[Wed Aug 24 17:56:45 2016] >Input file: TM3PUZATD.pdb >TM segments: G18-39_G81-103_G123-137_G139-173_G218-237_G264-280_F19-36_F39-55_F69-88_F277-299_F319-337_F365-385_F429-447 MAIDEN score = -116.1640 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 ----------- ---------------- I274G-A326F 1.62267007732338 T295F-Y381F 1.27141930031281 I333F-L447F 1.2302424218957 I224G-I274G 1.15471057469602 I99G-L167G 1.11146788070134 I99G-I170G 1.09464938955723 N157G-L237G 1.06079407195875 I154G-H159G 1.04221444214811 L156G-L236G 1.0349123403663 F128G-V79F 0.984106595917205 F330F-V442F 0.981364567085419 F336F-V375F 0.965942593763502 I24G-L321F 0.9502131716281 V100G-F219G 0.922600911962897 I154G-G161G 0.89308970605151 F153G-H159G 0.881748069079883 Y166G-F78F 0.874833700596087 S95G-I163G 0.842988973302077 M34F-A43F 0.837554710289702 I333F-L443F 0.811429008906314 I333F-L446F 0.809952243201945 I24G-L320F 0.782585942777374 K337F-L446F 0.78056861749935 A271G-P328F 0.774553330117255 N87G-H159G 0.7687058104818 H159G-L237G 0.768514069019577 V292F-F434F 0.765613432694007 I27G-W378F 0.752608364121574 V162G-L236G 0.745647213853744 V285F-F438F 0.737706452177271 G299F-M385F 0.717659438086203 M75F-L80F 0.703627860789922 L102G-P70F 0.701482497830908 I322F-P382F 0.700555908244504 L137G-V232G 0.681218469314026 Y141G-L156G 0.675854940037393 G74F-V79F 0.672259857655359 Y141G-L235G 0.671094935497242 L334F-L446F 0.667888479647561 L49F-A73F 0.666888023731244 G169G-V79F 0.665163569858195 L334F-L447F 0.657626650149381 L126G-L172G 0.65599118544443 F144G-G155G 0.648514528200265 Y141G-L236G 0.646965629777152 I97G-F219G 0.641026326510338 V134G-F441F 0.639682546009995 F287F-I373F 0.633436985825631 L77F-P82F 0.628798182079299 L143G-P82F 0.627078719732498 Y325F-L379F 0.626872068725572 G148G-F153G 0.626282578637099 F144G-G161G 0.619830896715067 F153G-G161G 0.613891621486484 L140G-D145G 0.600360910196938 A96G-V218G 0.596323954308366 I154G-F164G 0.591454798127719 S103G-G71F 0.588835984798417 V91G-G160G 0.586538334006075 I274G-V327F 0.586063927259331 S329F-L379F 0.58029910131281 G53F-Y69F 0.579584096090275 F278G-A326F 0.573627074633352 A165G-V232G 0.565064070757888 L147G-P152G 0.564207435212416 I94G-I163G 0.563982389112249 L156G-L237G 0.563804106331593 V31F-T46F 0.558759494878045 I220G-V277G 0.558708001821955 F153G-T158G 0.554913023164496 P324F-L379F 0.548056760004611 T228G-F330F 0.539276729226005 V89G-I227G 0.53500802784186 L167G-F78F 0.526628029221468 F330F-L446F 0.520795223378415 S95G-S222G 0.519324927719798 L294F-Y381F 0.514145806394325 F330F-L443F 0.513358532101087 L321F-P382F 0.508527410117203 T275G-A326F 0.506986742560539 F336F-L447F 0.506852097661577 S95G-F223G 0.505806168657142 A133G-V79F 0.499226296487019 L289F-F434F 0.498323988308315 P132G-E229G 0.498051720072672 V31F-L47F 0.495101613055188 V34G-I335F 0.487465098438452 Q129G-L172G 0.486408969954619 F144G-L156G 0.479943600407728 L102G-I170G 0.479462806393795 V35G-A264G 0.476740934417801 Y166G-A226G 0.474126302454196 V27F-S50F 0.473586359181655 E39F-C85F 0.465367991599716 P30G-F336F 0.465125145517845 S95G-F164G 0.462695713744652 I224G-P328F 0.457857254843641 P30G-I335F 0.456726999664005 I99G-G169G 0.450685420160334 E39F-T45F 0.448768173008836 M34F-E39F 0.44646169134627 S270G-I331F 0.443827901439334 P30G-K337F 0.441473991301392 L140G-P82F 0.434799433473586 V298F-Y381F 0.434459697145246 K90G-H159G 0.433748804888944 I27G-P324F 0.430938653694209 V91G-I163G 0.429053407627983 F128G-L80F 0.42217822470888 V35G-A265G 0.420550209987572 R146G-C85F 0.419865536173986 K90G-P273G 0.419850288739064 V34G-A265G 0.417717207150189 V27F-V32F 0.416210070327949 G299F-Y383F 0.415762640990508 I99G-S222G 0.415502907131005 Q129G-L80F 0.414782268861215 V91G-A226G 0.412855346455926 L147G-I154G 0.408965274874232 V31F-A43F 0.403867947515195 V27F-L47F 0.400374501698436 V100G-H173G 0.399432404588858 A133G-V232G 0.397747747968956 L272G-V327F 0.396563346714406 L167G-M75F 0.394335322728947 E39F-T46F 0.394004023334936 A267G-I331F 0.393309246145884 V34G-A267G 0.39240799123998 V296F-Y381F 0.390468668931074 F164G-F78F 0.390419117561456 V162G-L237G 0.389758392522402 Y325F-Y383F 0.382679161412943 S95G-A226G 0.380959562199854 I37G-A264G 0.380680134158207 I290F-I373F 0.380212263330198 A92G-A165G 0.379193794592023 R146G-L156G 0.37872291003532 A225G-A326F 0.375148561428786 H159G-S234G 0.373605451914344 I220G-F278G 0.373002611929572 P132G-N440F 0.369731707687297 T275G-L323F 0.36726568484443 L137G-P231G 0.366711098969056 L137G-L235G 0.365170533003465 T284F-F438F 0.361581135197421 I154G-G160G 0.358184956828535 V296F-M385F 0.356999760128314 V327F-Y381F 0.356799801146095 Y141G-V79F 0.353034232952309 S329F-P382F 0.352603893866298 L135G-T86F 0.352414497882522 F287F-F438F 0.352061920166204 L85G-S270G 0.351821782879256 V34G-V268G 0.349975614129502 V134G-V232G 0.349064579141834 K90G-A233G 0.348710392257328 A165G-F78F 0.348548287662338 I99G-F219G 0.348544369337918 P231G-N439F 0.348372828187925 V91G-V162G 0.346492100481606 R146G-I151G 0.345145573342073 V298F-M385F 0.344781895620464 S270G-P324F 0.342591024630087 S136G-L83F 0.339571421186305 I170G-G71F 0.336017317306633 I322F-M385F 0.330814726335824 V230G-V442F 0.330586460070485 S103G-A171G 0.329402736920988 A267G-A326F 0.328642353935949 P231G-P82F 0.3286173773576 T158G-L236G 0.327062936351751 M371F-V442F 0.326559409312213 L272G-A326F 0.32577934753697 F131G-L83F 0.323014680909774 A96G-G168G 0.32248261801801 I274G-Y325F 0.322097460394523 K90G-S222G 0.321336578387965 A92G-S222G 0.320015958007111 R146G-N157G 0.316957411477758 I99G-Y166G 0.316508488911547 P231G-P328F 0.316365584525245 S88G-A271G 0.315002388841693 R146G-G155G 0.313413771648285 L140G-V232G 0.312396257140036 F223G-I274G 0.31205248241009 G161G-G74F 0.311784338319497 F144G-I154G 0.311269604795231 M130G-A435F 0.311134812054446 G28F-A36F 0.310346548615121 I274G-P328F 0.307395557197248 A264G-A271G 0.306763079849004 V319F-Y381F 0.30544546953802 E229G-V442F 0.305274963686725 G169G-M75F 0.30445501736456 Y55F-P70F 0.303833143277164 P231G-V442F 0.303431855820275 A139G-L83F 0.303178635128628 Q129G-V79F 0.299571175646156 T291F-P382F 0.296321993264889 S136G-A165G 0.296161893443252 F287F-N437F 0.293541329263587 G169G-A73F 0.292807761514438 I333F-V375F 0.292504366300138 I154G-V162G 0.29103134301123 L172G-A432F 0.289786529633523 S270G-P328F 0.289599503835409 S288F-G380F 0.288593876786253 G28F-S51F 0.288586441256247 L372F-I444F 0.285587468961616 L126G-G168G 0.285107211504565 W84G-T228G 0.283596963595479 L39G-A265G 0.2826966353903 G380F-N440F 0.282626262734289 G124G-L172G 0.281862969964974 T228G-P324F 0.280337142498781 L294F-T377F 0.280184529825998 G53F-G74F 0.278598684358456 S288F-F434F 0.277801395805161 V292F-N437F 0.27512788127055 I224G-A326F 0.272103494693602 I37G-A265G 0.27167891557326 P30G-Y325F 0.271363334094314 V296F-M384F 0.271344257244503 S332F-L379F 0.270063400922816 S288F-F438F 0.269861066671696 D145G-G161G 0.269487974123982 A264G-K337F 0.269288267520906 V89G-P273G 0.26879165270451 P328F-Y383F 0.266724208608087 T45F-C85F 0.263480911848551 Q129G-A171G 0.262290348682515 T370F-W378F 0.261301880311404 Y166G-H173G 0.261253455460408 G299F-Y381F 0.260756164247102 V134G-C85F 0.257525832951729 I227G-P328F 0.256753366867688 G299F-M384F 0.255379623381897 L26F-V31F 0.25430423765593 E149G-T158G 0.254161630136586 G299F-P382F 0.254100681860337 V268G-Y325F 0.251996895626167 Y141G-R146G 0.251034947054905 L140G-P231G 0.250630017188945 P152G-H159G 0.250070737398845 Q129G-S136G 0.248752451745729 S288F-S433F 0.247733384621524 I170G-M75F 0.247024280592278 V230G-F330F 0.246774764814528 A92G-I163G 0.246470691422568 T228G-T275G 0.246057415994136 T291F-G380F 0.243431170230226 M34F-Y40F 0.24261235133921 T275G-L320F 0.241669593032127 G380F-L443F 0.24138392920681 G160G-A233G 0.241093278119022 S270G-V327F 0.240284605813955 T45F-L80F 0.240107310806853 M28G-L320F 0.240107209389476 W84G-P273G 0.239136480537594 T295F-P324F 0.239076117795512 D145G-Y150G 0.238538039455749 P365F-T370F 0.238536631081843 F287F-R369F 0.236756181291715 L82G-S270G 0.23656133799047 F128G-A435F 0.234197187250376 V268G-V327F 0.233984046970111 D145G-M34F 0.232820632563669 A171G-G76F 0.232707606990065 G93G-L221G 0.232269058927407 Y29F-A36F 0.23141153492485 V79F-V84F 0.230328413085049 N157G-L236G 0.230276144694255 L31G-V268G 0.229692628735604 F293F-Y383F 0.229194573776913 T158G-L235G 0.229035399025374 L140G-F78F 0.228968577826864 G299F-N376F 0.228727350924872 V162G-M75F 0.227718444504951 E149G-L156G 0.227041560160416 A36F-F42F 0.226290722714732 L83G-P273G 0.225582152625534 L221G-P273G 0.225305319904654 G53F-G76F 0.22499720043185 L26F-T46F 0.224726617850392 V81G-A266G 0.22335693320694 F287F-A435F 0.222104191930992 A43F-S50F 0.221970370498048 P328F-L446F 0.221907420187033 L20F-G53F 0.220765826614649 A92G-A233G 0.220423913691988 A36G-A267G 0.218937263782973 A92G-I227G 0.217767792656193 E229G-N437F 0.217752560052918 L221G-T228G 0.217612935344663 V292F-M430F 0.217145709091447 Y141G-F164G 0.216716473084091 L289F-S433F 0.215814978414368 N440F-Q445F 0.215681660783767 A133G-S234G 0.214924927499277 S38G-A265G 0.214364365067011 M28G-V375F 0.214338423848447 S332F-V442F 0.212014967340708 N376F-L443F 0.211839410210876 S95G-P70F 0.210417910846221 L321F-G380F 0.210161457959543 P30G-S38G 0.209222333615252 L33F-T46F 0.209141186024205 G71F-V79F 0.208355491300645 G93G-T228G 0.207590430584504 V162G-V232G 0.207420722158867 V268G-I274G 0.206905183158987 Y166G-F219G 0.206553864048119 F436F-V442F 0.206466747129229 G169G-L77F 0.206253433826523 A226G-F330F 0.206185141345938 T46F-G74F 0.206010667103091 G28F-L33F 0.205722088484423 S38G-S332F 0.205499285238187 I163G-G74F 0.205486020276907 G168G-L77F 0.204769127639334 I24G-F29G 0.204520408695883 L279G-V319F 0.204419659163267 F278G-Y383F 0.203207283957946 L323F-M384F 0.203038608011356 L140G-M75F 0.202274585441476 L294F-M371F 0.202160298899244 V298F-W378F 0.201239278632784 A96G-A226G 0.201186855102236 V375F-L447F 0.201013858334727 T291F-T377F 0.200973770170318 S95G-L167G 0.20046027486897 I224G-Y325F 0.19992552696903 F164G-A226G 0.199484069116886 A96G-I220G 0.198811424882091 A165G-G76F 0.198741469422855 Y141G-S234G 0.198469159249148 M130G-L429F 0.198198502124032 T291F-I444F 0.198072319213167 L323F-P382F 0.197834333213216 L334F-N376F 0.197832006283594 M125G-L167G 0.197782189840767 L372F-G380F 0.19764312623472 F128G-C85F 0.197424150542389 M34F-L49F 0.197011655862888 L221G-M385F 0.196455406085394 G161G-P231G 0.196100921761661 L294F-N437F 0.19596764458037 V319F-Y383F 0.195829391931793 M430F-F436F 0.195411215831702 G148G-L236G 0.195114683930704 V285F-F436F 0.195027368390751 Q129G-P82F 0.194903685398219 A271G-V327F 0.194579428571551 L143G-N157G 0.194544598920089 S222G-P328F 0.19444964620799 A171G-A432F 0.193511425452346 P30G-S270G 0.192933270238562 L32G-M269G 0.192692770706382 A96G-T228G 0.192111532964935 G299F-L379F 0.191486995934135 Y35F-A43F 0.191480655529741 G93G-I163G 0.190200412731499 I322F-Y383F 0.190016160361469 I94G-T158G 0.189321119231553 S329F-Q445F 0.189197015813115 D145G-N157G 0.188878396681299 F131G-V84F 0.18827431903698 S288F-M384F 0.187595488271288 M34F-S51F 0.187437096122411 G161G-L236G 0.187061991689539 S95G-M75F 0.186439128547522 T228G-L443F 0.185977620966455 K337F-W378F 0.18577376161901 T158G-L237G 0.185746493739695 H173G-A432F 0.185371790952011 G161G-L235G 0.18527810442173 K123G-H173G 0.184939106765676 S329F-Y381F 0.184769829581982 T377F-P382F 0.184360185383461 S136G-N440F 0.184060376442522 P30G-L379F 0.18205638485086 A267G-T275G 0.18165514514873 Y150G-V32F 0.181639932598987 F223G-T275G 0.181591400687109 T275G-V327F 0.181517224957275 I37G-A266G 0.18143367112557 T295F-F434F 0.181395412967946 W283F-P365F 0.181360081581158 D145G-T158G 0.181069924093524 Y141G-E149G 0.180945982083736 L82G-K90G 0.180856552534498 P70F-L77F 0.180839543139998 S222G-Y383F 0.180814763486397 P231G-L446F 0.180773754113306 F287F-F434F 0.180651903613443 G98G-M75F 0.180236195075304 V134G-L140G 0.180141236781675 H159G-E229G 0.179550943766125 G148G-L237G 0.179467344722443 G155G-Y166G 0.179348972392061 L221G-G380F 0.179323905638215 G98G-A165G 0.179310595872083 A326F-I331F 0.178881424827074 L26F-G53F 0.178873747851365 F164G-A233G 0.178531867893723 M28G-V268G 0.178436923223593 L126G-G76F 0.178231601515894 F144G-Y166G 0.178198358854422 L20G-G299F 0.17784169143877 V89G-I163G 0.177648232195981 S103G-L126G 0.177643417112578 L289F-N440F 0.177176556299879 G124G-G169G 0.177015958458726 L221G-P382F 0.176751623268081 L140G-G76F 0.176666775418273 S136G-Y166G 0.176509613612029 T284F-T366F 0.176479715001472 A92G-A225G 0.176369551597352 D145G-P82F 0.176305829723423 K90G-A225G 0.176069632689655 V91G-I227G 0.175113195142246 Y166G-M72F 0.174469050596106 L85G-P328F 0.174458069066122 T284F-F436F 0.174146852841592 F278G-V327F 0.173891734616469 L221G-S329F 0.173365480691551 Y141G-A233G 0.173216516526886 L26F-V32F 0.173035408868421 S329F-N439F 0.172935832391813 S270G-L323F 0.172761787745579 T46F-F81F 0.172144390305357 A96G-H173G 0.172121877459818 F287F-A368F 0.171678177260552 S50F-M75F 0.171633666911988 S332F-G380F 0.171623651173491 P132G-S288F 0.171402483292028 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