A154 -A162 0.28070771919189 F194 -G199 0.28050042507363 A308 -E317 0.279822957259688 L161 -G168 0.279646232659974 L118 -L159 0.278252188062251 N151 -M201 0.27619283680799 L303 -K318 0.272867077724753 L300 -A333 0.272746116918936 V234 -D321 0.272563478071876 G193 -G239 0.272327690141712 E310 -E317 0.270903469694593 A232 -K318 0.269753375538663 L192 -G295 0.26884911228735 L301 -V332 0.264065370712613 K297 -T339 0.263632516291937 S120 -N151 0.263330186061893 G295 -C336 0.259246486881182 L121 -G156 0.257625327292236 L303 -A333 0.253843138969277 Y231 -D321 0.25367250784406 A162 -G298 0.25359939759115 S200 -Y231 0.253339443037598 T153 -S158 0.252826024809662 D241 -Y296 0.240229280162785 W188 -G295 0.239865869483367 G191 -L245 0.237564035952812 Y296 -C336 0.234590079627257 P166 -Y294 0.233349094808155 L196 -G298 0.230509842446904 L118 -L190 0.228026207539674 G191 -V242 0.226632070606707 P166 -L299 0.226291994091833 V238 -G298 0.220489880187701 K318 -Y330 0.21859360450145 L230 -D321 0.217991355183912 L236 -D241 0.217620178350772 V155 -G197 0.216295258840183 S116 -L121 0.215633624287806 Y309 -E317 0.215573494403199 I305 -A333 0.2147577540971 G199 -L299 0.214028387026127 S200 -V234 0.213480258349057 L111 -G168 0.213463174285188 A126 -S195 0.213127451224212 F194 -V234 0.21176812091779 E310 -K318 0.21095940919116 L299 -V332 0.209752063569313 F165 -G298 0.209504524939613 Y198 -G298 0.208510670024112 Y294 -T339 0.207260046870303 F194 -M240 0.206193716788686 I205 -T316 0.20547582536147 L121 -V155 0.203324590321611 W188 -D241 0.202822104641043 P166 -G191 0.202803545384192 L152 -M201 0.202024753116632 E317 -R323 0.201969019848542 G235 -N320 0.201700534293797 G304 -I319 0.201508549740548 L196 -L302 0.200565688659222 P166 -S195 0.200518441676957 S200 -L307 0.200077688878508 G235 -D241 0.199131748472953 G199 -A232 0.198487847454107 A308 -D321 0.198024240320961 M201 -L299 0.19669599196658 G304 -T311 0.196260442102367 S120 -V155 0.195978888400393 G197 -V234 0.194279025453057 F194 -V242 0.192974018411165 W188 -Y294 0.189258052702033 L159 -G193 0.187757560305019 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0.171058878916686 G193 -G235 0.170958219503602 S119 -L192 0.169253851646041 Y198 -D241 0.169077107582384 G199 -Y296 0.16902312274805 G191 -I247 0.168787108815122 L307 -I329 0.168732421909136 T153 -K204 0.167618586690244 A160 -G197 0.167553958865647 L303 -G326 0.167433158574665 A232 -G326 0.166404272872517 G199 -L237 0.166339345168534 L307 -N331 0.165907156824799 L189 -D241 0.164441471591556 A154 -G191 0.164235169958323 G235 -L243 0.164191947979511 T316 -A328 0.163909489923115 K204 -F306 0.163813742818516 Y294 -C336 0.163271402333606 G168 -G197 0.163172649978241 E310 -Y330 0.163086581629613 G199 -G239 0.162787960046167 W188 -L299 0.162021457264978 G199 -G298 0.161215891044106 S119 -V155 0.158752137609381 Y309 -M327 0.158721772908413 V115 -G191 0.158584414908237 G295 -A333 0.158085024383 L189 -G197 0.15808067150712 S114 -F194 0.157586540248962 S200 -V238 0.157397845639346 N331 -I338 0.155904807450632 L192 -T244 0.155787513894966 L121 -C157 0.15527340953788 F194 -G295 0.155088720282722 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0.13655019560585 A163 -G298 0.135762637923265 G199 -L301 0.135359714265157 P166 -L190 0.13490623970321 G122 -G197 0.134666498074205 D321 -G326 0.133654050809266 G304 -M327 0.133249421067718 L245 -Y294 0.132657482766455 L301 -F306 0.132607216733728 I305 -I329 0.13204474259136 M240 -G295 0.131557119245099 W188 -G298 0.13148663674382 L190 -Y294 0.131376178043479 I205 -K318 0.131318289745653 S119 -V124 0.130333136016276 L167 -L189 0.129979064685009 T203 -G235 0.129911084349725 E310 -S315 0.129525215773794 Y231 -Y330 0.129480665799711 Y309 -V332 0.129324862774264 G156 -G199 0.129123075784093 S200 -V325 0.128902912745202 V155 -L161 0.128797292878118 T311 -N320 0.128658746228323 I205 -K312 0.128559921823479 Y198 -Y231 0.127733991545414 G191 -G298 0.127684277481432 Y231 -E317 0.127575176477575 L299 -G304 0.127531327961078 N151 -T203 0.127477337935708 L230 -N320 0.127198347006291 T244 -I292 0.126814579176341 S158 -M240 0.126523755979691 L192 -G197 0.126026682030374 V115 -G197 0.125729596783875 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