[Fri Aug 26 18:34:06 2016] >Input file: TMQ8K099S1D.pdb >TM segments: B93-128 MAIDEN score = -1.0840 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 ----------- ---------------- S96B-L119B 1.08260030930566 L103B-L127B 1.05853511734752 L95B-L119B 0.802420351991691 L98B-P123B 0.707985634204141 L101B-A126B 0.669098565059755 L95B-N117B 0.626434286910406 E97B-F122B 0.510345760929159 E97B-V120B 0.494914877960454 F122B-L127B 0.440369845494882 L98B-F122B 0.422256374302174 R104B-L127B 0.391432523148572 A100B-A125B 0.387381813664297 N93B-P115B 0.386938586699834 M102B-A126B 0.3731950005661 S96B-P115B 0.36340024563385 M102B-L127B 0.34213111278576 G105B-A126B 0.319350698057312 P115B-T121B 0.293011928926483 L103B-A126B 0.289372041658031 M102B-R113B 0.288740209544196 L103B-A125B 0.288083047342064 S99B-P123B 0.282737125204881 A100B-L127B 0.278786159493216 L103B-R128B 0.276077379630033 R104B-A125B 0.250306267712157 R104B-A126B 0.247968524661999 M102B-R110B 0.245522893006154 M102B-R108B 0.233327104819452 L114B-T121B 0.208131567089108 N93B-L114B 0.193270965115442 R104B-L109B 0.183812042614518 R108B-R113B 0.182066321606262 S96B-G116B 0.178226976276314 R107B-A126B 0.175150172368845 A100B-G105B 0.174914463610592 N93B-G116B 0.167798809172712 L112B-N117B 0.164821518460358 G105B-A125B 0.162823713808207 P123B-R128B 0.161160296239724 S96B-V120B 0.158846330382369 L95B-M102B 0.150210026574039 N93B-R118B 0.141355830413442 A94B-R113B 0.128005672520452 E97B-G116B 0.127383371286051 E97B-T121B 0.119814147654129 R113B-F122B 0.117678809181418 S96B-M102B 0.1162085319384 L98B-L106B 0.114379272497306 A100B-L109B 0.114296189008625 A100B-L112B 0.11418545905721 R104B-R128B 0.109922694362114 L114B-P123B 0.108223735434025 S99B-G105B 0.106383125384129 L98B-L112B 0.106121999101678 L106B-A126B 0.100074557671416 L98B-L109B 0.0982674780006678 L95B-P123B 0.0891707324909401 L109B-L114B 0.0882099487543864 L119B-L127B 0.0881347082310853 L95B-L112B 0.0867362618657452 R108B-L127B 0.0860875815566233 A100B-V120B 0.0821592039164898 S99B-N117B 0.081464637209602 L103B-L112B 0.0805660605722638 R104B-P123B 0.077452075784278 R104B-L112B 0.0729232699245511 G105B-R128B 0.071317246809611 L119B-A126B 0.0712905229787744 E97B-R118B 0.0700842921788336 L106B-A125B 0.0698681481038497 L95B-G116B 0.0685357924217023 T121B-R128B 0.0678529135363198 L101B-L109B 0.0672400604752865 L101B-R128B 0.0655856867898954 E97B-P115B 0.0642706354457641 L106B-E111B 0.0638748174993564 L98B-R128B 0.0595842529908324 L98B-A125B 0.0591444902919847 L109B-A126B 0.0573239204907492 L112B-A126B 0.0567347132183689 L106B-P123B 0.0566909157085504 L95B-A100B 0.0557849102968087 L106B-R113B 0.0538758024004835 N93B-L112B 0.0527716669044862 R113B-L127B 0.0499145732145645 L98B-P115B 0.0494935181446827 E97B-L103B 0.0479110915764469 G105B-L127B 0.0457706486896243 S99B-L119B 0.0456049832652452 L98B-G105B 0.0454975448163222 P115B-V120B 0.0432577979077342 M102B-T121B 0.0430527516924128 T121B-A126B 0.0429801617327561 R118B-P123B 0.0381884953415956 S99B-L106B 0.0367089793875686 E97B-N117B 0.0361313046580528 S99B-T121B 0.0334307710783261 L95B-T121B 0.0310920874788945 E97B-M102B 0.0293756178963682 A94B-T121B 0.0285075641931536 L103B-L114B 0.0270832902684228 L119B-W124B 0.0270044867793668 L95B-R113B 0.0261939625616252 S96B-N117B 0.0228730238819259 S99B-V120B 0.0207924545269984 L98B-T121B 0.0187266580857006 S96B-F122B 0.015096142203922 A100B-P123B 0.0111424904665585 G105B-E111B 0.0109743676709961 A100B-W124B 0.0105563912496942 A94B-V120B 0.00581252217653661 L112B-T121B 0.00549367574072701 L106B-R128B 0.00272742130145698 L98B-A126B 0.00104599684554918 A100B-L106B 0.00051082971673555 S96B-L127B -0.000856123179505605 G105B-R110B -0.00101842616808501 L95B-F122B -0.00141311509570308 L103B-E111B -0.00429830739898573 S99B-R104B -0.00999996521652591 N117B-F122B -0.0105412505725075 E97B-A125B -0.0106522774243611 E111B-L127B -0.012113474982699 R107B-R128B -0.0124175459544893 A94B-G116B -0.0128099186095412 L101B-L127B -0.0137199237056977 L103B-T121B -0.0161152062324867 L109B-R128B -0.016544144018666 R108B-A126B -0.0191549578002093 R107B-L127B -0.0208794796108105 R113B-T121B -0.0210577291794212 G105B-L112B -0.0220054229682694 L112B-L119B -0.0239376771998447 A100B-L119B -0.0242955332177344 V120B-A125B -0.0288536697635724 A100B-F122B -0.0320479823459041 L103B-F122B -0.032247002074751 M102B-L114B -0.0331907697702283 E97B-A126B -0.0333873302679786 L98B-L127B -0.0365826096631308 R104B-E111B -0.0373750076609256 S96B-W124B -0.0396593697966119 V120B-A126B -0.0405415828469922 L112B-R128B -0.041538119577206 N93B-V120B -0.0422910687074531 R108B-R128B -0.0456558219742229 L101B-R108B -0.0501046322859411 L103B-R113B -0.0520832795862962 R113B-R118B -0.0522916843189796 N93B-L98B -0.0586086680611881 S99B-F122B -0.061533924869293 R110B-R128B -0.0632851877021847 R104B-R110B -0.0659079521431588 S99B-R118B -0.0688707383424427 G116B-T121B -0.0722870687201231 L101B-L106B -0.0731377086671632 A100B-R107B -0.0744890106921998 S99B-R128B -0.0748444251866387 S96B-R113B -0.0781619028962339 S99B-R107B -0.081671718249622 A94B-L119B -0.0857657272963905 M102B-L119B -0.0871780475575337 L98B-G116B -0.087995731543467 E97B-L127B -0.088270585179459 G116B-F122B -0.0959897492579884 L112B-P123B -0.100058360116093 A100B-T121B -0.10111779597165 L112B-F122B -0.101224608866568 S99B-L114B -0.101243775024374 E97B-P123B -0.103277371546135 L109B-L127B -0.104803184160457 V120B-L127B -0.104934441844736 S96B-T121B -0.108953807477863 S99B-L112B -0.109157884684463 A94B-S99B -0.111240009420749 A94B-P115B -0.111810693390984 L98B-R104B -0.115895125921561 L101B-R107B -0.12378979600558 M102B-E111B -0.124108899248644 L101B-L112B -0.124151665121827 E97B-R113B -0.12646768588731 R113B-L119B -0.128235710514675 R104B-F122B -0.131941294227089 L98B-N117B -0.132122404994675 N93B-R113B -0.133632396072398 E97B-L112B -0.136530906405609 E111B-R128B -0.138442196175573 R110B-L127B -0.140626677181579 R107B-L112B -0.142602975388877 L103B-R110B -0.144819908382375 F122B-R128B -0.147832878007474 E97B-W124B -0.148343957782939 N117B-P123B -0.150478966439872 L98B-R113B -0.151299100631647 L101B-W124B -0.15258886849898 A94B-F122B -0.158479452009441 M102B-W124B -0.160935766958727 L114B-L127B -0.161132274166638 L101B-F122B -0.163569704531059 L98B-V120B -0.163906293139852 P115B-F122B -0.164721261737453 R104B-W124B -0.176113799791784 M102B-R107B -0.1786944635011 L95B-R118B -0.181162274675549 L114B-F122B -0.184727537147658 L103B-R108B -0.185664399229807 L112B-L127B -0.187935822887769 L106B-L127B -0.188178064440072 L95B-V120B -0.188239157819005 L98B-R118B -0.189076058713221 S99B-A125B -0.198218297812843 S96B-L114B -0.198443750440735 S99B-W124B -0.201313673801286 M102B-P123B -0.206772320578567 N93B-L119B -0.207906594689272 A100B-R128B -0.208837074691831 A94B-N117B -0.209469569210586 E97B-L114B -0.2111470377292 L101B-P123B -0.21119684886233 L101B-A125B -0.220422757425091 L114B-V120B -0.231470204459252 L103B-P123B -0.244297791394674 M102B-R128B -0.249790924794068 L98B-L103B -0.26430826012489 L103B-L109B -0.26477947028145 L114B-L119B -0.273694451090636 L98B-W124B -0.282232179806575 L106B-L112B -0.286658728695082 T121B-L127B -0.287615872502369 S96B-P123B -0.2884907143258 L98B-L119B -0.291177230748719 M102B-L112B -0.295421843940573 S99B-A126B -0.313779852679893 M102B-A125B -0.315874049954901 A94B-L114B -0.318693328576428 M102B-L109B -0.319716335718352 S99B-L127B -0.328010867998735 M102B-F122B -0.332125615084886 L103B-W124B -0.339265501143691 L95B-L114B -0.393726635147923 L98B-L114B -0.401351622721986 A100B-A126B -0.435560829952591 S96B-R118B -0.487146907293178 E97B-L119B -0.538859702574734 L95B-P115B -0.552376386576611 A94B-R118B -0.658422772046831 N93B-N117B -0.715401717522216