[Mon Aug 29 17:37:58 2016] >Input file: TMD5AER1M2G.pdb >TM segments: 6-33_ 95-167_ 184-209_ 247-282_ 428-440_ 527-541 MAIDEN score = -56.7070 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 ----------- ---------------- Y199 -T247 1.22443247343742 I21 -L95 1.2233626198868 I192 -L258 1.02613929394237 V100 -F146 0.972332520577418 Y14 -I99 0.827045270126185 F96 -T151 0.790920378933586 I21 -F96 0.752849636638702 I25 -T155 0.734121554104965 F18 -T151 0.729988721129663 I131 -S208 0.72017923123478 V100 -N147 0.714483788961536 F22 -T155 0.712335940865495 D138 -Q204 0.697642188523147 T200 -T248 0.683225062662496 S196 -G251 0.646617208541195 G129 -S208 0.631012484220833 Y199 -K250 0.597951757328747 F22 -Q152 0.595375483435194 R134 -S208 0.568477292317851 D130 -V207 0.565167815022015 F18 -L150 0.546258546850849 F96 -N147 0.539585226679762 A188 -F261 0.539353165418101 F18 -F96 0.536969347407191 F135 -D140 0.535038187646602 D130 -A205 0.530656672551491 L118 -F123 0.525124885942029 H126 -I131 0.524179668983422 V26 -T155 0.520772119774536 F123 -D128 0.517584016260528 R13 -I99 0.511283122853078 D130 -F135 0.507896167037523 F146 -T151 0.505968306956701 L111 -F135 0.492790465227949 A185 -M265 0.479829858804324 A185 -M262 0.479748357670917 S17 -L95 0.472530476532921 M107 -L139 0.471265553880671 F11 -S103 0.470657623793806 Y10 -R106 0.465854648039499 S133 -V207 0.463107748329592 K202 -K209 0.457879066768896 F18 -I99 0.455031353174118 I274 -S279 0.443773314086452 T104 -Q143 0.439164046867743 S196 -G255 0.434890670790868 G129 -K209 0.423558508246691 Q152 -Y160 0.421860852898391 R108 -L139 0.420295155246131 L189 -R194 0.418286364454787 K529 -M534 0.407527199047544 Q204 -K250 0.404874968804968 I192 -M262 0.403818137459092 Y199 -T248 0.395343970540397 H126 -S208 0.394957862235996 K529 -E535 0.393799524608505 T104 -L139 0.384139685509963 A206 -T247 0.382769278850867 H102 -D140 0.381310557430576 S17 -H102 0.373133642579614 Y14 -S103 0.369961851532348 Y199 -G256 0.358153130750512 A145 -L150 0.355634477871169 A188 -M262 0.345154915666119 Y10 -M107 0.343988403514987 N141 -R197 0.341199330892958 R108 -N141 0.337196975102077 R13 -N105 0.33279602279857 S149 -V154 0.330171373628542 G129 -A206 0.329241039402491 I187 -M262 0.326206339990208 R106 -L111 0.31993878911219 R108 -D138 0.3195867009679 K15 -H102 0.31688249230642 R108 -T136 0.316587610988429 L132 -S208 0.315442671792526 S103 -A145 0.31387336903554 I530 -E535 0.313655947681832 H102 -G110 0.309029495904896 L132 -S137 0.306588567995138 G256 -G264 0.305758979344347 V273 -S278 0.292819389489111 G110 -L139 0.290713438559659 L189 -M262 0.289250720081655 V26 -Y160 0.289151477815374 G129 -S137 0.288966026643156 F18 -L95 0.27926183408769 M107 -Q143 0.277236937380998 D128 -V207 0.273908667929756 V120 -D128 0.273427239158732 I21 -T151 0.273417114997573 R134 -D201 0.270952060020767 Y199 -Q204 0.269071376600107 R108 -F135 0.268354608637847 V20 -L95 0.266696275615709 I272 -G277 0.264297829507656 H126 -S133 0.261193138517417 G113 -F135 0.258264917747847 S133 -Q203 0.256873463126076 R134 -A206 0.254073369423289 Y199 -R252 0.252045548729195 D128 -D138 0.250661137388946 I257 -M262 0.248747841831708 S133 -K202 0.248711960782001 S196 -Q204 0.247984412758971 S149 -N156 0.246934768000327 A101 -K109 0.246791739085761 A188 -R194 0.246528626754275 D130 -D140 0.246475023353982 T97 -Q152 0.246077492703294 R194 -D201 0.244652623865014 Q531 -R541 0.244502136586818 Q203 -G251 0.244161906449713 T200 -L253 0.242222678446333 F112 -F135 0.238908561630233 T104 -D140 0.238134411343813 K127 -A206 0.238108333421439 S17 -F96 0.238014598037658 Y14 -A101 0.237000693677337 S196 -F254 0.236260626664396 N141 -Q204 0.235190739157806 R106 -K114 0.235118786865119 K15 -R98 0.234910078032448 M107 -R134 0.234819538614028 E535 -R541 0.231081550427765 F11 -A19 0.230954961612609 Q203 -F254 0.230522760012048 I21 -V154 0.23012420021575 R134 -K202 0.229778045143731 S103 -S149 0.228617366097398 L189 -G255 0.227639152326869 D138 -K209 0.227253530115605 T29 -Q152 0.22608894687833 D130 -K202 0.226088929100192 V26 -I157 0.224733907692197 Q143 -Q204 0.221094714548677 R194 -Y199 0.220610731876283 R108 -K114 0.220375174553314 D140 -D201 0.219340803013264 N269 -G277 0.218062384213189 K109 -D140 0.216615392327439 K198 -K250 0.208564557018661 R13 -M107 0.206851835246533 A101 -Q143 0.206624299632225 S103 -S137 0.206283666598317 R98 -N144 0.205467767814817 N105 -G113 0.20485754316439 I25 -T151 0.204816255773798 F7 -M107 0.203912477991913 G264 -A271 0.203603081456969 M265 -V273 0.203532779010966 I25 -T97 0.203011909171257 A188 -L258 0.202935359761825 K109 -R117 0.200137694306691 W8 -I142 0.199531731081839 N105 -D140 0.197837291666336 K15 -I99 0.197636494524434 K114 -R134 0.196839087400255 M107 -L132 0.194785061185294 V190 -L195 0.192185193490906 G255 -N263 0.191323416394443 T104 -I142 0.189742122983796 A101 -T136 0.189722655772505 Q204 -F249 0.186820857885649 R134 -K209 0.185485926278309 F261 -V268 0.185052001076232 A28 -T151 0.184204074371167 N263 -T270 0.18396236404552 V191 -L258 0.183789996635467 K250 -L258 0.183240582080665 F135 -Q204 0.183115992701105 F11 -N144 0.181644108543979 F18 -Q148 0.181493799114839 F6 -F11 0.18066358187738 V100 -S149 0.178962042247969 G129 -Q204 0.178866755308292 L195 -G256 0.178461702045003 N144 -L150 0.178072203382289 G110 -L118 0.177865191767576 R134 -Q204 0.177861296454156 R117 -D128 0.177684725280367 S103 -L150 0.176055752260788 L115 -H126 0.174995388781386 I21 -A28 0.174735581461865 G129 -A205 0.173863906482048 L115 -K127 0.173687465353545 I142 -T151 0.172544773326631 T136 -A205 0.171841421917494 V20 -V154 0.171440969967347 F96 -A145 0.17012448869656 A19 -I99 0.169923743348431 A27 -T151 0.169836568369366 N105 -F146 0.168730936727439 L115 -S133 0.168418940439169 I433 -I538 0.168360730462979 R13 -A19 0.168038176154413 Y160 -S266 0.167957888174552 Y14 -M107 0.167818843851895 T247 -G255 0.167557514648734 K198 -Q203 0.166544249092126 L186 -G264 0.165315548437883 W8 -T104 0.165061142229904 A188 -S196 0.164604378048269 F261 -N269 0.164038637136724 R108 -S133 0.163830178799296 A27 -G162 0.163621292888059 G432 -A539 0.163302471565407 L111 -R134 0.163082983526376 K209 -T248 0.162401061813858 I99 -I142 0.161804576812894 A28 -G162 0.161636831452177 I21 -I99 0.161560245079524 D128 -T136 0.161383113510726 E116 -R134 0.159707177141087 K127 -L132 0.158822401052707 G113 -T119 0.158130651521501 I25 -A158 0.157607587069486 A185 -S266 0.155300955109487 I192 -I257 0.155192569020207 F7 -N147 0.155105353241234 R106 -R134 0.153874228647577 V191 -Y199 0.153386017305064 K114 -F123 0.152126479280601 T119 -K127 0.15210160892186 R106 -D138 0.150566135539127 R13 -A101 0.150383462067064 F123 -G129 0.150135314145891 S137 -K202 0.150018099628035 I193 -K198 0.149977223239027 K202 -K250 0.149354791386523 V190 -R197 0.149264405834126 L115 -G129 0.14900880589927 V100 -I142 0.148882803991059 T29 -T151 0.148319105419526 T29 -L159 0.148282115177292 V184 -M265 0.147417071759569 K15 -L23 0.146799780913193 R134 -Q143 0.146413931372564 K114 -L132 0.146310183931608 N144 -Q152 0.146267769513971 V164 -V273 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0.115425161762447 L118 -S125 0.115314303580511 S17 -N147 0.115262216258823 L189 -L258 0.114552274292441 L195 -L253 0.114515434712829 S17 -L150 0.113879088893559 L23 -T155 0.113822675569279 S266 -V273 0.113207304158396 N105 -L139 0.113186078012455 W8 -S149 0.113084288839826 F7 -N105 0.113066701876233 A27 -A158 0.112778263913594 K114 -D128 0.111574672017778 L23 -L159 0.111569277971271 W8 -L16 0.111451788912433 K109 -R134 0.111044647223197 D138 -A145 0.110764843842162 V207 -G251 0.110597899774683 W8 -R106 0.110576442866881 R428 -I433 0.110125999503771 I142 -N147 0.109852992999925 A185 -P260 0.109796035687834 K109 -T136 0.109677354063865 K12 -T151 0.108970220679188 Q203 -G255 0.107932101724044 I192 -R197 0.107862556985304 I99 -Q148 0.107463291730775 A533 -G540 0.106734885600702 R13 -R106 0.106692922449136 I187 -G264 0.106368974372032 Q204 -K209 0.106340016814814 A145 -V154 0.105505738844608 S137 -V207 0.105404089979663 M166 -V273 0.105390712673222 A19 -V153 0.105337254606076 A185 -F259 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