[Fri Aug 26 17:14:56 2016] >Input file: TMD3B5D6M1D.pdb >TM segments: 23-46_ 81-100_ 141-167_ 184-213_ 231-258_ 282-308 MAIDEN score = -36.4778 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 ----------- ---------------- S100 -I144 10 P157 -L189 1.89115698111857 I96 -T155 1.68241760683495 M28 -L93 1.56453585626944 P36 -L85 1.5401544453682 S99 -I144 1.45889204340221 T39 -Y86 1.251938709195 L240 -M293 1.24839730804851 S99 -L147 1.15377725876947 Q206 -I241 1.12937669470386 I96 -I158 1.04236621869275 Y247 -F285 1.00239001347666 A26 -K307 0.928983114121959 I96 -V152 0.91035651548571 Q206 -A242 0.907573321323597 Y247 -F286 0.901302078813984 L89 -Q166 0.898482788830027 L189 -Q257 0.894708235501628 L251 -F285 0.894298670198331 I96 -L156 0.859457776898434 L193 -K253 0.841097687917722 V160 -Y190 0.837846623987338 V252 -F285 0.828454752060987 I194 -Y249 0.825290204180453 I198 -L250 0.810012729020329 I96 -N151 0.745939674667063 V46 -L167 0.734969920835613 N202 -V245 0.709744029631916 T30 -M303 0.698517986790031 C98 -N145 0.684522246763396 V205 -A242 0.682205366564837 L197 -Y249 0.680234129820501 A26 -F304 0.676993325612646 G192 -V252 0.676116405404303 V40 -G288 0.671173199390843 A236 -L298 0.666248713367426 L240 -V297 0.658681747530161 E184 -L189 0.654197621237278 L251 -K287 0.646200989682473 Y35 -L85 0.644989697199101 V160 -N191 0.642953084769038 N191 -K253 0.636739364266231 M28 -A92 0.632338142446061 L33 -M303 0.612099811620532 F37 -V294 0.606490731523749 Q45 -M289 0.605716985091229 K90 -N162 0.599584997044758 A92 -W159 0.596484956537037 P248 -F286 0.593755612122911 P203 -A242 0.583493169688764 P248 -F285 0.583308568714203 R43 -G288 0.581609039539912 Q45 -F286 0.550953267274723 S209 -I241 0.547240356312211 L251 -F286 0.525080113257481 G88 -R164 0.522659930568545 N145 -A196 0.516091971901833 A32 -L93 0.50996742118115 T30 -A300 0.505948682608969 P203 -E211 0.498407786562909 T30 -A301 0.495984332666063 V160 -L189 0.493622729985165 Y35 -L89 0.489956868467683 S91 -W159 0.488780434772112 G192 -S254 0.479703885472185 I31 -L93 0.477877088132225 V46 -A258 0.476677642197551 Y247 -Q295 0.47423531024365 S99 -I143 0.46460216145664 G95 -I158 0.453180497289612 K292 -V297 0.451982841104225 P195 -L250 0.45005976021832 I237 -V297 0.446274075000456 A32 -Y86 0.43853295859911 S201 -V245 0.436931085372588 S91 -I96 0.432734866002496 A32 -L89 0.431683326375238 P290 -Q295 0.423392684429866 C98 -N151 0.420070919630581 L156 -Y190 0.418645234367633 G192 -R255 0.417064890806305 G95 -T155 0.415443885871254 I237 -M293 0.412593468689271 V161 -L189 0.408228333059397 I198 -Y247 0.397905995480964 I31 -A300 0.392964841826949 S38 -S291 0.392590455374324 F37 -K292 0.391856095302607 P36 -N87 0.389312029209508 L85 -Q166 0.387965217777079 P157 -N162 0.385774873537916 N145 -P203 0.385449178602538 C98 -I144 0.384519714755034 T163 -S254 0.384323400720369 T42 -Q166 0.37869078064765 K239 -M293 0.378121802290399 L33 -A300 0.376743872093157 C98 -L147 0.375278276293209 P157 -N191 0.37470258493034 G27 -L93 0.370255316588558 G188 -Q257 0.368118458200851 S91 -V161 0.366017820796718 T39 -L167 0.358211259263639 L250 -R255 0.35697802161121 Y86 -Q295 0.356140654770771 I231 -A236 0.353447658035766 P195 -Q257 0.351329096982764 V205 -Y249 0.350851721316623 K239 -K292 0.350552997698378 N202 -G243 0.349848035495373 Q45 -F285 0.34973619103846 P36 -N162 0.348954045657099 T30 -F304 0.348854705139951 T34 -T296 0.345459225519274 P157 -S254 0.342599146541874 L240 -K292 0.342264288599275 S209 -A242 0.341242439946245 N151 -P195 0.340514776626851 V160 -S254 0.340281629554785 Y247 -M289 0.339097046107615 V161 -Q166 0.335342305088576 G23 -E308 0.333689696965265 I158 -R164 0.333219595646636 P36 -P290 0.329948575168556 I96 -W159 0.32684035354211 K142 -V200 0.326544706527779 G243 -M293 0.324103726237368 F302 -K307 0.323645035878823 S100 -C146 0.321713969814367 E211 -G235 0.319484816801088 A32 -G95 0.318859095261029 T296 -A301 0.316607874788333 G235 -G243 0.313309104611742 L240 -T296 0.310861289753416 L156 -L189 0.30882844426493 Y35 -V297 0.307901216608601 S204 -A238 0.307659501718232 S38 -K90 0.306607971532388 L199 -T246 0.303600439374245 P203 -Y249 0.301069175219469 Y247 -V297 0.299601077176174 G27 -E308 0.299159243963413 S29 -G299 0.296005202720078 P36 -T163 0.295506873326961 G243 -S291 0.294947291038134 I153 -Y190 0.294510712354862 A92 -N162 0.294438853132914 S209 -G243 0.294334365320925 P157 -E184 0.293860877099792 Y35 -Q295 0.293372006718859 T39 -P290 0.293031443102935 T42 -P248 0.292667718057404 N141 -P203 0.290181927326936 Y210 -G243 0.289221422316531 G188 -L193 0.287629814836039 Y190 -Q257 0.286659324087877 T155 -T163 0.286385018497809 N151 -L156 0.285352307453143 M293 -L298 0.28431997412248 I194 -V252 0.282009319939282 T163 -P195 0.279695066885315 G27 -G299 0.279061900869439 Y190 -V252 0.278505470877043 E184 -Q257 0.277466040196665 A236 -A301 0.276584483950461 T246 -T296 0.276521036273676 G148 -L193 0.275234618621762 P36 -Q295 0.274601249942235 T30 -G299 0.274081203957889 G243 -K292 0.274066106579914 S99 -C146 0.273567388725042 Y210 -V245 0.270340839714947 P36 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0.229984148232755 T42 -L85 0.229805601055621 T42 -L167 0.22890708140133 N202 -S209 0.228177566794397 S84 -S91 0.227726672362281 I31 -V297 0.225037998071834 Y249 -K287 0.224410032242954 A32 -F304 0.223401187277136 Q295 -F304 0.222663241662978 P157 -Q166 0.222606922772655 S99 -S201 0.221611172701108 G88 -I94 0.220969230203029 S38 -K287 0.220516495974197 F37 -S291 0.220365309158801 T39 -W82 0.218189952891783 G97 -L147 0.218028313056793 G95 -W159 0.215312717326221 P203 -P248 0.214437445660706 G187 -L256 0.211672748700105 T163 -G188 0.209723864980425 V297 -F302 0.209656263968202 S254 -G288 0.20847757964663 N151 -Y190 0.208387363319469 Y247 -V294 0.208362699737819 L156 -G187 0.206355106704166 G95 -T163 0.20603090024226 T34 -G88 0.204842149467395 T163 -L250 0.204513216742048 S41 -S84 0.203190001831694 G88 -I158 0.201676368770804 V244 -F286 0.20087652970794 K90 -R164 0.200701032869326 L89 -V161 0.199900302560597 R43 -N162 0.199609389943171 V200 -F207 0.199595012251035 G27 -I94 0.199259658671773 S38 -N87 0.199072225531975 I143 -G148 0.198915889581783 G24 -L93 0.198534704957031 N191 -L251 0.19837554993601 V46 -L256 0.198353787846305 V46 -S254 0.198201723290828 A196 -S204 0.197915598842761 E211 -A242 0.197628501203951 T39 -L85 0.193978300615889 G27 -L305 0.193291960297694 P157 -L256 0.192338500433866 P290 -L298 0.192235372077072 A300 -E308 0.191839042827118 N162 -S254 0.191699963109321 A92 -T296 0.190877006833689 L213 -A238 0.190875732880039 V244 -M293 0.190676142258441 N162 -Y190 0.190230904512913 T163 -L189 0.190068860473835 N202 -Y210 0.189852413382238 A32 -S84 0.188703263277347 S41 -Y86 0.188450971036669 R43 -M289 0.187568726678861 L44 -M293 0.187114565358395 S254 -K292 0.186733368344449 K239 -T296 0.186422187775428 R43 -A258 0.186390634287383 Y190 -A258 0.186214419745419 G97 -N202 0.185203092900308 N145 -L197 0.185163979566491 C146 -L197 0.184936451253957 T34 -T83 0.184718813233007 G97 -I153 0.184662029206681 G148 -P157 0.184033852546009 G148 -N202 0.183822378403211 G148 -L199 0.18349999407753 C98 -P203 0.18296071999617 G97 -Y190 0.181289103151767 G235 -M293 0.181088980336151 G288 -G299 0.181049329056176 N141 -G148 0.180850440707588 S29 -Y86 0.180146103742835 A32 -I94 0.179859234168997 G192 -L199 0.179599584069068 Y35 -M293 0.179463214307153 G235 -L305 0.179211900843876 S100 -L199 0.176889423150184 V244 -M289 0.176460897537149 T30 -T39 0.175190628357294 P195 -R255 0.174447656713746 G185 -G192 0.174278232607269 K212 -A242 0.173230903898418 G97 -V200 0.172448085551181 K239 -Q295 0.17244751578728 M28 -G88 0.172113326219915 K212 -L234 0.170399511761598 L250 -M293 0.17025156232824 Q45 -G284 0.168493887981173 L33 -N87 0.168489976110462 V152 -V200 0.168479103374032 V46 -Y249 0.16844780862812 C98 -I153 0.168321747469589 Y35 -G95 0.168297157972665 L189 -K253 0.167987372433417 P195 -T246 0.167624838869765 V40 -Q45 0.16759646432806 S204 -G243 0.167125005972608 F207 -K212 0.167009051349856 I94 -I158 0.166312153082664 E211 -K239 0.16438291997553 T155 -P195 0.163797936725619 S99 -S204 0.163627171169763 V160 -G187 0.163573946505116 G24 -I94 0.163487050137906 A92 -G299 0.161636831452177 L167 -G288 0.161523442754637 G23 -G95 0.161515071556521 I198 -Y249 0.161407550339892 G97 -L156 0.16104611079719 V252 -M289 0.160332453080799 T42 -W159 0.159604413943434 T296 -F304 0.159426773060317 Q206 -G243 0.158673934267148 L283 -P290 0.158410894099466 F285 -S291 0.157500148683973 L33 -T296 0.157159981167116 R43 -N87 0.156354058695332 Y247 -K292 0.156072937317863 V152 -V161 0.155908081195146 I153 -N191 0.155898952865702 T246 -K287 0.155500186880203 F37 -F302 0.155450300925366 C98 -L156 0.155393658590761 V152 -W159 0.154977200181201 T30 -L89 0.154311696321448 N202 -E211 0.154190548454873 T42 -F286 0.154153615689933 I194 -L250 0.153986073645987 M28 -G299 0.153713704593457 S38 -V297 0.153380538118796 Y249 -Q257 0.153354060167752 T154 -G187 0.153082035445426 G299 -K307 0.152275307166578 I31 -M293 0.151891304239827 N162 -R255 0.151644635898266 T42 -L251 0.151400220280504 G27 -S91 0.150936380540263 I237 -A300 0.149963606195028 S29 -P36 0.149813432012212 L33 -K90 0.149620767285979 T34 -K307 0.14961606643909 I31 -A92 0.14911325524269 E184 -A258 0.148724872196128 M28 -K90 0.148723926390858 P203 -G235 0.147921873032942 S201 -K239 0.147576455977266 M28 -L305 0.147205964497381 V40 -L167 0.146796257057487 E211 -I241 0.146650849559438 S91 -V160 0.146405413405949 I231 -E308 0.146331526209317 R43 -Q295 0.146321339159759 G97 -T155 0.146226303827974 P203 -K239 0.146208658768963 L234 -K239 0.146186827539648 I237 -A301 0.146125884167738 T163 -K292 0.145760915619961 V46 -V161 0.145711828212235 G23 -K307 0.144406090688039 N202 -T246 0.144238609342854 N145 -S204 0.144228787570339 K90 -T155 0.143794568222838 A32 -A92 0.143621800440605 A236 -K292 0.141900772995424 T30 -K90 0.140880682400012 Y35 -I94 0.14055322504963 C146 -S204 0.140525067842523 G95 -V160 0.14048928471723 G95 -G148 0.140234122392398 I153 -V186 0.140032491037429 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