[Thu Aug 25 00:28:47 2016] >Input file: TM2QOMCGG.pdb >TM segments: A15-68_A73-88_A92-100_A122-129_A141-146_A166-172_A191-196_A219-224 MAIDEN score = 326.1364 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. ----------- ---------------- BBeads pair Empirical energy ----------- ---------------- V146A-I167A 10 E144A-R169A 10 S64A-T75A 10 T62A-S77A 10 T170A-Y193A 10 V172A-L191A 10 Q142A-G171A 10 D52A-M87A 10 S34A-S67A 10 V44A-F57A 10 Q194A-R221A 10 T38A-D63A 10 V42A-V59A 10 T60A-G79A 10 R21A-Q41A 10 V40A-H61A 10 D196A-D219A 10 H48A-L53A 10 K99A-Y122A 10 W19A-G43A 10 K47A-L53A 10 I97A-G124A 10 K46A-T55A 10 A125A-L145A 10 F54A-S85A 10 A84A-L96A 10 N36A-S65A 10 D95A-E126A 10 M23A-H39A 10 A86A-I94A 9.20929592834386 T58A-G81A 3.65116050987433 G168A-F195A 3.1783883563686 Y93A-G128A 2.99120990590973 L51A-M87A 1.76519943047991 A80A-Y100A 1.34827791040727 Q41A-H61A 1.30947897881215 L191A-L223A 1.25901682144852 L145A-I167A 1.24574693495981 L166A-D196A 1.20158610788085 G192A-L223A 1.17434376132661 L82A-I97A 1.17132206519934 T60A-V78A 1.07823492697962 I167A-F195A 1.07270833214137 L82A-G98A 0.942548818793618 W19A-V44A 0.900481586311438 V146A-L166A 0.875361154716103 W19A-Q41A 0.853520451054493 F57A-L82A 0.848648338135341 Y37A-T62A 0.816621805188992 W19A-V42A 0.802618107230153 M23A-T38A 0.795839241056327 V42A-F57A 0.792160140422267 I22A-V40A 0.770854097346713 F54A-Y83A 0.756875359985074 K99A-A123A 0.753005920441852 Q194A-L223A 0.747979285181717 L53A-S85A 0.736214595763934 V44A-T58A 0.716070328611875 T58A-A80A 0.700462030262456 I94A-E126A 0.679828874493879 A123A-L145A 0.677114606800343 L51A-A86A 0.664347133357019 I94A-G128A 0.664002416015028 T58A-L82A 0.655273922740093 F54A-A86A 0.654521894529137 L191A-M224A 0.64949369203566 S67A-G73A 0.645292058089539 L82A-L96A 0.641515839194919 I97A-Y122A 0.632800405101404 R21A-H39A 0.630392426438199 G27A-F33A 0.619156396147718 L51A-F88A 0.615049243633436 E15A-D45A 0.610260049661091 V42A-T60A 0.593760728019952 F33A-S67A 0.584238951436198 V40A-D63A 0.574250570448575 F195A-S220A 0.571642804756409 A127A-P141A 0.569860345541518 A84A-I94A 0.558680935481916 L53A-A84A 0.557885259592412 G17A-K46A 0.547182750684905 L166A-F195A 0.544394497027609 F33A-A66A 0.538526730220013 T62A-V78A 0.536755747879765 Y122A-V146A 0.519710060987237 Y129A-Q142A 0.514563569940599 G56A-Y83A 0.495448170597394 A20A-Q41A 0.495195232855075 I97A-A123A 0.485677928240271 Y193A-L223A 0.477380038268998 Y83A-I97A 0.475569666867259 Q41A-Y100A 0.474207578523828 A66A-K74A 0.467226080423417 F195A-R221A 0.466274296563982 E144A-I167A 0.462372206653504 V42A-T58A 0.452319625269896 H61A-K76A 0.451667886920351 S64A-G73A 0.448887162649019 V40A-T62A 0.435395209198502 E49A-T55A 0.434505208647483 T170A-L191A 0.428525925078966 T62A-T75A 0.425680589830685 K46A-F54A 0.416158447412649 V146A-R169A 0.413942753053657 S85A-Y93A 0.405145837710169 Q194A-D219A 0.402820560304128 Y193A-S220A 0.399567487947395 S24A-H61A 0.39722166299456 V40A-T60A 0.395600047812639 S34A-S65A 0.392371054829177 A20A-V40A 0.389393543390408 I94A-A127A 0.386000172519706 G25A-Y37A 0.377567163176447 T170A-Q194A 0.376783731446536 E126A-T170A 0.375528922657223 R169A-F195A 0.374833305092653 R169A-G192A 0.373735078064552 W19A-V59A 0.373563869643927 S28A-F33A 0.373330474588415 D45A-Y83A 0.371976474444109 A86A-A125A 0.362756276891518 T38A-T75A 0.36225783769506 F88A-Y93A 0.358971360124636 Y93A-G124A 0.355752543853902 G81A-I97A 0.354368091614088 V44A-T55A 0.349812449321118 M87A-Y93A 0.344098794503482 Y93A-G171A 0.342556500866736 M87A-A92A 0.341129262332594 M23A-Y37A 0.340992892777202 H39A-H61A 0.339011345278941 A127A-E144A 0.333860681315604 S77A-K99A 0.333616157328474 E126A-G171A 0.333043726359203 E126A-G168A 0.332733189839479 A20A-G43A 0.332093075384477 I22A-H39A 0.330334343969672 G27A-A68A 0.329639260374817 G25A-A66A 0.328462746111537 G79A-K99A 0.327807175684477 V59A-Y122A 0.326539679034148 V59A-V78A 0.326045806281037 S85A-L96A 0.319888639688584 G192A-M224A 0.314195171468317 G32A-G73A 0.313422663022234 A125A-A143A 0.312542624207806 A92A-A143A 0.311193499104377 L191A-M222A 0.310277591883773 L53A-M87A 0.307248668994895 E144A-G192A 0.305254737537815 R21A-Y37A 0.303546722500834 A16A-K47A 0.301549250889829 D45A-M87A 0.299946414575506 I94A-A125A 0.299077098205387 I22A-Q41A 0.298257391514949 K46A-G56A 0.295028009624406 G43A-H61A 0.294954815545702 G31A-A66A 0.293455334589103 H39A-S65A 0.292573922801855 Y83A-D95A 0.288770141317552 R169A-M224A 0.287289891684368 G25A-H61A 0.287283788356406 A84A-A123A 0.283549770011284 G124A-L166A 0.28265893448696 G17A-L53A 0.281558600487976 V146A-D219A 0.279095687896401 H61A-G79A 0.278314114768805 N36A-K76A 0.277894354234274 V44A-V59A 0.27701489527161 G56A-A84A 0.275246164973086 A143A-G171A 0.269306577062853 S85A-G124A 0.26903798433194 V59A-G79A 0.267526680739171 F54A-D95A 0.26654540137074 Q194A-M224A 0.263346170007722 F57A-A80A 0.260341447217288 D95A-V146A 0.254849678998632 F88A-I94A 0.253587033459851 H39A-T60A 0.25224418817023 G192A-R221A 0.250733320514714 V40A-V78A 0.250481257592597 L145A-G168A 0.249605889877769 G128A-A143A 0.249385668740365 Y37A-S77A 0.249224620336733 V40A-V59A 0.246910594292111 I97A-A125A 0.245758045594245 T38A-H61A 0.245040020294548 G32A-S67A 0.241560317396374 Y83A-A123A 0.237689762886478 T38A-S64A 0.235336725500763 G192A-M222A 0.235276270389978 F88A-E126A 0.233479793464132 D45A-V59A 0.230010126062625 A86A-L96A 0.229395837911295 A16A-G56A 0.228091081042789 W19A-H39A 0.22562931844831 S30A-S65A 0.222382085520035 R21A-V59A 0.219788530738293 F57A-Y83A 0.216952120295869 A20A-F57A 0.216745674516488 L96A-A125A 0.216481719600018 S85A-A127A 0.214519843412533 S24A-S77A 0.213720621943396 G168A-Y193A 0.211805827707517 S24A-Q41A 0.209292557837748 I22A-T38A 0.208941653166522 T62A-G73A 0.208936083139603 S24A-S34A 0.207820977016747 D45A-F54A 0.207465106176305 G98A-A123A 0.207169609665517 M87A-I94A 0.207099753558913 G25A-T38A 0.207094237210672 D63A-G73A 0.206194246053164 F54A-M87A 0.206136653306807 H48A-Y83A 0.205796439398867 S85A-G128A 0.203263189408485 G27A-T38A 0.202983093792811 S28A-S64A 0.202905694190507 G31A-A68A 0.202415193027052 D95A-L145A 0.20203317851406 T26A-H39A 0.201345882126462 L51A-S85A 0.194980427416249 T55A-S85A 0.192214819271554 T26A-T62A 0.190946768530322 M23A-V40A 0.189827928035013 F33A-G73A 0.189790980768862 Q142A-R169A 0.189729134261616 L96A-A123A 0.187153322365081 R21A-H61A 0.185348550038005 Y83A-A125A 0.184701136856034 Y37A-S67A 0.184366601497177 V40A-Y100A 0.183751822678784 V146A-Y193A 0.182215218766859 H48A-M87A 0.181941975559217 V44A-L82A 0.181067604976945 G56A-Y100A 0.180467181623034 Y129A-E144A 0.178135440882767 S28A-Y37A 0.178118262800152 G27A-N36A 0.178103289862301 G168A-L191A 0.177453372394243 S85A-A125A 0.177036613579369 D52A-Y93A 0.17546158792822 T38A-G79A 0.174520144846396 H61A-G81A 0.174371032231662 G128A-G192A 0.173732355606167 G27A-S64A 0.173641955580082 A86A-A92A 0.172503381823255 D35A-T75A 0.169395880078703 H39A-G79A 0.168698620159353 P141A-G168A 0.167106001729761 F88A-A127A 0.165172440375748 T55A-D95A 0.164145478698783 A86A-G98A 0.164096042959325 H48A-F54A 0.163810312714019 G98A-V146A 0.163412306525031 T26A-D63A 0.163012895385874 H39A-K74A 0.161464903454476 H61A-Y100A 0.161376217868021 V44A-G56A 0.160532540517069 A125A-V146A 0.159915540223361 G81A-G124A 0.15954189633792 A127A-A143A 0.159418009532441 H61A-K99A 0.158851791933092 G56A-K99A 0.157198417671331 T170A-D196A 0.155911665955004 K46A-T58A 0.155900431623418 D45A-A84A 0.155325629592264 G124A-G168A 0.15429547817929 A143A-F195A 0.153692723092044 G128A-G168A 0.1523415331481 A84A-I97A 0.150361064337528 A29A-D35A 0.149427887556504 D95A-G124A 0.148942334090644 V44A-S85A 0.147567713218538 W19A-T55A 0.146297678479936 W19A-T60A 0.146209824600143 L53A-A86A 0.146125587231003 Y93A-L145A 0.146030161513718 H48A-A92A 0.145633297742554 G43A-A80A 0.145065269607321 M87A-A127A 0.145011723286517 T26A-T75A 0.14449491146049 G81A-A123A 0.142800037519348 E49A-F54A 0.142594056235468 G168A-M222A 0.142509439170216 V78A-Y100A 0.142438678445867 G168A-L223A 0.140800047621433 G56A-G81A 0.140577801344608 A127A-G168A 0.14010176635743 T26A-S64A 0.138936208685329 S24A-M224A 0.138519724182053 H39A-T75A 0.13742978918766 Y129A-L191A 0.135671725207026 G43A-V59A 0.135621307932451 S64A-V78A 0.135531239535107 S30A-A68A 0.135248513606257 A123A-A143A 0.132354802186852 T60A-S77A 0.132109276381519 A29A-N36A 0.131563346215361 M23A-H61A 0.13149988808748 V42A-K99A 0.130107455588547 G171A-L191A 0.130101506791286 P141A-T170A 0.128673605213385 L96A-V146A 0.128589670919015 Y83A-Y93A 0.128375945413775 I97A-V146A 0.127578993083739 A84A-E126A 0.127004788196635 W19A-G56A 0.126646198526977 G124A-I167A 0.126560762725362 E15A-F54A 0.126077534624176 A18A-D45A 0.125721213468155 M23A-V59A 0.125701905481637 P141A-G192A 0.125257645880476 R169A-M222A 0.123882231461461 G79A-I97A 0.123762414868792 D52A-Y83A 0.1232339931083 Q142A-I167A 0.122956461918147 E126A-R169A 0.122841316195763 T60A-G98A 0.122406334442819 E15A-G43A 0.121908277285357 L53A-L82A 0.120626578614283 I22A-V59A 0.120145846660794 G43A-F54A 0.119895499177662 E126A-E144A 0.119842872482072 V40A-S64A 0.119428609160466 G168A-D196A 0.11683090391394 H61A-V78A 0.116032531253564 K46A-D95A 0.115904467454737 H48A-A84A 0.115476309026803 A86A-Y129A 0.114645863695392 S34A-T75A 0.114570421310583 E126A-P141A 0.11455918099363 A143A-L191A 0.114317336618774 K46A-L82A 0.114254363069777 A80A-G98A 0.113812128082323 G98A-G124A 0.11195716828811 G17A-F57A 0.108953479973285 G17A-T58A 0.108714814732843 T38A-T62A 0.10869590370752 Q142A-L191A 0.108419739521 A84A-A92A 0.107305956304906 L50A-S85A 0.107097973745978 A80A-G124A 0.106928138175503 G43A-A84A 0.106857799173746 S85A-A123A 0.106768797474478 A16A-L51A 0.106372735876239 L96A-G124A 0.106241280067021 S30A-A66A 0.106073398738589 V78A-G98A 0.106030536273664 A127A-I167A 0.105780265882196 A29A-S65A 0.104867187755677 G56A-G124A 0.104792486223332 R21A-T62A 0.104700734220418 A16A-S85A 0.104668350906506 F88A-G128A 0.103602291983631 G128A-Y193A 0.103358693920971 F57A-G98A 0.103281631622717 G56A-G79A 0.103100810173058 L166A-D219A 0.103005153920011 T58A-Y83A 0.102660270741026 A18A-T58A 0.102195474610831 A86A-G124A 0.101912238006606 A125A-G171A 0.101715962796085 G128A-T170A 0.100936846878452 K99A-L145A 0.100748453311159 G25A-T62A 0.10049035139635 G27A-G73A 0.100354810504737 V44A-G79A 0.100052986795251 Y122A-L166A 0.0996345542449557 W19A-H61A 0.0985811074006149 S24A-A66A 0.0984955091517075 A16A-V42A 0.0971504061448285 S77A-Y122A 0.0970508280163092 E144A-Y193A 0.0968234867662732 A123A-G168A 0.09666165039107 D52A-L96A 0.0966393653569328 I167A-S220A 0.0962465991639894 T58A-G79A 0.0960343606196918 D35A-K76A 0.0951923115440143 H39A-V78A 0.0949771347590183 S28A-N36A 0.0948379321466524 L166A-Y193A 0.0943746226435307 T58A-S77A 0.094151059512579 R169A-S220A 0.0940947549723996 W19A-K46A 0.0934807307834218 S28A-R221A 0.0933370237406326 I167A-G192A 0.0933169021771758 L50A-A86A 0.0932178786344093 S28A-Q194A 0.0926592568110705 V42A-A84A 0.0926466645006374 R21A-G79A 0.0918946409100156 G43A-G79A 0.0913451098689033 A86A-E126A 0.0907229591191299 T55A-E126A 0.0900725951630021 Y83A-E126A 0.09003738436193 N36A-A68A 0.0899781013043386 A84A-Y122A 0.0898891989934585 Y93A-V172A 0.0897577715679567 T55A-G98A 0.089555193595629 V40A-A80A 0.088892739596258 G43A-G98A 0.0886804784085578 F54A-E126A 0.0883992355831067 D95A-P141A 0.0880764701303258 T170A-S220A 0.0871784486617249 D45A-L53A 0.0863988359167003 L53A-I97A 0.0857958127178264 F54A-G81A 0.0857818052281929 G17A-V59A 0.085529189193942 G27A-M222A 0.084874341953129 G56A-I94A 0.084660567026783 L166A-R221A 0.0838639413329735 A29A-G73A 0.0834271457984772 L145A-L166A 0.0826986610247045 G25A-G73A 0.0821485159030233 Y122A-E144A 0.0820853802153438 R169A-R221A 0.0820795813367572 A92A-A125A 0.0820497718287321 F54A-G98A 0.0818423481601096 G17A-G43A 0.0815800677576384 S30A-N36A 0.0814906256102752 G56A-L96A 0.0814444036594352 G56A-L82A 0.080611631158451 T58A-S85A 0.0804106480825951 E15A-G56A 0.0802233236414676 H39A-T58A 0.0795617990117679 L82A-G124A 0.079281408840819 V59A-I97A 0.0792797000513961 A20A-T38A 0.0789226137919994 F57A-D95A 0.0788897171003207 T38A-V78A 0.0780360139607508 G17A-G81A 0.0764279209925391 G31A-G73A 0.0758391766715306 A143A-G192A 0.0752114982134824 V42A-S77A 0.0748807677590047 V44A-L96A 0.0745102710724749 I97A-A143A 0.0739104062918177 S85A-A143A 0.0738328146656615 G27A-S220A 0.0731110198477047 G25A-T75A 0.0728925239127367 D95A-A127A 0.0727388407477125 V78A-Y122A 0.0726548114910024 A18A-Y83A 0.0724631392722457 S30A-S220A 0.072320067401471 T26A-S67A 0.0722295444326275 Y100A-V146A 0.07218233322613 K46A-L51A 0.0720030401110874 S24A-T62A 0.0718037866789922 L50A-I94A 0.0712785250569317 G56A-A123A 0.071209337766013 V44A-G98A 0.0709117036021509 Y93A-E144A 0.0703562145727071 K46A-Y83A 0.0703380505964173 S64A-S77A 0.069692002835172 Y83A-Y100A 0.069690095564634 G98A-E126A 0.0693347100098154 A18A-V44A 0.0692243551557805 Q142A-Y193A 0.0690801896571407 Q142A-R221A 0.0690415685478107 S28A-D196A 0.0688769947149805 T55A-Y93A 0.0688545630085797 T60A-Y122A 0.0682479103520897 A18A-H48A 0.0672301149790799 G81A-A125A 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