[Fri Aug 26 18:15:49 2016] >Input file: TMD8DWG7M1D.pdb >TM segments: 19-41_ 45-72_ 74-95_ 97-123_ 199-242 MAIDEN score = -23.2610 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 ----------- ---------------- I49 -I102 1.84201065667541 I33 -E38 1.28103502325387 I92 -L98 1.22079276754056 I210 -F220 1.20620429922707 I231 -E236 1.19491712269874 I92 -L97 1.15422881943175 A56 -R61 1.07532510008551 F203 -W209 0.959401440209405 A230 -E236 0.952560594828633 F88 -T105 0.802008823928112 V116 -I213 0.772374201042696 L50 -K234 0.772212564340643 W209 -I215 0.761473597285907 L58 -L217 0.725372315051736 G52 -I102 0.699671328570632 L229 -L237 0.698067101744492 N214 -C221 0.688838078955018 M211 -F220 0.686986986564283 I92 -F100 0.669856202103738 F218 -I224 0.663836487631004 C80 -F85 0.660876695128136 F71 -I76 0.655216820052607 A212 -F222 0.61672449029529 Y53 -I103 0.610660250876747 F88 -G101 0.607901875979618 I68 -S117 0.587547528995966 L58 -S216 0.58439425365578 R61 -G112 0.582329606153527 F85 -G90 0.579926417713682 R207 -I213 0.579447734556059 F22 -A122 0.577757890320813 F232 -L237 0.572696429763617 I224 -L229 0.569273078806574 P32 -K234 0.560508483296944 Y53 -I102 0.559412628577184 I213 -G219 0.559003951487803 S114 -S119 0.525524251233534 I49 -M99 0.505585009752354 A212 -F220 0.501712184946135 L78 -P110 0.494966667134943 F84 -A89 0.490854434129001 F22 -N118 0.481548159911425 Y91 -L97 0.481011641857944 N118 -I123 0.475052887781869 F83 -F88 0.464157094412053 F218 -G223 0.463130479992202 S64 -A113 0.457858494037904 F218 -N227 0.45749190194291 P62 -I215 0.457381448558123 I46 -S51 0.441101779102506 Y39 -A93 0.433373297730788 I213 -F220 0.430872920255982 L77 -P110 0.429143923499969 Y53 -A109 0.4256535617516 L35 -I46 0.417164709901539 L67 -P72 0.416172755991157 G52 -I103 0.406919220100086 I213 -F222 0.406578665941871 R61 -I215 0.40111180928915 A41 -I46 0.396471444984247 D69 -C121 0.387877564329012 P29 -E235 0.385408475697807 I68 -K74 0.3799639105011 I48 -I102 0.370613882087635 A56 -L106 0.370278745077085 L217 -G223 0.369483763171914 Y39 -G90 0.368763630046482 F24 -C80 0.358468757674954 I48 -Y53 0.358361368280396 T28 -C80 0.35805082932927 T57 -L217 0.354086348879471 I49 -I103 0.351420873304957 C87 -G101 0.346923316350582 A23 -A122 0.345111698823924 N70 -K75 0.34223519688211 A230 -L237 0.342003856959894 L81 -I86 0.334886027477737 A109 -S114 0.334414202053763 A93 -F100 0.333704944193949 S64 -K74 0.33346813099429 G52 -L106 0.332301351136438 R202 -N214 0.331013339658655 C226 -I231 0.329562582566064 W209 -G219 0.326462706888156 S36 -K234 0.323198163283388 C221 -I231 0.321151578555905 K75 -S119 0.320047158266967 I48 -M99 0.319767188294389 M211 -G219 0.31627561624543 T57 -T105 0.316124750219063 T45 -E235 0.315943989409756 K75 -P110 0.31532060971234 G52 -G112 0.314241483046923 G65 -S117 0.31340712106396 T57 -A109 0.312296725107788 W209 -F220 0.311670960086758 S64 -H107 0.309205588553351 K74 -C80 0.308661747011883 P32 -Y53 0.303980855068309 P72 -N118 0.301538515231746 P110 -S119 0.299271319457462 A93 -L98 0.298689524304184 S51 -A230 0.296194905930347 T54 -P62 0.295824536406815 V116 -I215 0.292323593285221 I68 -C121 0.291336374182934 C80 -T105 0.290516765049534 H107 -S114 0.290251383803482 G112 -S216 0.289056153407794 P62 -T115 0.288912422039716 C87 -F100 0.288824845063617 P32 -I46 0.287865164877561 I86 -Y91 0.286366871186152 G47 -L98 0.285167850963023 R61 -N118 0.281382933381655 G112 -N227 0.281351015406224 L35 -G47 0.280455450295319 N70 -C121 0.27892539643722 G112 -N214 0.278356744735343 I79 -G108 0.27748056977166 G52 -L98 0.27717016924105 T45 -T105 0.276748137173668 L35 -A41 0.275358532757718 P29 -K234 0.275298843916983 L229 -K234 0.274558017859562 G112 -S119 0.268069080221041 A41 -A89 0.26614149194347 R202 -A212 0.26434764444774 R202 -A208 0.264221651366846 S216 -N227 0.263305419507708 L217 -N227 0.262958012969072 I46 -E235 0.261135840493496 T45 -M99 0.260226760135188 R207 -A212 0.260195807247792 A82 -G90 0.258044784961512 P62 -S216 0.255622263383404 A93 -I102 0.254025118225888 C80 -C87 0.253159366896872 I79 -P110 0.250702852815996 A82 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0.178564713600265 C226 -L237 0.177801580499191 G112 -L225 0.17779210938251 F111 -K234 0.177486136879291 A82 -T105 0.176988551319914 T120 -W209 0.176084903098894 S64 -L78 0.175521529510417 I68 -K75 0.175389048783651 Y21 -A122 0.175210284216616 I49 -A56 0.175109255593413 C226 -I239 0.174436013036178 A208 -S216 0.173451663426007 T206 -N214 0.173322756129518 F22 -S119 0.173087628521612 Y34 -C87 0.172554355836549 L20 -S119 0.172161581593629 S117 -A212 0.171683300356862 S36 -G90 0.170947006467148 F63 -A109 0.170498742997601 T54 -P110 0.170163750421708 L58 -S114 0.169798544356635 Y228 -E235 0.169306138586865 T28 -K234 0.168300260252136 G112 -L217 0.168150904956544 T57 -A113 0.167017362242755 L77 -C121 0.166366099027793 S119 -S199 0.166228159373602 S51 -A109 0.166032763965191 G219 -I224 0.165921284568197 I86 -A94 0.165287704647664 R61 -S114 0.16507494623951 A41 -G52 0.163816833927388 A212 -F218 0.162929761669399 F232 -T240 0.162546918598143 G112 -A212 0.162360940558059 G65 -A208 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