[Fri Aug 26 17:56:39 2016] >Input file: TMQ0Z7W6M2D.pdb >TM segments: 88-118 MAIDEN score = 3.3281 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 ----------- ---------------- C106 -F111 1.3276331435725 I103 -Y114 1.12613695903694 H105 -F111 1.05591354700118 I97 -Q115 0.93738743768283 H105 -R113 0.912664682001737 I103 -R113 0.826284977908841 C106 -R112 0.702563581604838 P89 -R94 0.428657920881899 R94 -C106 0.404520010534925 S92 -I97 0.402841203253831 S92 -T98 0.396740871575045 I103 -R112 0.38951187002162 I97 -T102 0.386796803564041 A99 -Q115 0.349909956730662 H105 -R112 0.349236040724348 A99 -G116 0.3429391280136 K107 -R112 0.328899369463366 I103 -G116 0.311113185216465 P89 -T102 0.294170303647114 G93 -A99 0.292760298960099 L100 -G116 0.290400661571948 I103 -Q115 0.285202063833183 Y104 -Q115 0.280919387853408 L91 -G109 0.276561570389714 I103 -P117 0.258335221802515 Y104 -R112 0.254004792535445 S92 -Q115 0.250438283050148 Q88 -P101 0.21743148755203 Y104 -E110 0.205777973006762 K107 -R113 0.201642321161305 G90 -I97 0.188034232029969 G109 -Y114 0.182619154312812 R94 -D108 0.178062739222181 P101 -R113 0.175667316746264 S92 -Y114 0.172884380534767 G90 -Y104 0.17194456435214 G93 -T102 0.162763204980481 G90 -T98 0.161503755376694 G93 -Y104 0.160452585207426 S92 -R113 0.159585095395386 A99 -R113 0.155041844402452 C106 -R113 0.154372817153815 P101 -Q115 0.145925791840029 L91 -Y114 0.145529221047508 G93 -G109 0.142052137264496 G93 -L100 0.134212236521466 I103 -G109 0.124480672368491 L91 -I96 0.122823901017084 T102 -R112 0.117302367723933 H105 -G116 0.112070113883432 T102 -P117 0.107015179761009 I96 -G116 0.104999585676882 I97 -R113 0.103566777915605 Q88 -A99 0.102124622473183 S92 -I103 0.100471988308387 R94 -E110 0.0984095793267106 P89 -A99 0.0928935192562692 T98 -Y104 0.0880311661588047 L100 -Q115 0.0875931189479044 L100 -R118 0.0850205125169601 P89 -L100 0.0842672227726649 S92 -C106 0.0787210251291854 R94 -Q115 0.0786642553286201 P89 -Y104 0.0745764290476618 R94 -T102 0.0696902636172976 Q88 -I103 0.0689299298139963 T98 -R113 0.063074777148677 F95 -R113 0.061492658318258 L91 -F111 0.0612955346065145 F95 -G109 0.0577664801958893 G90 -A99 0.0559748419857704 I96 -F111 0.053689660297024 H105 -Y114 0.0533570181121001 I96 -H105 0.0520916734746772 I96 -I103 0.0489328470640302 S92 -G109 0.0487198120250589 S92 -Y104 0.0412623708832722 S92 -H105 0.0389902989750968 I97 -P117 0.0369680306578721 L91 -H105 0.0347781070024857 I96 -P101 0.033972304371723 F95 -L100 0.0337904327430996 L100 -R113 0.0307041863757274 A99 -Y104 0.0296844540649301 L91 -R113 0.0294726720979219 P89 -I103 0.0184486418793028 I97 -R112 0.0166224731507389 R94 -F111 0.0147945766774966 L91 -E110 0.0126411595958036 R94 -G109 0.0118169672491149 F95 -G116 0.0102796414284567 G90 -G109 0.0102019859395143 Q88 -I97 0.00971995035254647 Q88 -Y104 0.00782540180549418 G93 -R113 0.00632288515932089 P89 -P101 0.00618330106138698 L100 -Y114 0.00571702201550162 R94 -A99 0.0030267259529877 T102 -R113 -0.000796361154514535 I97 -F111 -0.00504320502068012 I97 -E110 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-0.0730320513612939 S92 -A99 -0.0800380793861155 G90 -L100 -0.0820046230070313 R94 -Y114 -0.0827492377468535 F95 -C106 -0.0834089427592684 I96 -G109 -0.0850590706679033 L91 -I103 -0.0852482888787258 A99 -Y114 -0.0852520349885409 T98 -Y114 -0.0869098979239644 R94 -R113 -0.0891592806838927 S92 -R112 -0.094126149581327 P101 -Y114 -0.0958132129204246 Y104 -P117 -0.0958468398890107 Q88 -T98 -0.103722767105977 L91 -A99 -0.106668903039981 F95 -E110 -0.107644451945736 R112 -P117 -0.108866750318342 T98 -G116 -0.109524830347251 F95 -R112 -0.110328625227325 F95 -D108 -0.112245844930911 L91 -R112 -0.11295668190818 I97 -Y114 -0.114517978222985 Y104 -F111 -0.122096943395053 T102 -F111 -0.128152081923214 R94 -Y104 -0.131169792124305 F95 -H105 -0.131364614290066 Q88 -G93 -0.13360503152366 I96 -E110 -0.134543330121562 T102 -R118 -0.136183860113387 L91 -D108 -0.1371079157169 K107 -Y114 -0.138773979571861 F95 -Y104 -0.142039873569573 A99 -P117 -0.142186116548476 Y104 -G109 -0.144308529217233 Q88 -R94 -0.149377479965292 P89 -I97 -0.151121797036982 I96 -T102 -0.159845937838579 T102 -Y114 -0.167235322741551 L91 -T98 -0.169401792798043 R94 -I103 -0.172431141951728 F95 -P101 -0.17300593462757 I103 -E110 -0.176385085966962 F95 -Y114 -0.17872254290498 H105 -E110 -0.179424172559718 Q88 -T102 -0.190851281722585 I96 -Y104 -0.198871754439042 C106 -Q115 -0.200375624635667 L91 -Y104 -0.209632486237566 T102 -E110 -0.213650451924012 T102 -Q115 -0.216792109250097 F95 -Q115 -0.217863201687849 Q88 -F95 -0.219494942575588 I97 -Y104 -0.224932443296169 P101 -P117 -0.228415152372017 L91 -L100 -0.230171750053781 S92 -T102 -0.232861553482165 G90 -I96 -0.235334094918426 P89 -F95 -0.254976229346885 G90 -F95 -0.255230042232108 F95 -F111 -0.260325835490002 P89 -I96 -0.263357645590818 S92 -P101 -0.264038955608251 C106 -Y114 -0.273005096035717 I96 -Q115 -0.275486410678597 T102 -G116 -0.277768299997909 L91 -T102 -0.278443243371413 P101 -R118 -0.297206901394754 I97 -I103 -0.300411397004519 G93 -T98 -0.303118216642166 H105 -P117 -0.308529392000195 L91 -I97 -0.312179661321212 S92 -L100 -0.324790872524581 I103 -R118 -0.326390369625907 Y104 -Y114 -0.348838224328134 L100 -P117 -0.387599760590561 F95 -T102 -0.417908053746896 P101 -G116 -0.427466041358121 Y104 -R113 -0.645679675443439