[Fri Aug 26 16:26:36 2016] >Input file: TMQ8K377S3D.pdb >TM segments: A77-129 MAIDEN score = 53.3453 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 ----------- ---------------- C102A-Q124A 10 C102A-I125A 10 T92A-V115A 10 E79A-C102A 10 S78A-I101A 1.51812115140688 M89A-K111A 1.35725359186325 M89A-L112A 1.24374305447619 D97A-L120A 1.22736485121533 L77A-I101A 1.22170878786662 I101A-I125A 1.09752806007154 L88A-K111A 1.0660566281215 L94A-L118A 1.05785769899267 W93A-V115A 0.998705887799155 F85A-K111A 0.883475510714602 L96A-L120A 0.874646171613544 W93A-L118A 0.848572753112508 T86A-F109A 0.823832396635929 L88A-L112A 0.776886347905312 V104A-L128A 0.724230174284722 F85A-F109A 0.720960507855171 E79A-V104A 0.720299406599587 F85A-A108A 0.682057338999265 L91A-L112A 0.674904571675245 A82A-D107A 0.674057090531665 L91A-V115A 0.652662759977685 Y95A-L120A 0.643130142546551 L80A-V104A 0.639738102871258 L80A-Q105A 0.622326245282512 W93A-E117A 0.619271104374106 L91A-R113A 0.59130012814718 L77A-H100A 0.56789703387583 L77A-N99A 0.566480003869742 H98A-L120A 0.564954813188972 C102A-T126A 0.535519259844799 F85A-L112A 0.529400827931888 Y95A-T119A 0.52708158673329 Y95A-L118A 0.519498064319429 S103A-L128A 0.488559747159766 L96A-S121A 0.48701411261306 T86A-A108A 0.453058778405978 V104A-A129A 0.440481486843652 T86A-Q110A 0.437895536365963 Q90A-V115A 0.415211762255239 L94A-T119A 0.405732376481938 L80A-I101A 0.403204633252855 H98A-Q124A 0.39731263916376 L88A-R113A 0.394240448028489 S103A-T126A 0.390235243764478 Q90A-L112A 0.374649501021147 T92A-L112A 0.372827650144726 L88A-R114A 0.357356325095327 R81A-D107A 0.320755427493673 R81A-A108A 0.317224837019817 G106A-E127A 0.310607531650932 V104A-I125A 0.304454452525938 T86A-L112A 0.298759562165611 A82A-V104A 0.298243406819623 Q90A-E117A 0.286308195648029 L80A-A108A 0.279090139738123 L91A-E117A 0.278080765244096 S103A-Q124A 0.277435308108597 D97A-V104A 0.272505413447137 G83A-L112A 0.272335414015444 G87A-K111A 0.27161421745198 L94A-V115A 0.271484263360272 S103A-I125A 0.2711653445929 E79A-I101A 0.269288895723034 L94A-K116A 0.258115338361953 Y95A-H100A 0.257232338957163 L91A-K116A 0.246871987800252 Q105A-T126A 0.240667587764363 M89A-D107A 0.236354570265484 C102A-E127A 0.236192633150075 S78A-Q105A 0.23550246491414 G83A-D107A 0.228057818078286 V104A-E127A 0.223534963133653 Q84A-A108A 0.219359742315227 Q84A-Q90A 0.215776672829813 F109A-A129A 0.21404446008744 Q84A-G106A 0.211460927011828 Q105A-E127A 0.208301981844993 F85A-D107A 0.206221495787199 Q90A-F109A 0.205085728686286 F109A-E117A 0.201045641865187 L96A-L118A 0.199497577714142 W93A-K111A 0.196925637231232 Q84A-R113A 0.192359580806833 G83A-A108A 0.1886037631945 T86A-T92A 0.185845117986362 G87A-T92A 0.184586652755999 W93A-R113A 0.182203285380132 F85A-V115A 0.178119623532656 S78A-C102A 0.175411291911787 Y95A-E117A 0.174996350719551 F109A-K116A 0.174742531874856 Q105A-Q124A 0.164399722934383 Q105A-A129A 0.160852631920789 I101A-N123A 0.159094698435005 Q105A-L128A 0.155908603987304 H100A-T126A 0.149070527393648 L80A-N123A 0.148407352720202 G87A-A108A 0.144096043242594 D97A-L118A 0.14143228080485 A108A-R113A 0.140462224985982 N99A-Q124A 0.138518782351921 A82A-Q105A 0.136992664406391 R81A-G87A 0.136494741395595 E79A-F85A 0.13475191582732 L88A-L118A 0.13423381616007 Y95A-F109A 0.133176738961563 L80A-Y95A 0.133142277568247 V104A-S121A 0.132529544334228 S121A-L128A 0.130035993507555 K111A-K116A 0.126721395361411 Y95A-L112A 0.126188958972199 H98A-I125A 0.124985274468027 Q84A-S103A 0.124222618364192 S78A-D97A 0.123273689654104 A108A-V115A 0.122792234353539 G83A-V104A 0.120269460095512 A108A-L128A 0.11959825408809 L94A-N99A 0.119488852314273 N123A-L128A 0.119371042304055 L77A-Q84A 0.117985340650982 L80A-L94A 0.117636986444751 Q84A-L94A 0.117608986311076 G106A-A129A 0.114615664945042 G106A-K111A 0.113831513453372 L77A-L120A 0.113591064076346 T86A-G106A 0.112040004157251 L96A-V104A 0.111843107145683 N99A-T126A 0.109923509268704 R81A-Q110A 0.109487076985705 L77A-N123A 0.109075257604883 Q84A-L91A 0.106145034341142 L91A-L96A 0.105938061398046 C102A-L120A 0.104629119905589 Y95A-S122A 0.10366748358302 V104A-L118A 0.103643978085587 L94A-S121A 0.102054526931603 E79A-H98A 0.100431727862509 L80A-L118A 0.099280147777177 T119A-Q124A 0.0990170067514748 G106A-I125A 0.098671756687819 Q90A-R113A 0.0964018512829263 L96A-A108A 0.0963778636196523 Q110A-L128A 0.096244110292051 E79A-Q84A 0.0954755235395335 A108A-L120A 0.0946053975956489 L118A-N123A 0.0915026671769437 L88A-A108A 0.0890554506350085 S78A-S121A 0.0888659446517721 L96A-Q105A 0.0884390146410836 A82A-G87A 0.0882547303843548 V115A-L120A 0.0879318847312587 I101A-T119A 0.0877980146933549 Q105A-L112A 0.0873587708220132 I101A-S122A 0.0865318417765897 L80A-S103A 0.0850430808935858 E79A-E127A 0.0848764967766035 S78A-T126A 0.0843798516472328 L94A-K111A 0.0842921188591195 D107A-A129A 0.0839908430555059 L80A-L112A 0.0817251877340537 L77A-L94A 0.0781020327595847 L96A-V115A 0.0779517744955149 Q110A-A129A 0.0754199427443438 G83A-S103A 0.07414373575068 T86A-R114A 0.0727397316786047 R81A-Q105A 0.0726602960503804 R81A-S103A 0.0726286096153146 M89A-A108A 0.0718376373995815 F85A-L120A 0.070786588436909 G83A-M89A 0.0693540640506702 L77A-S121A 0.0669498904701822 H98A-S103A 0.0666962932195214 L88A-V115A 0.0658871894769568 E79A-G106A 0.0643375041126659 A82A-I101A 0.0621725485779301 F85A-T119A 0.0619579791135434 V104A-N123A 0.0619204324775535 Q84A-M89A 0.0615178209861857 A82A-A129A 0.0587992831870197 F85A-Y95A 0.0580229803161849 S78A-H98A 0.0577626071845385 L77A-A82A 0.0575848601837659 L77A-S122A 0.0562623860608247 L88A-K116A 0.0561312860057765 A82A-C102A 0.0561177531751778 L96A-N123A 0.0543414609580122 S122A-E127A 0.0540411779914916 C102A-S121A 0.053400360562375 F85A-Q105A 0.053388790771403 D97A-S103A 0.0524845255243543 Q90A-L118A 0.0507431836545047 Q84A-V104A 0.0506714142021685 R81A-N99A 0.0503590305543611 F85A-G106A 0.0499507550952103 S78A-L120A 0.0491516125759037 L88A-L96A 0.0490493977519391 A82A-L96A 0.0482196009017493 H100A-E127A 0.0451223857408458 L88A-F109A 0.0439388326901824 L91A-A108A 0.0439203204770215 L80A-F85A 0.0423218685930289 D97A-I125A 0.0422413204526806 C102A-N123A 0.0395043295390565 S78A-Q84A 0.0392136627712951 D97A-E117A 0.0391249836675724 G87A-L112A 0.0390756682327495 H100A-L128A 0.0384708532662219 S103A-F109A 0.0380084711461319 E79A-Q124A 0.0377090830792297 V104A-Q110A 0.0376570209137714 S103A-T119A 0.0376551255930551 R81A-L96A 0.0368975230736863 G87A-L94A 0.036250033388098 A82A-L88A 0.0359162432824465 L96A-S103A 0.0357453793152536 T92A-Q110A 0.0340707161444627 A82A-L112A 0.032676100055646 E79A-N99A 0.0325015346459487 Q84A-Q110A 0.031520913537206 L77A-S103A 0.0305539764717171 I101A-A108A 0.0299001365542679 T86A-L94A 0.0280125619232927 N99A-L120A 0.0277423273852349 S78A-A108A 0.0274680721839395 V104A-T119A 0.0267458104066995 L80A-Q124A 0.0264273928546297 S121A-E127A 0.0263684039733274 R81A-F109A 0.0258340323245203 S103A-E127A 0.0257165306222271 Y95A-V115A 0.0252148603331568 T92A-E117A 0.0249230282853881 L96A-F109A 0.0238226573758225 T92A-A108A 0.023407825737372 T86A-Q105A 0.0232504322393918 E79A-S122A 0.0231019430480006 R81A-C102A 0.0220497347250461 E79A-D97A 0.020738069583452 C102A-A108A 0.0195042528071148 T92A-K111A 0.0188094305372299 L96A-T119A 0.0183607791373444 H98A-L118A 0.0180973832166714 F85A-R113A 0.0160012952391109 Y95A-N123A 0.0155393696027972 W93A-R114A 0.0152352811968297 R114A-T119A 0.0101166846695659 A82A-G106A 0.00991656627200843 G87A-V115A 0.00930127466790598 F109A-T119A 0.00782562714243729 G87A-R114A 0.00671560113954739 L112A-L120A 0.00462467889887463 G83A-L94A 0.000428998447270401 L80A-T86A -0.00528251122500301 L118A-I125A -0.00536305490944855 E79A-L120A -0.00694437653756852 T92A-F109A -0.0077302216131212 Q110A-E117A -0.00864618605496392 Q84A-L112A -0.00976634319138819 H100A-T119A -0.0101847915546962 C102A-T119A -0.0106300969322577 L120A-E127A -0.0108622191112004 F85A-R114A -0.0114638384811504 E79A-S121A -0.0121226912982 L118A-L128A 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