[Wed Aug 24 18:26:52 2016] >Input file: TM2WJRATD.pdb >TM segments: A17-25_A29-38_A55-65_A68-77_A88-96_A100-106_A131-138_A142-148_A169-175_A182-188_A207-213 MAIDEN score = -14.8118 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 ----------- ---------------- E58A-L76A 5.3443468636317 P183A-V211A 3.82604211061209 H137A-T143A 2.80982922086042 M34A-V57A 2.12898447507477 M75A-P88A 1.88165618565079 I63A-V71A 1.83045788612583 S36A-V55A 1.82347033146536 P73A-V90A 1.44226363329151 L92A-I104A 1.19164819520136 A145A-V172A 1.16067692820262 L173A-I185A 1.14380260498036 K21A-M34A 1.09657293349924 V172A-E186A 1.00077751577728 W146A-V172A 0.997794375233605 T148A-N169A 0.920841932423234 F144A-L173A 0.902155232222254 W31A-A62A 0.885906312414918 W146A-F171A 0.884189134893855 Q174A-Y184A 0.784586657354907 V134A-W146A 0.766546378684211 W31A-V59A 0.763117198100093 G29A-I63A 0.694729556343413 V57A-T77A 0.686052128644079 V57A-L76A 0.682844146916544 I138A-F144A 0.669690446283483 L76A-Y89A 0.669392331592143 W94A-F102A 0.657139917988903 W30A-A62A 0.638526034581426 F144A-V172A 0.624799930617127 W30A-V59A 0.623590833414853 E58A-M75A 0.622838032161837 V71A-L92A 0.619677027576198 F102A-V134A 0.605332009969279 N101A-T135A 0.57026533158256 A170A-E186A 0.568127903876594 V172A-I185A 0.561991454595898 F102A-G132A 0.54121842283754 W69A-L92A 0.519518699369969 W146A-N169A 0.513337033285003 I104A-Y133A 0.508900449480918 A96A-F102A 0.49662928606824 F144A-F171A 0.496616245306396 V59A-L76A 0.484444047946874 L76A-P88A 0.476648672394515 G74A-K91A 0.474365744159531 Y133A-A145A 0.472108507720342 A62A-P73A 0.468067987090517 F102A-T135A 0.463504904816722 T182A-F213A 0.459073809112504 Q147A-A170A 0.458310040196392 Y106A-Q147A 0.457406234050943 M34A-E58A 0.447832253896148 F142A-L173A 0.440343108527423 A145A-F171A 0.438016469657889 T70A-L92A 0.425168943368579 S23A-M34A 0.422230391683154 Y61A-V71A 0.414866745287539 I185A-Y207A 0.41337312781444 D95A-H137A 0.405080041315713 Y184A-S212A 0.403897349490066 K64A-V71A 0.4035428015468 D131A-Q147A 0.397648252491327 H137A-Q174A 0.396455390475752 E24A-W31A 0.393826076927962 P183A-I209A 0.392911038744573 A32A-V57A 0.387088663639475 W31A-E58A 0.378524084605487 A145A-L173A 0.355152786708343 N101A-Y133A 0.350818367619596 L65A-V71A 0.348365454181163 Q174A-I185A 0.345098659105972 S93A-F102A 0.34427879090062 V71A-V90A 0.340629184240968 L100A-H137A 0.339424505572578 A170A-D188A 0.336714418339858 T143A-E186A 0.335664694753129 V57A-Y89A 0.333269257437943 Y89A-G103A 0.331360981384291 V90A-Y133A 0.330606849157639 T135A-A145A 0.319388337502191 K91A-G103A 0.31848374535334 I104A-G132A 0.310080055353622 G25A-A32A 0.309951293042721 Y184A-I209A 0.309751084648842 L100A-V134A 0.308872815770215 A145A-Q174A 0.308612792785561 N169A-R208A 0.300897831531622 Q56A-L76A 0.298681941584746 S33A-G74A 0.295921955382956 E58A-P73A 0.295555302991175 I185A-I209A 0.29461122147528 V71A-W94A 0.293084433944378 L100A-Y136A 0.289570962331673 S23A-W31A 0.288220870861526 W31A-T70A 0.286088119021452 V22A-M34A 0.279923222850488 Q68A-W94A 0.256822116342046 G25A-E58A 0.25657499803036 E17A-G210A 0.255318362510684 D95A-Y133A 0.255216160734434 N101A-Y136A 0.251648108711762 T182A-V211A 0.247546690066587 V59A-M75A 0.243797676339714 T135A-W146A 0.242592970804895 S33A-L76A 0.240219987188599 W94A-G132A 0.233044606720416 A32A-R72A 0.232533528868542 M34A-V55A 0.229904560968922 L65A-P73A 0.226506206636787 G103A-D131A 0.221437144111287 T143A-L173A 0.220377977940164 V22A-E35A 0.218769055906543 T135A-F144A 0.21817746272332 R72A-S93A 0.216439089355255 V71A-S93A 0.214943741785467 Q147A-E186A 0.214378072397258 T70A-W94A 0.208214419519232 H137A-F144A 0.207984612590688 D131A-D188A 0.207055050123627 W30A-K64A 0.205377011670463 S33A-P88A 0.200265166255352 E24A-W30A 0.197448124583459 M75A-D131A 0.197311279453634 Y136A-A145A 0.196340640663439 D131A-N169A 0.196134009067836 H137A-Y184A 0.195672562627203 Q174A-F213A 0.194341566678959 N37A-R208A 0.194199698044454 N60A-R105A 0.19322575745013 Y89A-G132A 0.190896809103156 E24A-A62A 0.190609574028863 M75A-R105A 0.190064491698156 Q68A-N101A 0.189254711816418 G132A-W146A 0.189235174798294 K21A-W31A 0.186036921302946 S33A-E58A 0.185871718662428 W30A-K91A 0.184817663340264 H137A-F142A 0.183804991917843 W30A-T70A 0.181673328456814 R72A-W94A 0.181094601648145 N60A-T77A 0.179576696716843 V172A-R208A 0.178683998831391 R19A-D188A 0.177712871971133 R105A-Y133A 0.176673052448483 I63A-R72A 0.173149152776887 W94A-R105A 0.17269281625048 V59A-V71A 0.171869805218575 Q147A-Q174A 0.165325021777194 S23A-M75A 0.16457560197946 F144A-N169A 0.162191953349198 R19A-Y207A 0.159671970169819 N60A-P88A 0.159484907887087 T135A-T182A 0.158613113687148 T182A-S212A 0.155739244135644 W69A-D95A 0.155350478833141 N60A-T70A 0.153960151598396 M34A-S212A 0.15376971854705 W31A-Y61A 0.153614074055461 L65A-K91A 0.151782293453691 T18A-T38A 0.15077105113302 L20A-S36A 0.150163540160799 E17A-E35A 0.149812243063662 S23A-L76A 0.148295018073203 G103A-Y133A 0.148243735802418 R105A-G132A 0.14592914997755 S36A-V57A 0.144932147688254 G103A-A145A 0.140791621454631 Y136A-Y184A 0.139930206054925 I104A-Q147A 0.136516261995862 Y133A-W146A 0.136496169531662 V172A-I209A 0.135924081918468 A145A-Y175A 0.135428186568515 H137A-T182A 0.135158459225027 Y184A-R208A 0.13269130800141 K91A-T148A 0.13252854716071 A145A-D188A 0.132387439654054 G29A-P73A 0.131134673049183 E58A-K91A 0.130735515911995 K91A-V134A 0.129294791636525 Q68A-G103A 0.128671746600765 A96A-G132A 0.125684004684192 Q174A-T182A 0.125682263560221 I185A-G210A 0.125092803043591 Y61A-G103A 0.125009158969402 N37A-E58A 0.12461954298688 N60A-M75A 0.123850575389694 T77A-P88A 0.123252990111959 S33A-P73A 0.121023233981035 S93A-D131A 0.120434075408322 G25A-P73A 0.119984760868669 M34A-Q56A 0.119132509972832 Q147A-F171A 0.119079596576257 Q174A-V211A 0.11816296155941 H137A-W146A 0.117377602031825 N169A-Y187A 0.117273404981815 T18A-I185A 0.116813492353479 N37A-Q56A 0.116317215077664 G74A-I104A 0.115711768632412 E186A-I209A 0.115061789336308 A145A-T182A 0.114966965339458 A170A-Y187A 0.112532455346912 R72A-Y89A 0.111586919801441 I63A-T70A 0.111299838109376 T18A-V55A 0.111207769611476 G25A-G74A 0.111062998584972 S23A-N37A 0.110562006268943 R19A-R208A 0.10994545780846 A145A-V211A 0.108559107910898 Y184A-F213A 0.108473389663376 V22A-G210A 0.10844088108564 T135A-N169A 0.108337864689363 V22A-T77A 0.10794997868274 V71A-A96A 0.107804698930495 A62A-G103A 0.107316880377825 E58A-T77A 0.106822576855834 T18A-S36A 0.105363902242987 W146A-L173A 0.104692987020846 F102A-A170A 0.104510254689969 T143A-S212A 0.103354438543423 A62A-P88A 0.103262968773675 R19A-S212A 0.102322658317035 G25A-W31A 0.102151896759521 A32A-T77A 0.101701662959012 R19A-T38A 0.101023254907287 Y133A-Q147A 0.0992328666970499 I63A-Y89A 0.0989413072003114 Q56A-P88A 0.0963090444561541 T70A-R105A 0.0956579867107198 W94A-G103A 0.0952722920986799 V134A-F144A 0.095050795933199 N101A-T148A 0.0947574889796763 D131A-A170A 0.0930886506952566 V59A-T70A 0.092577276627444 T148A-V172A 0.0920003942576231 I63A-M75A 0.0912873316358533 F102A-D131A 0.0895253275239374 E24A-Y61A 0.0889923235297843 V172A-Y184A 0.0888372906269552 A32A-V90A 0.0884519167557705 Y133A-V172A 0.0878246518273635 G132A-F171A 0.0876444733050894 L65A-F102A 0.0876113552241986 N101A-D131A 0.0871342446377157 T135A-T143A 0.0871115447664366 V172A-D188A 0.0869357315861041 E17A-E186A 0.0864878022873277 T18A-S212A 0.0856585572673289 N37A-T77A 0.0833215832868155 W31A-K64A 0.0830276098738669 A62A-M75A 0.0827381973874545 R19A-S33A 0.0820710875006005 L20A-R208A 0.0818498538163615 A62A-L76A 0.0815669756685153 V172A-T182A 0.0815512922740327 Q147A-R208A 0.0810833137678233 Y61A-S93A 0.081082905321372 S33A-V59A 0.0806629093992868 K91A-Q147A 0.080337097147047 R105A-V134A 0.0793695177899041 G29A-G74A 0.0793661241404953 S23A-Y61A 0.0786844858554474 W30A-V57A 0.0784664078047244 T70A-S93A 0.0780623487780101 Y136A-T182A 0.0777841524956195 E24A-E35A 0.0772149374844782 S36A-Q56A 0.0762702491497671 L20A-N37A 0.0760519765227246 S36A-L76A 0.0751738655872707 I104A-W146A 0.0742162805210205 S23A-G74A 0.0732633489915131 K21A-T182A 0.0724771754809672 A145A-Y187A 0.0722382546585694 T135A-Y184A 0.0715578376601265 F102A-T148A 0.0712057023929136 I63A-G74A 0.0707966515012597 R72A-D95A 0.070163514727585 T18A-Q56A 0.069991258433669 K21A-G210A 0.06990347243513 Y175A-E186A 0.0688497695526679 I185A-S212A 0.0678890310071749 S36A-S212A 0.0670160404565783 P183A-Y207A 0.0665384570926304 A62A-R72A 0.066424172963865 R105A-Q147A 0.0663994494884212 V134A-Q174A 0.0659047534944353 E24A-M34A 0.0656952500492931 A62A-W94A 0.0654889872308058 S23A-E35A 0.0653586082991504 W94A-V134A 0.0644273058685929 A145A-A170A 0.0641915246558638 M34A-M75A 0.0638664828351689 A62A-Y89A 0.0637939237198237 T135A-Y175A 0.0617614346866695 G74A-G103A 0.0617213382776065 L65A-A96A 0.0607152756898146 G74A-R105A 0.0606386417058387 W69A-I104A 0.0599281582964748 A145A-E186A 0.0586982610172218 F142A-Y175A 0.0585061964868077 D188A-I209A 0.0581034986994697 W31A-K91A 0.0573996939041672 W94A-Y133A 0.0570783523194425 S93A-N101A 0.0567307213462747 W146A-I185A 0.0563553063148201 N37A-V55A 0.0559484885228642 G29A-L65A 0.0557076144180942 E58A-G74A 0.0555738939545577 T70A-Y133A 0.0555321104768285 P183A-R208A 0.0554310700507066 A96A-Y133A 0.0552034891355766 F171A-P183A 0.055122300576212 K21A-Q56A 0.0546593102177142 N60A-Y106A 0.0540999436509057 R72A-F102A 0.0534001743413688 I138A-T182A 0.0527295642847418 Q147A-V172A 0.0520051633130301 T77A-Y106A 0.0516503563860529 T18A-Y187A 0.0510383847712008 G74A-L92A 0.0510100549642409 V59A-P88A 0.0506522738776658 F142A-E186A 0.0503138338741209 N101A-F144A 0.0500947012736831 K21A-T77A 0.0500704317657219 M34A-G74A 0.0500004137744083 A62A-Q68A 0.0496804644473834 W146A-E186A 0.0494750561686554 M75A-L92A 0.0491157939065001 T18A-V211A 0.046585116439231 M75A-I104A 0.0463644974686961 K21A-V59A 0.0462458121642966 T18A-M34A 0.0454643988211196 N169A-Y207A 0.0454104690915038 Y136A-T148A 0.0444139710000298 L65A-T70A 0.0442822165311636 E24A-N60A 0.0442173111873387 V71A-Y133A 0.0438961366167039 L92A-Q147A 0.0437584882479314 S93A-Y106A 0.0431626128536942 W146A-A170A 0.042682679939777 T70A-Y106A 0.0424932762305219 E17A-R208A 0.0419192038157168 V71A-N101A 0.0418316670928207 N37A-V57A 0.0417797521787453 G74A-S93A 0.0406677133741201 T70A-G132A 0.040588735712872 K91A-T135A 0.0404080788249291 A170A-Y184A 0.0399273458127802 G103A-H137A 0.0396319018688687 Y61A-L92A 0.039418946970331 T135A-I185A 0.0386343341904394 V172A-S212A 0.0386277749626478 G25A-M75A 0.0385665346929915 E35A-T77A 0.037972056451939 W30A-S93A 0.0378336630880982 Y89A-Y133A 0.037248070633594 V134A-N169A 0.0367504485589307 G132A-V172A 0.0367267015755459 A62A-V71A 0.0364673769112711 W146A-Y187A 0.0356871106671182 F142A-V211A 0.0352399500653364 M34A-N60A 0.0347087574947276 T70A-V134A 0.0339156055042391 S23A-A62A 0.0338586726661738 R19A-V57A 0.0333519518214284 Y136A-F171A 0.0330448717421028 S33A-Y61A 0.0329407502233834 G25A-I63A 0.0312776173078433 Y175A-Y187A 0.0311625237810631 E24A-F213A 0.0303459480018055 I63A-W94A 0.0293549154542458 A62A-R105A 0.0291230416114949 G25A-M34A 0.0283074164482651 V71A-Y106A 0.0274224453117182 R72A-K91A 0.0271689223594884 I63A-I104A 0.0268345835403441 L173A-S212A 0.026726293507368 A62A-D95A 0.0266363621623208 T70A-A96A 0.0266237891486867 R72A-N101A 0.026408455514114 A32A-Q56A 0.0261387549819729 T143A-V172A 0.0258522439413937 V59A-K91A 0.0251646069559284 V134A-Q147A 0.0249926113139143 N60A-Y89A 0.0247608240492614 L76A-K91A 0.0246728034997874 D95A-T143A 0.0245779192928488 T143A-A170A 0.0244455319991241 G74A-Y106A 0.0244453548717445 A96A-I104A 0.0238720596141544 F171A-G210A 0.0237448524642856 E24A-R72A 0.0237403684160729 S36A-G210A 0.0226051055625112 A96A-H137A 0.0221396793032531 R19A-E58A 0.0220175198323203 L100A-G132A 0.0219549873211742 N60A-L76A 0.0213415115101089 E58A-V90A 0.0213210986970046 R72A-P88A 0.0207080099486543 T70A-Y89A 0.0198907907390491 P88A-D131A 0.0190028543284746 E35A-V59A 0.0189649281918425 I104A-A145A 0.0181734613663416 E17A-V55A 0.0173156067495304 Y133A-T143A 0.0172990195057841 D95A-A145A 0.016468397711674 V71A-P88A 0.0164474328915096 I138A-T143A 0.0162564432453927 N60A-S93A 0.0162120474903641 W146A-Q174A 0.0160154888009771 T135A-V172A 0.0160087413826924 W146A-Y175A 0.0159186518495982 G25A-K64A 0.0158825335702865 T38A-V55A 0.0157754575048177 E24A-V57A 0.0150298695663511 S23A-N60A 0.0148120845698329 P73A-I104A 0.014449550729136 R19A-Q56A 0.0143026385464968 G29A-K91A 0.014199927145701 S23A-V211A 0.0141262850837918 N101A-G132A 0.0120041390724151 T38A-G210A 0.0117893674692608 F144A-D188A 0.0112523626256125 I63A-P73A 0.0108155121053217 T143A-I209A 0.0105278114576555 A170A-G210A 0.010326380638946 N101A-I138A 0.00970364420523406 R72A-R105A 0.00783411268871403 F171A-I209A 0.00742133602133288 A62A-T70A 0.00678654532262257 G103A-N169A 0.00620941457279045 R105A-N169A 0.00586659715273408 L20A-T182A 0.00567161131584981 T143A-Y187A 0.00563533549408657 V59A-L92A 0.00549350963776796 F144A-Q174A 0.00537466405950748 F142A-I185A 0.00445810676058733 S33A-S212A 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