[Fri Aug 26 16:40:11 2016] >Input file: TMQ5ZRC5M1D.pdb >TM segments: 80-185 MAIDEN score = 16.2673 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 ----------- ---------------- V90 -V169 10 I81 -S87 10 V94 -V164 5.48908148036526 I81 -V86 4.11708806109948 V98 -I159 1.45849886844058 A92 -I166 1.42793170009175 E140 -I166 1.31374134503127 V80 -S87 1.17275845333297 T154 -I159 0.983453340639699 R139 -I166 0.959834557336612 I106 -Y111 0.905742963587681 D145 -L150 0.873645320668358 V93 -I166 0.873322948142658 L123 -V146 0.847371778435745 V86 -D131 0.842264620466678 D84 -L132 0.830414662320762 L118 -Q153 0.829780325356921 V100 -I105 0.828121309173056 I81 -V88 0.774455600495453 Q147 -V161 0.746429915191154 M135 -L142 0.74124052069019 T122 -I149 0.734979646514785 D134 -L142 0.721860362865685 L118 -L150 0.720587175785513 F96 -V161 0.7003483740586 V90 -K167 0.695758245325631 T115 -T154 0.676464634577286 V88 -E173 0.664482750691746 I176 -K181 0.657531221161524 V88 -L171 0.647414535074583 L123 -D145 0.640039776710031 R97 -S162 0.637453999756734 V146 -D151 0.634981214978723 A92 -N143 0.619297434115157 R97 -I159 0.615828061931545 A92 -K168 0.605270112504181 V98 -G158 0.599216894243117 V93 -V164 0.593504646518625 F96 -K160 0.587638093682532 A92 -V164 0.574120285667981 H130 -D145 0.503560575288404 V86 -L132 0.500103972930262 Q147 -N163 0.492138321458655 V80 -R89 0.491618808514373 F96 -I159 0.491373093355651 A119 -V146 0.48352592525942 T115 -I159 0.475632690966061 Y95 -Q117 0.474667985740303 A92 -V169 0.464230288528186 V94 -S162 0.462743205089825 L171 -I176 0.461186429816709 V93 -E165 0.450747637387183 M135 -Q141 0.440213290805518 R83 -L127 0.438915962475846 P101 -E155 0.4373138612282 R83 -L132 0.436110329196098 V80 -V88 0.426808457480124 V94 -V161 0.414652071367364 V99 -I159 0.398468120772062 D84 -H130 0.395497592231962 E113 -T121 0.39203449438546 V80 -G128 0.390457312976925 L118 -T154 0.38813829225186 V146 -V164 0.383716966618477 Y111 -S116 0.382741992416836 S87 -H130 0.376354386481816 L127 -M135 0.367330245501593 F96 -S162 0.360289792158574 V126 -D145 0.358921908787547 S87 -L171 0.355429766480423 E102 -G158 0.343798991540696 A114 -K160 0.339124275019513 V88 -D133 0.333763075471095 V126 -D134 0.331036458436891 S82 -L132 0.329629942860164 V100 -Y111 0.327672997290763 V88 -L132 0.322184490370738 A119 -Q147 0.32191661991988 L171 -R177 0.317208194276496 R124 -V146 0.316019033339368 R139 -K167 0.316004356535902 V90 -I166 0.314467718050137 Q147 -E155 0.312685210813171 A92 -S116 0.311329169971002 V80 -L127 0.299548447882417 V99 -K160 0.296454359328999 S174 -K181 0.294751699999008 A114 -G158 0.289074373337042 A119 -S144 0.288956370972698 V80 -V86 0.287719083875171 N85 -R124 0.287599626351143 G128 -L142 0.286765732651307 N143 -K168 0.28305000019705 V100 -G158 0.280838900613871 R124 -D145 0.276773311766435 A92 -S144 0.276726170899263 D84 -V126 0.276160819834417 Q120 -E165 0.275569437207317 D131 -V169 0.275009706669451 V126 -L142 0.27359851260137 F96 -N163 0.272809367816404 D151 -G158 0.272386305870223 N91 -M135 0.269701050528655 V90 -D131 0.265979828913263 V88 -V169 0.264149667849265 V99 -D151 0.263076063576791 E155 -N163 0.261715217820426 H130 -K148 0.259994292801441 R139 -K168 0.257850397247072 S125 -K148 0.255857250567296 T154 -V161 0.254070465852383 V108 -E113 0.253062483476215 Q107 -G158 0.249707987369149 R89 -M175 0.245533051367547 L123 -Q147 0.245412303789688 D84 -D131 0.237933569850057 E155 -V161 0.23740074729772 V126 -D133 0.232904305844029 S125 -Q147 0.232338031135555 P101 -S156 0.230431658601328 I81 -R89 0.229722440489214 Q117 -S125 0.229003936371069 D134 -D170 0.228998211049343 V86 -M175 0.228515422079745 R124 -M135 0.226735882381168 R89 -M135 0.225556626651386 S116 -S156 0.22548312955442 Q120 -Q129 0.224804104913376 Y95 -K167 0.22445936214846 S116 -Q153 0.222364389799504 N91 -I166 0.222044947693398 F96 -Q120 0.219083316134327 V93 -D145 0.217517603636524 E140 -E165 0.216795661185989 V169 -M175 0.214230018682849 V126 -V146 0.2141068573547 Y95 -D151 0.214055490346547 F96 -Q117 0.213878380204133 S116 -S125 0.213768786709154 V86 -E173 0.213260547915675 T115 -E155 0.21290686683383 D131 -D145 0.211862474572865 V99 -S156 0.208911015787974 E140 -V164 0.208769674531021 V98 -D151 0.208545519690425 I149 -V164 0.207187854464904 Q120 -G128 0.207005590887041 S82 -V88 0.206441870937733 T122 -H130 0.205250335899522 R89 -Q129 0.203794702216444 L123 -N143 0.203512940009397 S144 -K167 0.198819462908183 V99 -S162 0.198142928209386 A92 -D170 0.196370310554266 N110 -L118 0.196353815859098 D133 -K168 0.194310782155603 R97 -V108 0.193990221759795 N91 -Q120 0.192570803173119 L142 -N163 0.191672259417212 D131 -L136 0.191598290701209 N91 -R139 0.191448851888672 S144 -A152 0.188336336720233 A114 -T122 0.187745603005032 N91 -L142 0.187193455991224 I81 -L127 0.186578981057736 L150 -V161 0.186531210236128 V98 -K160 0.18615226532044 H130 -E140 0.185983685719342 T115 -A152 0.184885428925808 V80 -M175 0.183877736489796 L142 -K168 0.183605416613561 D145 -A152 0.182846679128228 L136 -K167 0.182816843702936 E138 -K168 0.180175863861907 R124 -H130 0.179960233461451 F96 -G158 0.179651150158367 R124 -D170 0.178944924801417 R89 -D134 0.17840433640047 D151 -N163 0.177746488447671 V80 -D170 0.177609789725896 V90 -H130 0.17702624721155 D131 -D170 0.17670674383701 D84 -R89 0.176498905796981 S116 -Q147 0.176404958762859 T122 -L150 0.175271889263427 A152 -S162 0.174740725768441 A119 -D151 0.174170071898058 S82 -N91 0.173355595359848 R124 -D134 0.172972647236342 L132 -K181 0.172884913890331 E140 -Q147 0.172754777444016 T122 -L142 0.172428148433584 P101 -Q107 0.172402010229034 Q120 -K148 0.171923126591022 V86 -D170 0.171077326692684 N85 -Q129 0.170068183233257 Q107 -E113 0.169006737794767 V94 -I166 0.168122681305104 Y95 -E165 0.167628551290563 N91 -S144 0.167448165151232 A92 -G128 0.16672616464398 Y95 -S144 0.165251237202606 T121 -K148 0.162036363308123 A119 -A152 0.16066862642316 I105 -T154 0.160658943940051 E173 -A178 0.158020549230733 T121 -Q129 0.157940431153246 I81 -I176 0.156852753555873 V86 -D134 0.156419991221806 S144 -I149 0.156057773531035 R97 -W157 0.155721979362532 I81 -V90 0.154927300523617 Q120 -L150 0.15457431671295 T121 -D145 0.15431312383531 T115 -Q147 0.1538464907566 D134 -V169 0.151338918707172 D133 -N143 0.150691262562862 V90 -A119 0.150517091934988 I105 -A114 0.150071055367365 L142 -V164 0.148408281567235 R97 -A119 0.148341220133199 A92 -E165 0.148281294163438 R124 -Q129 0.148023836680935 E109 -A114 0.147442801922068 R97 -Q147 0.146491437323426 R97 -A114 0.146382528297599 I105 -E155 0.145405890444089 V93 -S144 0.144915163980072 Q120 -V146 0.144582495072619 I105 -G158 0.144417644816988 S82 -V126 0.144361802964662 N103 -G158 0.14355458963603 D151 -I159 0.143249124529349 T121 -L150 0.142587656067313 S125 -N143 0.142565305326724 V80 -M135 0.14118645520442 S82 -Q129 0.140920747186684 T115 -S156 0.140638299222229 V80 -D131 0.140429772230268 V146 -V169 0.140284616435005 D133 -E138 0.139877528553997 E140 -N163 0.139382887057945 D172 -A178 0.139233857855831 V80 -V146 0.139201760249401 V80 -S125 0.138703075023102 D172 -R177 0.137699570632004 D134 -K181 0.136665178816028 H130 -A137 0.136617835049873 H130 -N143 0.135621348714984 V88 -H130 0.135068424462649 S87 -Q129 0.134508710210592 V88 -S125 0.134360860802954 I149 -K160 0.134272632073226 A137 -N143 0.134135190073843 V90 -D133 0.133358138358586 A119 -I159 0.131662151264424 F96 -A114 0.131059220697613 N91 -A119 0.130230697694056 N91 -E140 0.129742262330294 N143 -K148 0.129072210605523 T122 -S144 0.128697765744244 R89 -K167 0.128696029368549 T115 -N163 0.128283664253138 V94 -L150 0.128192603156676 R97 -Q107 0.127950318794576 Y95 -Y111 0.127688782556921 S144 -V161 0.127220525872609 I81 -Q129 0.127211413192113 V93 -V126 0.127129839859035 V80 -E173 0.126519976363231 I105 -T115 0.125888178054361 S116 -W157 0.125072093879069 L127 -V169 0.12475061636366 I81 -G128 0.124041356626721 L142 -K167 0.123654889992948 V126 -R139 0.123059671363048 R97 -G158 0.121974463746204 F112 -Q120 0.121807147753149 E102 -E155 0.121221497930112 A119 -D145 0.121011333470332 Q107 -S116 0.120921491303277 V126 -D151 0.120909204035756 L123 -L132 0.120800101043943 Q129 -I149 0.120517068614363 R124 -Q141 0.120301701849321 D131 -N143 0.120046489173234 E109 -Q117 0.119624354902742 V100 -S156 0.119311072494456 A92 -L127 0.11913585728627 L127 -Q147 0.117991284398937 V94 -S116 0.117400011983992 S116 -E155 0.116738391058436 I105 -N110 0.116385281195291 Q117 -R124 0.116098872491586 L127 -L171 0.11589932068002 A92 -K167 0.115864482115498 S144 -Q153 0.115804561681868 S82 -L123 0.11570152613529 V86 -A178 0.114319813524786 Y111 -V161 0.113744624889566 L118 -K148 0.113713543755814 A104 -W157 0.113379521212414 L150 -S162 0.113251391956433 V94 -K167 0.112249201188987 V100 -T115 0.11212253185869 L127 -L150 0.112054288983788 Y111 -A119 0.111842997670822 S82 -L142 0.111615870719674 T115 -S162 0.11158558853881 N91 -S125 0.111272055878639 R89 -R124 0.109915314238833 V90 -D134 0.109720731663017 S125 -D131 0.109581330640627 V90 -S174 0.10845557649456 A92 -Q141 0.10778808340747 V108 -S116 0.10776558924261 N110 -W157 0.106960341013652 A92 -N163 0.106678177251048 T154 -S162 0.105834499089551 I81 -R124 0.105436430654901 V90 -M175 0.105134297333274 L150 -W157 0.10452744797104 L123 -D151 0.103704429290059 A137 -L171 0.103569758144114 I106 -T154 0.102943676396258 R97 -Q117 0.102636444768348 S144 -E165 0.100814993669698 Q129 -S144 0.100811411779905 T115 -D151 0.0983622670794277 V88 -Q129 0.0982357302231927 S144 -V164 0.0980439859645079 V88 -T121 0.097954799046466 N91 -N163 0.0978776041256174 R97 -S116 0.0977840193011557 F96 -E113 0.0975104865663896 A119 -S156 0.0966676742353276 Q120 -V161 0.0965684503813244 F96 -E155 0.0965189433428071 A119 -N163 0.0958948544315383 S116 -A152 0.0953001287695161 A92 -L136 0.0949107884059243 T121 -V161 0.0945866476151753 Q129 -Q141 0.0937734770089635 A119 -L142 0.0936879147961496 D133 -L171 0.0931890825329602 Q117 -I149 0.0928518941548804 R97 -Q153 0.0918878564287642 H130 -S144 0.0917489793624573 S82 -V90 0.0914823104419771 V93 -S162 0.090950543974861 T121 -D151 0.090891957161217 N143 -K167 0.0908476622008978 K148 -V164 0.0907214735882933 V90 -L132 0.0901414062074322 N143 -S162 0.089806732986613 V93 -L118 0.0891434450207675 I149 -I159 0.0890617187052012 K148 -V161 0.0890230048645995 V90 -S125 0.0888340549501621 D84 -R124 0.0883939123178505 S125 -L142 0.0883224063239165 F96 -F112 0.0880919594278105 V99 -Q107 0.0873651181725759 V93 -Q117 0.0871030241986746 F96 -E165 0.0869813701516584 S116 -N143 0.0869454382460386 V86 -I176 0.0869094878982599 V94 -Q147 0.0866933032494526 A114 -L150 0.0862889142440246 R83 -L136 0.0859224180959981 A92 -Q117 0.0855870629835076 V94 -L123 0.0854821129261274 D145 -N163 0.0853344372256113 S82 -T122 0.0851842112620761 N110 -Q117 0.0850488945429662 Q141 -L150 0.084980369403703 L118 -S125 0.0848537237023423 E113 -I159 0.0848496522812443 E138 -K167 0.0845205021831004 R83 -L123 0.0845159661847608 V98 -S116 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