[Wed Aug 24 18:00:35 2016] >Input file: TM2QFICGD.pdb >TM segments: A12-33_A35-59_A72-97_A113-132_A140-169_A171-202 MAIDEN score = -18.7879 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 ----------- ---------------- L80A-M193A 1.31253689454249 I182A-L187A 1.21928791102908 L19A-I24A 1.06485026057843 W28A-V33A 1.03404939453678 L77A-E196A 0.972254024028341 A79A-E196A 0.956371756790964 R192A-A197A 0.9545673135 K73A-A78A 0.893447418391545 W28A-I35A 0.840005009694668 I186A-L191A 0.835215198509017 L95A-F178A 0.824172233441874 H172A-L177A 0.818100035468752 M84A-A190A 0.798102190642648 L19A-D45A 0.786094075339882 L80A-F85A 0.785229053405045 A163A-W168A 0.772611972670711 L148A-D153A 0.768305282310499 N157A-H172A 0.751358294441156 V40A-D45A 0.749299828835344 A163A-W171A 0.746551093590224 E196A-L201A 0.720635050279116 V56A-E75A 0.720412463310553 L18A-L127A 0.708925609278223 A79A-D146A 0.706745749174162 L161A-H172A 0.706517189149501 L162A-H172A 0.701423970613648 M15A-L53A 0.691908621790693 L180A-Y185A 0.691418255397534 M15A-A48A 0.68368670037192 G181A-I186A 0.679041328564669 F94A-F178A 0.678234800011928 L80A-E196A 0.67742774615706 L80A-Y195A 0.664332670908199 L91A-Y185A 0.661473307974374 K23A-I46A 0.659622165615576 V56A-G72A 0.659355480065012 Y29A-A37A 0.652256562989704 L164A-Y169A 0.650048795784424 I184A-S189A 0.646152398036591 Q82A-D146A 0.643427299214013 Y29A-L36A 0.638592373986915 N52A-R57A 0.634331398022004 M15A-L50A 0.633014461399556 L19A-I46A 0.627946573169831 M84A-L191A 0.624898104705935 L127A-R132A 0.617391066704686 L80A-R192A 0.614187259867165 S83A-G194A 0.589192541052258 L36A-I115A 0.582257414122813 A14A-L19A 0.582069849122412 Y185A-L191A 0.58179445982582 N52A-A78A 0.580676666502196 Q82A-M193A 0.578935916827579 V128A-Y150A 0.570595519570923 I122A-V154A 0.570441538461764 S152A-I184A 0.568342088900658 S87A-S189A 0.567399216720136 F85A-A90A 0.541179359191586 F85A-A190A 0.529029164004847 K23A-L43A 0.527907774700231 E75A-A197A 0.523252111469898 M15A-N52A 0.516884369971524 D41A-H149A 0.516320042385707 F94A-G181A 0.515911714226752 I24A-S42A 0.510769994552476 A79A-F85A 0.505942263571878 T96A-A174A 0.504409969071415 A14A-F130A 0.503601370861792 L187A-R192A 0.502975064056742 S83A-L191A 0.502490887707517 T96A-F178A 0.4981470123154 A79A-Y195A 0.495421880981034 G158A-R173A 0.481067912148242 L91A-I182A 0.479768878356912 S87A-Y185A 0.478525977134301 S83A-S89A 0.476598062685952 I22A-T124A 0.476494467720638 I22A-L127A 0.476022449791098 M156A-L161A 0.472422224944869 A16A-L50A 0.470397011684541 L95A-I182A 0.46611354917311 M84A-S89A 0.465520451392877 L77A-S200A 0.463021717804423 L80A-S189A 0.452258509063595 S49A-L54A 0.45071552689549 A81A-S87A 0.447266228897865 A12A-V56A 0.444291939387522 L18A-K23A 0.443905029315752 N157A-L162A 0.438751211309965 S140A-A145A 0.437166079471468 L19A-S49A 0.436692801209427 S76A-M193A 0.435566641384389 S89A-I186A 0.432105741225204 G183A-Y188A 0.429779031643621 G88A-I184A 0.425362963817008 S76A-V198A 0.424737625704757 V55A-A78A 0.424562429459965 M15A-H149A 0.418735545234815 I122A-M155A 0.418437402865729 A14A-R144A 0.414368204195197 F85A-S189A 0.40827512023499 S189A-Y195A 0.404888237368797 Q131A-M147A 0.400109349234693 H149A-M156A 0.3993041886024 I125A-F130A 0.394710852143496 T13A-L18A 0.394008839009492 V56A-A74A 0.389997467589483 S83A-Y185A 0.388619127993461 S89A-Y185A 0.383664087602451 S76A-S200A 0.383006260279528 D45A-H149A 0.382994162694573 A120A-A159A 0.378866067251535 S83A-M193A 0.377539597924782 G88A-Y185A 0.374881094741239 A79A-M193A 0.37479166259118 H149A-M193A 0.374045836146748 T13A-L53A 0.373042029149035 V128A-Q151A 0.372319820496392 W171A-A176A 0.369505217674059 Y58A-K73A 0.368911737188184 A12A-L53A 0.368253457766778 A81A-I86A 0.367845069878302 L20A-S49A 0.364109944269395 S17A-S49A 0.358958408099475 E75A-A142A 0.357767828466878 A81A-A90A 0.355793833674956 S83A-R192A 0.355124094935242 S83A-Y188A 0.352348864563226 L95A-A179A 0.35185627680679 A81A-A145A 0.34978577477608 G158A-H172A 0.346441274352132 Y195A-S200A 0.345252582658906 Y188A-M193A 0.344952518568489 L18A-S49A 0.344517227503165 G72A-E196A 0.344493973741069 T117A-C123A 0.343163752511064 L19A-A48A 0.341383729800955 A81A-M193A 0.341005819925604 A48A-A79A 0.340770801760168 F94A-L177A 0.340332867884737 G158A-A176A 0.339334913808867 S76A-A142A 0.339289836695836 A142A-M193A 0.334779517443685 S76A-Y195A 0.334238496991518 I122A-M156A 0.330228895414891 A74A-A81A 0.328108691278771 V154A-Y185A 0.326585977693542 T30A-A37A 0.325729328200735 G72A-A142A 0.324694277566763 M15A-I22A 0.3246861368991 S87A-A190A 0.3218688678099 S152A-A179A 0.321250920801768 R132A-D146A 0.320589728206683 L148A-V154A 0.315960392363676 T30A-I35A 0.313645197061646 M15A-L20A 0.31072816535137 K73A-A81A 0.309975389719224 Q82A-H149A 0.305145212172019 Y195A-L201A 0.303402973093993 I118A-A159A 0.301572651938122 G72A-A79A 0.30112032936878 M84A-G194A 0.300417190087893 Q82A-E196A 0.299881930735505 L95A-G181A 0.298518683892172 S76A-Q199A 0.298344988714769 I125A-V154A 0.297087154015999 D146A-M155A 0.297033759686358 G72A-A197A 0.296061033788316 T30A-L36A 0.295977215812577 D41A-I46A 0.295380514239771 A14A-L127A 0.294811504084843 Y29A-I35A 0.29391909093429 G88A-Y195A 0.291766948550406 G47A-H149A 0.288229614627125 F94A-I182A 0.286889817222368 G183A-L191A 0.285778063798814 I46A-T51A 0.284230974832749 G158A-L180A 0.284112195347939 L161A-A176A 0.279682797061349 G158A-Y169A 0.27956273184291 Q82A-S189A 0.27359207968053 V119A-D153A 0.272727583727463 L18A-G47A 0.272156541355648 V40A-M155A 0.27134412553589 L50A-V55A 0.269686752314296 A12A-S49A 0.268318508105535 L20A-F25A 0.268109889731628 S76A-Q141A 0.267196152231908 I118A-M156A 0.265404090825609 E196A-L202A 0.260844733870518 M15A-D153A 0.256620317213037 E75A-G194A 0.256615642163674 Y188A-G194A 0.255938541748371 N52A-S140A 0.253886171393942 Q151A-S189A 0.253581695834615 L77A-M193A 0.253222813434696 Y58A-S76A 0.2521167519727 Q141A-S200A 0.251848063626888 M15A-T51A 0.250904633182622 L91A-G181A 0.250452922870791 Q141A-G194A 0.250293218323025 N52A-G72A 0.249354438110305 D41A-D146A 0.249218952734705 D45A-V154A 0.248896486730887 G88A-Q151A 0.248198785150852 M155A-R173A 0.245096034960287 M147A-R192A 0.24444053434404 M84A-I186A 0.244208090147346 Y185A-R192A 0.244010497202793 S49A-Q82A 0.242547259895154 N157A-G181A 0.241117992492327 M15A-R132A 0.241064394329602 D41A-M156A 0.240637837819397 H149A-G183A 0.239505449698908 A37A-G113A 0.239149682930545 A142A-E196A 0.238092672303374 L39A-T117A 0.237340230135577 Q82A-Q199A 0.237074874623012 S152A-G183A 0.236815916083055 A79A-R192A 0.236388638692855 L53A-S59A 0.235440396212858 K73A-R144A 0.235221503465674 S87A-Q151A 0.235138009805662 A90A-Y150A 0.235044464911607 I125A-Y150A 0.2333538231604 A26A-A37A 0.232594087628259 L77A-Q199A 0.231755187176969 A78A-R192A 0.231470859243644 I24A-V40A 0.230721648594661 D175A-L180A 0.230538587242497 A48A-Y150A 0.229791454496402 S140A-S200A 0.227464865321872 F92A-A179A 0.227083452991149 A163A-A174A 0.226198801868973 S17A-S140A 0.226054576066171 A90A-Y188A 0.22528449202409 S49A-S59A 0.225282047756972 R173A-F178A 0.225197060363828 F94A-G183A 0.224959656537068 T13A-L21A 0.224217621400394 H149A-L180A 0.223605089285416 Y58A-E75A 0.222737252479128 K23A-Y150A 0.222571473931436 V44A-D153A 0.22218870529327 I182A-Y188A 0.221319452030933 S76A-S87A 0.218192257773374 G181A-L187A 0.217432679787514 T13A-Q141A 0.216476170131007 S76A-V143A 0.212977634532201 A26A-A120A 0.212292835127114 A16A-N52A 0.21193537327921 G88A-L95A 0.211925137110983 V143A-G194A 0.211436604960742 S152A-A176A 0.211095416021509 C123A-Q151A 0.208970184075122 R57A-A78A 0.208022270094643 G158A-L177A 0.207818711656132 A16A-F130A 0.206755835299444 I118A-V154A 0.205824532101031 V55A-E75A 0.204668867253821 G165A-W171A 0.204002401118191 M84A-L93A 0.202852363046023 I22A-W27A 0.201653967874307 T13A-I126A 0.201250464782124 T51A-L77A 0.200633286543157 T117A-T124A 0.199167959434529 N52A-L80A 0.198945242918378 R57A-E75A 0.198762634794541 L20A-T51A 0.198278313394853 S87A-Y150A 0.197701384818659 N157A-L164A 0.195377489848666 Y58A-A74A 0.195342100532796 M15A-V44A 0.195259988594374 S32A-A37A 0.192919108396223 A145A-M193A 0.192144048002201 A79A-Y188A 0.191579150246148 R144A-Y188A 0.191258065228014 R132A-V143A 0.190936917443995 A145A-G194A 0.190579361895155 G47A-V55A 0.189047032814687 A48A-A81A 0.187954415001212 D153A-A159A 0.187632977588723 A81A-R144A 0.18748988735632 G88A-S152A 0.187024553425513 E75A-L80A 0.187001139738559 A163A-Y169A 0.185972365701874 S89A-M155A 0.184950099593837 I22A-V44A 0.184549310469257 S87A-M155A 0.183801720557284 V128A-M156A 0.183076313196596 T96A-W171A 0.183075857884582 M155A-L177A 0.182873840600415 K23A-D146A 0.182436651238519 V143A-Y188A 0.182234264086797 D45A-L50A 0.181152333976391 D41A-G47A 0.180569930914632 V128A-M155A 0.179942177903254 S42A-N52A 0.179629544858393 S17A-L53A 0.179016054470864 T96A-H172A 0.178064536382089 M147A-L191A 0.178017398082986 S140A-Y195A 0.177534820736773 Y150A-S189A 0.177436191451385 L39A-M155A 0.177048269094735 S152A-A159A 0.176931177419583 A48A-L53A 0.176174725526057 D41A-Y150A 0.176027260150786 M15A-Y58A 0.175371012100248 A26A-L121A 0.174154664919307 S42A-M147A 0.174145082225088 A14A-I126A 0.173375998270291 I125A-H149A 0.172679314983302 S167A-A174A 0.172357693130889 M15A-S76A 0.171942013719177 G72A-L202A 0.170300129505854 M84A-S152A 0.170272398345767 R144A-H149A 0.170130766818705 A163A-H172A 0.169123161719104 Q131A-A145A 0.168818201026504 A26A-S32A 0.168545038619479 S89A-M147A 0.167635147875291 A90A-G97A 0.167516366589982 K23A-L39A 0.166673061575383 V55A-A74A 0.166637866661038 R57A-S140A 0.166204633152311 A37A-V119A 0.165262270214102 A74A-R144A 0.164984394758924 T124A-H149A 0.164831780353178 H149A-V154A 0.164696951670969 K23A-T51A 0.164578454510639 G97A-W171A 0.163994635120082 G72A-A145A 0.163718013760163 A26A-I122A 0.162469435157472 G97A-D175A 0.162178089941911 M15A-R57A 0.162025120175004 G72A-A81A 0.161918964289962 A26A-D41A 0.161707060789599 T13A-A142A 0.161656498306063 S49A-V143A 0.161346401886922 V154A-G181A 0.160960728315668 T51A-D146A 0.160878400740475 K73A-Q199A 0.159264428625747 S89A-F94A 0.158955925890904 S89A-H149A 0.158918314973064 R144A-S189A 0.158635428100602 G47A-M147A 0.158367576594723 L162A-W171A 0.158115098216781 L91A-T96A 0.15762462208794 S42A-Y150A 0.157393026604299 I122A-N157A 0.157365056901342 L148A-G183A 0.157136850310833 Y188A-Y195A 0.155929263193878 S129A-R144A 0.153717717869028 L53A-Y58A 0.15361434588213 S83A-S200A 0.153588965331456 A79A-G88A 0.153500541585391 M15A-I125A 0.152854559722618 L166A-H172A 0.152580958810255 S42A-S152A 0.152265347005681 Y29A-V116A 0.15177265772982 I46A-I86A 0.151620852149351 S17A-R144A 0.151358051622392 V55A-A142A 0.151036402132126 D146A-Y185A 0.151035131413841 I22A-I46A 0.150518893340603 T13A-K23A 0.149748622679584 A120A-I126A 0.149472248919293 L54A-K73A 0.149141809619026 S17A-G47A 0.1482961013107 T30A-T117A 0.148189958802165 D45A-N52A 0.148168582676267 Q82A-G88A 0.14741434375942 T51A-K73A 0.147355121775669 V128A-M147A 0.14719974330959 A38A-V116A 0.147188937973002 L54A-S140A 0.146901850518293 H149A-A179A 0.146364777411424 A14A-D146A 0.144369149537314 M84A-G183A 0.144127464305503 S83A-Y150A 0.143744206552982 M156A-R173A 0.143708357789887 A78A-M84A 0.143306027863377 S189A-V198A 0.14302010612467 G165A-H172A 0.142385588318474 E75A-Q82A 0.142329988732839 G113A-I118A 0.142214384050353 I126A-R132A 0.142199267660349 K23A-W28A 0.141866433646499 A14A-Q131A 0.141770192247149 M147A-L187A 0.14151443964629 M147A-D153A 0.141471252144821 S152A-Y188A 0.140835555685288 V44A-S49A 0.140535647125144 S17A-T51A 0.140250879363543 G88A-D146A 0.140007775945161 S87A-Y188A 0.139588670392026 V44A-V154A 0.138923138978898 V154A-I160A 0.13880588572691 V56A-S140A 0.138241314206983 T124A-S152A 0.137417125595689 R144A-D153A 0.136527358767055 L80A-V143A 0.136319715936894 A174A-I182A 0.136142456806978 K23A-I126A 0.135773876248543 S83A-A142A 0.135766314645158 V44A-S87A 0.134514448174062 M155A-I160A 0.134374929400519 I122A-D153A 0.133694581076683 T13A-A145A 0.133150756952974 S17A-V56A 0.133044726743878 A159A-A174A 0.132965558255078 N52A-S76A 0.132945844438251 Y185A-Y195A 0.132603999425235 L21A-I122A 0.132573814793615 N52A-D146A 0.132207824040824 V40A-A48A 0.132066968383224 I86A-A145A 0.131964683269644 M84A-Y150A 0.131819654082636 A74A-A145A 0.13163069810682 A12A-A145A 0.131570716321562 M15A-Q141A 0.130563254467992 A159A-D175A 0.130464197709606 L53A-M147A 0.130358982264505 L54A-S76A 0.130324333929202 T30A-I115A 0.130251154380867 E75A-S189A 0.129952423000433 L80A-L187A 0.129894001437604 R57A-Q141A 0.129799802052222 L180A-S189A 0.129763660716867 D175A-G181A 0.129240169444962 L43A-I86A 0.129148069959355 L19A-V128A 0.128972855077111 V44A-M147A 0.128500910026566 D146A-M193A 0.128471811275604 N157A-L180A 0.128405913084683 A16A-Y58A 0.128387142789865 A26A-A38A 0.128033067521871 S129A-H149A 0.128008909635045 I22A-L53A 0.127949188743118 A14A-Y150A 0.127821650912163 G47A-A78A 0.127808896713052 L191A-V198A 0.127762009984822 S17A-I126A 0.127597495727647 K23A-I125A 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