[Mon Aug 29 17:09:12 2016] >Input file: TMQ8Y3B8M1G.pdb >TM segments: 212-227_ 261-275_ 283-289_ 294-300_ 329-346_ 526-562_ 575-593_ 597-604 MAIDEN score = 260.6449 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 ----------- ---------------- E215 -N331 10 D583 -V604 10 Y580 -L602 10 R582 -V604 10 Y216 -G221 10 L266 -L296 10 A284 -K581 10 E579 -L602 10 D583 -I603 10 T214 -N331 10 E579 -I603 10 L285 -Y580 10 D528 -A555 10 L285 -K581 10 T214 -L330 10 G283 -R582 10 A576 -D583 10 G218 -Q224 10 A576 -H584 10 A284 -S300 9.24196983449303 G556 -A589 5.81929223559331 I217 -Q224 3.5753549271617 I577 -I603 2.19243152418621 I527 -A555 2.11064018237339 Q562 -H584 1.89179540406823 I288 -I598 1.88761868535842 L586 -I603 1.85635834219644 L285 -E579 1.83363397532296 A585 -V604 1.71308440361863 E215 -L330 1.66537503896443 E289 -I598 1.59440908077335 E215 -L329 1.43739075642487 I222 -E227 1.31302672750849 L285 -V299 1.29618795382012 I288 -L296 1.25798794384983 I577 -L586 1.23346164823189 Y552 -T593 1.21187732536202 F590 -I598 1.20733329776727 L266 -I295 1.19289020195983 Y338 -I577 1.17066720544821 T558 -F587 1.16933945329701 L586 -L602 1.14572258715264 Y580 -I603 1.10652652049594 A576 -R582 1.08057927729519 P578 -I603 1.04456041564795 K531 -V537 1.0401781763505 K531 -A554 1.02719167187051 T214 -L329 1.02583106642896 Q562 -H575 0.998042096528659 L285 -L602 0.980468063351498 E588 -A599 0.917924024999334 A274 -K581 0.905060912947388 F587 -L602 0.903496728586766 D583 -L602 0.895213573101602 F590 -V600 0.894541526554538 T560 -A585 0.851596128643996 R532 -V537 0.845751174478322 L285 -I603 0.840756795906468 T343 -F587 0.829412209917902 P339 -A561 0.827206349578057 L266 -D294 0.819988250612322 I288 -V600 0.789843378341667 Q271 -A297 0.767242765892211 F590 -K597 0.764115260917187 I530 -V537 0.763864719331551 Y216 -I222 0.753706074301832 L285 -F298 0.743653464496511 T337 -I577 0.738720407517427 E289 -D294 0.71121964055746 I530 -G556 0.690399056100656 Q271 -V299 0.686168074185578 I288 -A599 0.683561231016881 Y216 -L329 0.679235067520102 A284 -L602 0.676690176446592 T560 -L586 0.672324444655159 D528 -A553 0.666127103866199 A287 -F298 0.663156450773885 V529 -G536 0.661663640466959 A274 -L285 0.65962080534424 Y580 -V600 0.658506174972024 Y580 -F587 0.645765172399926 G218 -S225 0.64547384641019 E588 -A601 0.637403632814876 A554 -F590 0.618727235624952 L586 -A601 0.617463665341736 I217 -I222 0.614648808575982 I288 -A297 0.611210957396436 H584 -I603 0.606082341762851 A274 -F298 0.597224618533488 L270 -L296 0.594080116700537 P340 -I577 0.593983144647782 P340 -G559 0.59269263879015 L586 -V604 0.590635568905431 F587 -I603 0.590418276286216 G283 -Y580 0.58852760035739 E579 -V600 0.580569356005176 G556 -F587 0.573031179845791 P340 -L586 0.572252323496814 E579 -A601 0.570732852727803 V299 -Y580 0.570263137037898 V286 -F298 0.565849517912908 Y552 -A591 0.564689680615719 I530 -A555 0.562779186687434 K531 -G556 0.552268735191076 V286 -I295 0.547218227911129 L266 -F298 0.530668424664732 A284 -E579 0.527387606746745 D267 -L296 0.52495523010618 S300 -R582 0.52062571987353 P339 -I577 0.518385955890259 L266 -Q271 0.517739430916988 A287 -I598 0.516082707519832 P340 -A561 0.509133284328493 S212 -L330 0.505714343325609 V286 -V600 0.50345806748079 D528 -F590 0.503373506004604 K545 -Y552 0.495464684639906 F298 -P333 0.492876377335892 V529 -A555 0.492875659083319 A284 -F298 0.492629915474015 G218 -E227 0.489955647938113 A287 -Y580 0.476918494419325 L285 -P578 0.474073998941695 Y580 -L586 0.473388540124449 E289 -P592 0.472787970118239 A533 -V538 0.471661584853869 S212 -A576 0.467326164497878 G283 -E579 0.465812694906353 P578 -D583 0.462231929316106 S300 -R332 0.459785111953846 L285 -P333 0.458441270683687 S212 -A284 0.457690619257117 T558 -A585 0.450679280565597 A274 -Y580 0.45026389127047 T343 -E579 0.448445691182674 E579 -F587 0.444606981955812 A284 -P578 0.44421642574788 T214 -V299 0.440819936438094 Q271 -L296 0.440607609863743 T560 -E588 0.440577894187305 E275 -L285 0.440315886700295 R582 -L602 0.434439171756931 G213 -N331 0.428522108070394 F587 -A601 0.427060317869332 T343 -T558 0.426400072202467 P339 -E579 0.424335513628139 P340 -K557 0.424023347700586 L285 -R582 0.421670657297404 S212 -S300 0.418802271723367 P346 -K557 0.413579490904491 P592 -I598 0.410425591292576 V299 -R332 0.409441042875779 A561 -I577 0.407144662535203 A576 -A585 0.406207332018807 T558 -E579 0.400156897706311 K531 -K557 0.398554863141486 F590 -A599 0.397660305515188 L285 -R332 0.396909063067061 A284 -V604 0.390538742017293 S212 -R582 0.38901534043975 A287 -I295 0.388027384458021 A585 -L602 0.385517131837614 A555 -P592 0.383614128387777 Q539 -K557 0.380695813342479 D528 -A533 0.380204003048551 Q551 -P592 0.380143897606648 T214 -E275 0.379263337156184 A546 -A553 0.378604793664766 S342 -T560 0.378107569463652 A533 -A540 0.377732249306317 I577 -H584 0.375328164258094 V537 -K557 0.374528647185578 L285 -A297 0.370535183565961 A284 -D583 0.368768860239706 N526 -A555 0.367874625073709 Q271 -K581 0.367451382278711 S300 -Y580 0.36422952032789 A287 -A591 0.363463382019745 P346 -N526 0.362569263490301 A591 -A599 0.359910500699883 A576 -A601 0.350544892376231 A535 -K557 0.348586670840585 Y216 -L334 0.347580767662723 G341 -E588 0.344504482616965 P578 -L586 0.344391427743211 A576 -V604 0.342812976327078 V286 -L296 0.342641004854725 A287 -V600 0.342380143194269 A591 -I598 0.341218568558659 K219 -E227 0.339919016714258 S342 -H584 0.339581182924765 P578 -L602 0.338023809717293 K557 -L586 0.332601179592984 L285 -S300 0.330563579933234 V537 -T558 0.327557549431446 G559 -Y580 0.326317330447827 A274 -G283 0.326295290771773 V286 -E579 0.320344582242356 N331 -R582 0.31981661577109 A274 -A297 0.317564702477149 V286 -K581 0.316969386080791 A543 -Y552 0.316456677708519 T343 -L586 0.312513026378248 K345 -N526 0.311796184976749 N526 -M534 0.304908901796136 T214 -E579 0.298907499674603 A561 -L586 0.295779113722198 G559 -E579 0.295540109715331 P340 -Y580 0.294791775160626 I577 -R582 0.294451017768457 I288 -I295 0.294322683794484 R532 -A555 0.293704014211598 P339 -T558 0.293658241292839 P346 -P578 0.291421236325165 Y338 -R582 0.291289568291762 A284 -I603 0.289494872281004 R272 -Y580 0.288298729702815 P346 -I527 0.288149356272267 P578 -F587 0.287949744854016 V529 -Y552 0.287244507898105 A576 -I603 0.287169752346584 Y216 -L330 0.284703528288854 V529 -V537 0.283355273718427 A287 -A601 0.283293559537858 Q271 -F298 0.283165742669839 Y338 -D583 0.281196490592751 K531 -Q539 0.281020117223208 V286 -L602 0.279661019073095 A576 -L586 0.278861795539678 A533 -A554 0.275719010753726 E289 -A599 0.275513174177604 R332 -K581 0.2747980731815 L285 -V600 0.27289735420392 G213 -Y580 0.27185150062825 I577 -A585 0.269300976191293 G556 -F590 0.264526522063994 S300 -P333 0.264127010288106 G341 -H575 0.263319940773933 S342 -G556 0.26185085451873 Q562 -P578 0.261763910975428 T560 -E579 0.261351648731488 A585 -I603 0.260156682555694 G213 -D583 0.259506655954021 Y216 -R332 0.25862401489515 A274 -A601 0.258426753416583 K557 -A589 0.257290831955276 E289 -V600 0.257102944043534 I217 -E223 0.257037293509121 R532 -A554 0.256926406571273 Y216 -Q224 0.25443186709358 N331 -P578 0.251369676405902 V299 -P333 0.250700933834652 G221 -F298 0.249886410850276 R332 -I577 0.248676947164384 G213 -E579 0.2483925229524 D528 -T593 0.245042508679161 D528 -V538 0.243490933698413 N331 -K581 0.240687799947084 T214 -T337 0.240065694664326 G559 -A589 0.240061277041963 A544 -A550 0.239926675965709 K531 -A544 0.239171708061442 R532 -A543 0.238377671696679 Y338 -P578 0.237910718303135 A274 -R582 0.237540274295069 A553 -T593 0.237424821517974 L270 -A297 0.236117190936713 P340 -L602 0.234433164697078 T343 -P578 0.233675560592828 E289 -I295 0.232215140011495 L266 -A297 0.230385386282226 Y338 -F587 0.228449535883538 E215 -G336 0.228258380345487 Q539 -E588 0.227729250788149 G536 -G559 0.227568544856719 A274 -V299 0.227498193951153 G336 -D583 0.227043182419666 Y344 -K557 0.226926471911329 A555 -F590 0.226051543463655 E289 -F298 0.226042260618716 A543 -A550 0.225361198938812 S225 -S265 0.224740080286927 Y216 -E223 0.223216164822922 V299 -K581 0.221084323633784 N269 -E289 0.220511270655048 S342 -Q562 0.217267859426716 G559 -H575 0.217217577730341 G556 -Y580 0.217025047962783 G218 -N331 0.216922841088105 A553 -A589 0.21661154928843 G283 -K581 0.215819579444442 G559 -A585 0.215438174747536 A284 -A585 0.213019254837914 I530 -G536 0.212863261329798 S342 -A589 0.211957305362814 S212 -L329 0.209267238224169 G283 -R332 0.208711440199031 A576 -F587 0.208577552334699 G213 -T337 0.208365103173098 V299 -E579 0.207908606560024 D583 -A601 0.206332310818702 G213 -L285 0.206125535481799 A554 -A591 0.206089071028417 N331 -G336 0.204916955654779 A287 -L296 0.203549969312467 T560 -L602 0.202255044032783 G341 -A576 0.20156586341995 R335 -A576 0.2014073082392 G283 -P340 0.201347296684178 A544 -Q551 0.200845289054327 R335 -R582 0.200438861467226 Y216 -R335 0.200065636382051 T214 -I603 0.199130696806572 E215 -R332 0.198874803465048 Y580 -E588 0.198219928416091 V286 -F587 0.197434337597885 G283 -P339 0.197359970268409 T542 -A553 0.195904160801631 K531 -Y552 0.195137603289443 Y216 -S225 0.194938774331746 A284 -F587 0.194499678043453 T343 -H584 0.193956021694142 G559 -I603 0.193211955736538 P340 -H575 0.19308381255275 A540 -T593 0.190884543264112 G213 -A284 0.190259526589648 V286 -R582 0.19025542998717 A284 -E588 0.18992467082045 I577 -V604 0.188981300513137 H575 -R582 0.188703363678176 G541 -A554 0.187724323765203 I288 -K597 0.186806308333533 A284 -Y338 0.186601964916973 L264 -D294 0.185809869967346 A284 -H575 0.185657212141002 Y338 -A576 0.185490636733968 K557 -E579 0.184935356455531 G336 -Y580 0.183293819244024 K345 -A589 0.182899881291963 T214 -A297 0.182160910673547 T343 -A576 0.181753114504939 Q271 -P333 0.181630786366945 S212 -L602 0.178605311604294 R532 -G541 0.178283368336095 A540 -A555 0.178041220296715 G218 -L330 0.177864065648066 V220 -L329 0.177709319163283 G221 -L266 0.177277276346702 E588 -V604 0.175653611771816 G213 -H575 0.174435390543609 I530 -K557 0.174038427434645 T214 -A576 0.172930778356828 K345 -F587 0.171733289885506 V286 -P333 0.170391986005376 P340 -G556 0.169930060562956 D528 -T542 0.168716843497843 E275 -P333 0.168473604462863 T343 -K531 0.168195429740595 A546 -Q551 0.168020687300237 A284 -G559 0.167515208946993 G213 -P578 0.167230690318958 I288 -A591 0.167174109770806 G221 -A284 0.166702251800228 T560 -A601 0.16454601907867 K545 -T593 0.162564085989781 A555 -I598 0.162252815808618 S300 -A601 0.161740393548317 A543 -G556 0.161689129738386 S212 -H575 0.161580867361847 D528 -T558 0.160848515130686 L264 -N269 0.160656193317235 E215 -Q224 0.160466123054197 K557 -T593 0.160113353869445 A535 -T558 0.159774630189356 V299 -N331 0.15952359203003 G336 -I603 0.158504801642838 I527 -A540 0.158379795358398 P340 -K345 0.1580197504303 V537 -A553 0.156965730224688 T337 -T560 0.156022536415735 R532 -A544 0.152787011656774 T343 -A599 0.15268939693902 G283 -L334 0.150922173878897 A544 -A553 0.150509318767839 I530 -A591 0.150368835114246 H575 -K581 0.150115810921882 P333 -P340 0.149607653543872 N269 -D294 0.149034173912141 T542 -I598 0.148850257178002 A543 -Q551 0.148236604565339 E275 -A297 0.146689266028835 H575 -Y580 0.146621641432265 E275 -I603 0.146295175631699 Q539 -A553 0.145954693802882 I527 -G541 0.145856163029544 A561 -E579 0.145279909068693 F587 -V600 0.145266555685741 R532 -Q551 0.144477099844791 R272 -A287 0.144337189297954 R532 -E588 0.144101653661042 I527 -A535 0.143230517521553 I288 -L334 0.142738366868449 T337 -P578 0.141933630507984 R335 -P578 0.140912996172807 S212 -F298 0.140688301194054 R272 -S300 0.140654336107842 G541 -T558 0.140452647423217 G541 -K557 0.140296166203107 A561 -F587 0.139977773511877 A554 -A589 0.13961394610106 I222 -N331 0.138896226894571 A543 -T593 0.138705660521114 T337 -T343 0.138659700646511 A533 -K557 0.138546144742659 S225 -L334 0.13826731882213 V538 -A589 0.138253258353381 I295 -E579 0.137823629101936 E275 -A284 0.137672662672037 A589 -A601 0.137611729852108 S212 -E275 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0.11214429912244 T337 -H584 0.111965824304692 R532 -T593 0.111581926052847 Y552 -A589 0.111579601096685 P339 -P578 0.111532101727191 E289 -A589 0.111360590594171 G213 -I577 0.111318291387948 E215 -E579 0.111292625591465 G336 -A585 0.110848919188374 S342 -A555 0.110321069382306 V537 -E588 0.110182265766251 V529 -P592 0.110056933122912 G283 -L329 0.109754924275174 I527 -G556 0.10942928959531 T214 -D583 0.109404148954554 L266 -A274 0.109353639460942 E215 -V299 0.108924220277965 L285 -Y338 0.108837553133963 R332 -R582 0.107925173108574 S342 -E579 0.10634106239486 A561 -A585 0.106300942616284 E275 -R582 0.105710533146123 T558 -L602 0.105625510004471 G556 -P592 0.10544090576649 V299 -L330 0.105010705711819 A287 -V604 0.104770041187196 Y226 -S265 0.104722359900264 V286 -T343 0.104622248404519 E215 -G283 0.104455122679952 D528 -K597 0.104327325974182 R532 -A553 0.103816223114862 A540 -Y580 0.103460820969827 E289 -A601 0.10319471423193 T214 -R582 0.103014854144027 G213 -A274 0.103008829961906 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