[Mon Aug 29 16:46:17 2016] >Input file: TMQ5YJI0M16G.pdb >TM segments: 37-55_ 59-72_ 81-92_ 154-173_ 176-232 MAIDEN score = 205.7845 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 ----------- ---------------- N159 -D208 10 V83 -G170 10 R65 -G169 10 L64 -W86 10 Q194 -L200 10 S204 -F209 10 R65 -V85 10 C52 -E60 10 W178 -V221 10 E180 -C219 10 L176 -K222 10 I66 -G169 10 L64 -S87 10 L64 -V85 10 C165 -K199 10 S63 -W86 10 Q84 -G169 9.05755747960586 A62 -W86 3.34314073025115 W178 -C219 2.33512062859223 E180 -L185 1.62096032421067 E180 -L218 1.57801182990029 I66 -S168 1.41917610725668 N181 -C219 1.30195068303722 I164 -L200 1.24582522553833 L192 -T202 1.22311663047755 I160 -S204 1.17635450554548 L192 -I203 1.17506191093379 I160 -F209 1.12232993750923 W178 -L220 0.995160038422145 N159 -L207 0.989277069018859 L64 -E90 0.959823606274539 S177 -V221 0.946607398931247 T191 -I203 0.905041563742063 I66 -V85 0.890261340371714 I66 -Q84 0.874981250974344 N181 -L218 0.837141997262759 W178 -L218 0.833432065159053 W68 -V83 0.826167873622803 I203 -D208 0.809206535446912 F217 -F232 0.803635660020545 T202 -F209 0.801911826667126 V83 -R173 0.801609502288387 L176 -D195 0.787418210114321 L220 -D225 0.783036545606776 L61 -W86 0.77049857948178 W178 -K222 0.7513462835112 L192 -L200 0.742178264414397 D53 -E60 0.742106326570803 V44 -Q84 0.732143088086421 I164 -T202 0.724303869055513 K42 -V85 0.707161339417478 R92 -C165 0.705575475597918 I203 -F209 0.705368564125639 L176 -V221 0.698467053732258 L179 -L220 0.697258435431815 L179 -L185 0.697246313127625 L179 -L218 0.672941610371804 C219 -L226 0.661777639957402 V163 -L200 0.659477600482824 Q84 -F171 0.654145466724712 S87 -G169 0.653625084917042 V49 -A62 0.643125812033985 T190 -T202 0.642550477705176 L176 -Y223 0.627158498353216 G182 -F217 0.624541757873815 K42 -V48 0.623141259882296 P156 -R162 0.61443938243684 V83 -F171 0.611385101920603 W178 -Q194 0.602434331039547 Y67 -G169 0.595852221789431 L179 -V221 0.594842431794864 G81 -P172 0.592484999559875 Y67 -G170 0.586676487401212 C219 -D225 0.585048336280054 R65 -V83 0.58038410855674 L64 -S168 0.577785608565611 L176 -P196 0.573383953285193 K82 -G170 0.562370975733337 R162 -I203 0.561265418848215 S166 -L200 0.557370284817879 I160 -L207 0.555929934374491 S177 -L220 0.554119382341753 F171 -P196 0.547529240305834 P158 -F209 0.546279697595839 S157 -R162 0.543391608904303 K42 -W86 0.539628234653249 R162 -S204 0.53957292865872 S193 -I203 0.534698427590648 S39 -S87 0.529813149187607 R65 -S87 0.522290949474837 D195 -Y201 0.517714553821878 Y67 -K82 0.516872957924847 S213 -F232 0.516636827348409 T167 -D195 0.510161576330817 E180 -F217 0.506563891873295 L218 -F232 0.500909031062692 F217 -S229 0.500001807022271 S157 -F209 0.495875230507945 H215 -F232 0.490542258850375 T190 -I203 0.489463186341862 Y67 -D225 0.474411981169482 Q194 -Y223 0.474298671055742 V83 -S168 0.474069206300136 R65 -Y89 0.471069235008345 E90 -P196 0.452210686811873 K199 -L220 0.448772525722258 N210 -H215 0.444225395890022 P172 -E197 0.444036606882699 E180 -T231 0.4413005000606 V40 -W86 0.439712231176262 G154 -V163 0.437717232815299 V40 -S87 0.436926991113331 V85 -S168 0.432758950330053 C219 -V228 0.427786286341815 I164 -Y201 0.424551348021056 R161 -L207 0.419957497064333 V48 -W86 0.419675035653272 K82 -F171 0.419076814843581 L179 -C219 0.414563677248678 R162 -L200 0.414323666341941 S177 -L192 0.414019612853783 W68 -Q84 0.413987052742394 R43 -V85 0.412972408062231 T191 -T202 0.410731711055631 C165 -L200 0.40540527832613 T190 -F209 0.404883614798479 S177 -L200 0.402602676398347 Q84 -P172 0.401487336372465 Y67 -S168 0.399749644248439 L61 -E90 0.399307292419804 C52 -L61 0.395136904961408 S166 -T198 0.39232162662881 I66 -V83 0.391478854725836 R43 -V83 0.385959150046433 G154 -R162 0.378957468675982 W178 -N186 0.378776520073309 V221 -T227 0.378263035654393 N155 -R162 0.377827474908489 L218 -T231 0.375941254652517 L218 -S229 0.372130801003678 E180 -T188 0.370551280084801 T41 -G170 0.369153419781425 P156 -F232 0.363838943371231 I160 -I203 0.363735491484718 T167 -C219 0.363072625486336 S63 -Y89 0.362361660428415 W68 -G170 0.357629152737984 Q69 -K222 0.357548684018338 V40 -Y89 0.357023773778153 V163 -K199 0.356684675807424 S193 -T202 0.356467108572003 Y89 -V163 0.356430826348447 L220 -V228 0.354852760965305 L64 -T167 0.354754249652792 V221 -L226 0.350234732171388 Q84 -P196 0.347397972571832 E90 -G169 0.344626961321921 R161 -I203 0.344521533223734 C52 -E90 0.341466972930485 K38 -A62 0.340421931550728 T41 -E88 0.34008263645325 V83 -Y89 0.339858928693346 V48 -A62 0.33928870531027 W178 -L200 0.336330719981522 E88 -K199 0.335726306082691 C52 -E88 0.33492246988942 S87 -K199 0.33361282491359 S51 -L61 0.333267615252252 D195 -V221 0.332810753818512 K45 -S63 0.331750446174736 P156 -S205 0.331651999906984 Y89 -S168 0.330969665919251 P156 -N210 0.327038890942403 E180 -T190 0.326613907026247 T191 -S204 0.324796191771563 W178 -L192 0.321772798018089 R162 -F209 0.320854273884063 Q84 -S168 0.319690881840381 I66 -C219 0.319557868506634 P158 -E206 0.315322047075927 Q84 -E197 0.314407986947734 G170 -G224 0.312563604618999 S166 -L220 0.309033390637383 L220 -L226 0.308600071477203 R162 -K199 0.307393746449022 R43 -V48 0.302907463246916 Q69 -K82 0.302712815350495 G182 -H215 0.302547318788316 S177 -S193 0.301178973915398 S193 -K222 0.300548361085272 R92 -T198 0.299889257743743 G81 -G169 0.298794457779143 L50 -L61 0.298432635966832 T167 -P172 0.294975820946092 T202 -C219 0.293580771790931 Y67 -P196 0.293039177245387 I66 -T167 0.291334205355038 P37 -P172 0.288864548917138 R92 -E197 0.286607967836967 T41 -W68 0.28591282986135 T167 -W178 0.285078856816292 P158 -S204 0.281493805235374 P156 -V163 0.279929216659081 F217 -T231 0.279457111595618 S177 -G224 0.2793350490267 C165 -K222 0.278812837484195 P172 -K222 0.276167922020155 L200 -L220 0.274710000728632 V49 -W86 0.272836282107036 G170 -L176 0.27192175050757 N91 -G169 0.269027651577471 G154 -Q230 0.266191032983443 T41 -V85 0.264282680273218 N216 -S229 0.26325446808501 E180 -L220 0.262980050795328 P156 -F209 0.261053233998595 C165 -T231 0.260878524191316 P158 -T190 0.260587152855233 T190 -S204 0.258565203634212 R92 -K199 0.258056848826755 S39 -G169 0.256004248830458 R65 -G170 0.254760435983184 N91 -S166 0.254378126665493 P156 -H215 0.250198635163023 N155 -S213 0.247711984756559 P196 -K222 0.247709805465643 E46 -Q84 0.247385588478724 D195 -D225 0.246765720751611 H215 -S229 0.246633746060351 K38 -E88 0.2457662162613 T190 -L207 0.24216708317225 T202 -L220 0.242107173026731 L179 -T202 0.242002432724811 T41 -Q84 0.241223732794283 R162 -N216 0.23838167917507 L179 -T191 0.237953811964629 T41 -V83 0.236683503273553 R161 -K199 0.234956813087084 N159 -N210 0.232630423899054 I164 -V228 0.23049463471453 P156 -T202 0.228381957350939 R161 -M211 0.225562396210824 I164 -V221 0.225097693033117 L50 -E60 0.224033180873978 A187 -F217 0.224002864977758 Q84 -G170 0.223363983942297 K82 -Y223 0.223349553908112 R43 -K70 0.223249471046909 S87 -P172 0.220435685256566 F171 -Q194 0.220172064112341 W86 -G169 0.219610060697186 T47 -Q84 0.219519385009224 K70 -R173 0.219391419348414 L179 -T190 0.216840852390944 K38 -W86 0.214631158293914 H215 -Q230 0.213834692418873 N189 -M211 0.212545847653582 K199 -K222 0.211109772225435 V163 -F209 0.210428997134278 R162 -M211 0.207740767476143 T191 -L207 0.207318272885354 T167 -T198 0.207234324667277 P196 -Y223 0.207136379272724 Q69 -P172 0.205628892403858 W178 -P196 0.205186696253319 V44 -V85 0.204678744638371 V163 -L192 0.201995824501839 E180 -V221 0.201902514308052 W178 -T188 0.201532998445029 I160 -T212 0.201097121972194 V40 -V85 0.200858573320366 S63 -G170 0.199821482263065 N91 -P196 0.199296170136818 A62 -S87 0.198867315303477 L192 -S205 0.198348852272449 R161 -L192 0.197955084470522 R65 -T167 0.196399454587938 K38 -C52 0.195413189760285 E180 -T227 0.19540667636352 T188 -E206 0.193352964238986 G154 -L200 0.192954145629816 R161 -F209 0.190393109854004 R161 -E206 0.189770217804079 N155 -L218 0.189311030798306 L176 -Q194 0.189071734257801 S72 -Y223 0.186200564940381 N186 -F232 0.18578172359033 C219 -S229 0.185400754112365 N186 -S229 0.185314990782703 P156 -L218 0.184614117604561 S177 -N189 0.184613125285726 K38 -L50 0.181239293237359 N159 -T212 0.180565877410756 A187 -F209 0.180312502981328 Q69 -T227 0.179960344389981 C219 -T227 0.179572624124149 E184 -H215 0.179520706685252 S177 -L185 0.179062381107935 S72 -P172 0.178883969506924 T167 -T202 0.178655591957077 K199 -L218 0.178272619970888 R43 -D71 0.177876912211733 S157 -Y201 0.176628695970465 Y54 -E60 0.174249148757265 K199 -D225 0.174157003897045 L64 -N91 0.172953775290846 G169 -T227 0.172701465781972 T202 -T231 0.171920491684286 Y89 -C165 0.170038199325758 N91 -K199 0.169405008129523 G154 -L220 0.169141613792183 R43 -W68 0.168500432101697 V85 -G170 0.167999331056083 G169 -L176 0.167859177792006 G154 -T231 0.167565040532119 N155 -D214 0.167386371124833 E180 -N189 0.167067925574673 L176 -C219 0.166180237383311 K38 -F171 0.164564287847609 K45 -W68 0.163993783208447 K38 -D195 0.163874153663977 P158 -Y201 0.163327781179799 S72 -G81 0.162894331193695 P172 -D195 0.162204218578064 T167 -D225 0.161665599278885 R92 -S168 0.161284386119512 T41 -T167 0.161079419028246 C165 -L218 0.160297820664918 E88 -R173 0.159707177141087 E60 -Y89 0.159629586158987 L64 -K199 0.159481089095115 R43 -S63 0.15934168633933 Q69 -G169 0.159151110583839 S63 -S166 0.158590348205771 T191 -S205 0.15830949777541 S87 -R92 0.158045144461862 S193 -F209 0.157741387517348 K42 -Q84 0.154602897298471 T167 -L220 0.154493743375984 N91 -D195 0.153614507053153 Y67 -Y89 0.152257452475213 L218 -T227 0.151743870180276 K42 -S168 0.151444984466483 C165 -G170 0.151110528565495 S177 -Y223 0.150963921716441 E180 -A187 0.15088257931569 R161 -S213 0.150547865197362 T198 -T227 0.150502599905404 R161 -D195 0.150184801926652 K45 -R65 0.150182647862027 W86 -T167 0.150168159697918 A62 -E90 0.149624488850639 E59 -E88 0.14942055537954 W68 -T227 0.149249858006881 N159 -N189 0.148965594969434 L176 -S193 0.148586593619605 W178 -Y223 0.148141618942311 P37 -E88 0.147156598881455 I203 -T212 0.146822784882632 N189 -D208 0.146821835432706 L220 -Q230 0.146598719644254 T202 -T212 0.146438520455708 D71 -P172 0.146176540511816 K82 -S87 0.145821730529037 Y67 -V221 0.145638216256033 D71 -D225 0.145395264240397 S177 -E197 0.144070884389291 V85 -G169 0.143546003939032 N186 -T202 0.143528695201709 T212 -T231 0.143177349543625 G154 -D214 0.143161165505926 E180 -T202 0.143036184884087 I66 -G170 0.142978527093286 G154 -I164 0.142221254848909 T198 -K222 0.141683554545781 K42 -E88 0.141619958131828 P156 -L207 0.140932368044323 Y201 -E206 0.140843924238427 R43 -Q69 0.140072773080801 I164 -E180 0.139865103543513 C165 -F217 0.139619399016089 S166 -L179 0.13919693844602 C165 -S177 0.138920018927692 N155 -Q230 0.138509748639224 T191 -K199 0.138223386809546 V40 -S51 0.137352970721026 V85 -S166 0.135427922896717 L192 -N210 0.134751174411425 S39 -V49 0.134240217777541 L61 -S87 0.131856051814186 V44 -W86 0.131793146228997 G154 -K199 0.131691430338167 S63 -R92 0.131260668862697 G170 -T198 0.131254632549689 G170 -D225 0.130894233125717 R161 -S205 0.130208197991022 K199 -V228 0.130197589999529 L192 -V221 0.130063793936374 V48 -S87 0.129840076255491 S39 -E88 0.129133148019233 K222 -V228 0.128866135192735 E184 -L218 0.128173543792922 T191 -T212 0.128161136010674 S168 -C219 0.128081739060516 S51 -W86 0.128064433956701 K45 -V83 0.128054844571114 I66 -K82 0.128002182887224 N159 -S205 0.127932833760877 K82 -K222 0.12736944069411 C165 -Q194 0.127122730070996 G154 -S229 0.127076120087853 L220 -T227 0.127075116938414 K199 -Q230 0.126659015408046 E88 -T167 0.126592710901615 K45 -K82 0.126193436608092 S63 -V85 0.126122927732993 P196 -D225 0.125929325828496 D53 -A62 0.125558701934686 C52 -S87 0.125165186505721 N181 -S229 0.125002892812037 S168 -S193 0.124615752942747 N216 -F232 0.124499051824293 K70 -Q84 0.124415650896498 E46 -K82 0.123504120550156 T47 -S63 0.123111451401149 C165 -S229 0.122845116578851 L192 -L207 0.122704336168294 E46 -V85 0.122221765472987 T188 -S213 0.121732713231959 N181 -Q230 0.120474547456441 S193 -V221 0.120304800027304 L179 -K222 0.119715318614077 R43 -F171 0.119349018894105 I203 -S213 0.119156859234141 A62 -S168 0.118488195043554 R43 -Q84 0.118084110610943 N181 -D214 0.117908503318601 R65 -E197 0.117689265841502 L200 -Q230 0.117602948292848 K45 -Q84 0.117398492070468 L179 -G224 0.117106404943795 T41 -P172 0.116593590837333 A62 -E88 0.115936674139959 S157 -L207 0.115688995836074 S168 -L226 0.115522896034545 S166 -L176 0.115401905909996 S39 -C52 0.115113717315447 R162 -T198 0.114740557661146 F171 -S177 0.114042814870456 I66 -K199 0.113432336676118 E60 -E88 0.113096638395239 I164 -Q194 0.112626365090565 S204 -F232 0.112382013266441 S205 -T212 0.112201248269348 N216 -Q230 0.111781173410591 G182 -V228 0.111647368789436 K38 -S51 0.110849683421594 S63 -V83 0.110615275803119 G182 -V221 0.110441975930009 S177 -T198 0.110378995297756 T167 -V228 0.110248734865465 G154 -I160 0.110081176893598 S213 -C219 0.109949979785752 S166 -L218 0.109920954111026 K70 -G224 0.109665475193683 L179 -T188 0.109662329643264 R65 -T198 0.109622555395964 E60 -N91 0.109596698358434 S177 -L218 0.109172758438919 N155 -I164 0.108223996563369 V85 -E197 0.108082599988172 E88 -P196 0.1080731160195 N186 -S193 0.107343846736643 R162 -Q230 0.10661445331623 V163 -T202 0.106590832713179 L176 -T198 0.106130850559927 S87 -E197 0.106013083674246 V44 -A62 0.10593528212651 L179 -K199 0.10565154272759 N186 -S204 0.104959802766478 S63 -E88 0.104593580708615 P156 -D214 0.104491681157727 V83 -L176 0.104118215440554 R43 -S87 0.104024854463581 L64 -P172 0.103253370865241 S166 -L226 0.103192488405182 T188 -N216 0.102890264955094 Y54 -L61 0.10287146448449 F171 -K199 0.101156046055667 G169 -K222 0.100973158927184 V163 -T191 0.100863413150206 R161 -D208 0.100602965505992 R92 -G169 0.100602703813263 S63 -E90 0.100208726418369 V221 -Q230 0.0997464730568043 V40 -V48 0.0994792463010228 N189 -T212 0.0993105604880125 G182 -T231 0.0993103775601077 S39 -L61 0.0986150791844054 F171 -G224 0.0984068595273575 E88 -T198 0.0974702367503895 E88 -S168 0.0972710498999727 R162 -T190 0.0970005073996577 V48 -L61 0.0969690421589 Q69 -R173 0.096744450705371 T190 -V221 0.0962388867446178 T167 -K222 0.0961322434684511 T167 -E197 0.0958202871541269 G182 -L218 0.0957546060440042 Q194 -C219 0.095435753915647 S177 -L226 0.0943486036941863 I203 -N210 0.09429238700426 R162 -D208 0.0942161692641825 I164 -L226 0.0938017842234385 N186 -N210 0.0937836442952699 F209 -F232 0.0936038623376372 G170 -K199 0.0931761452483695 S166 -T231 0.0929516088822053 I203 -L220 0.0928869042383232 S193 -L200 0.0926655532929015 S166 -D225 0.0923903697695452 K82 -G224 0.0920446693576855 T41 -V49 0.0919908835434566 S157 -T202 0.091958115758179 Y89 -K199 0.091942837570417 S193 -C219 0.091875974400231 T167 -S193 0.0917427521071512 V221 -S229 0.0912692801219408 S39 -P196 0.0910550782420376 I66 -L200 0.0909990997897968 E184 -T227 0.0904023773345979 L64 -G170 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