[Wed Aug 24 17:33:56 2016] >Input file: TM1OKCATD.pdb >TM segments: A11-37_A64-95_A107-143_A153-203_A207-242 MAIDEN score = -68.6416 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 ----------- ---------------- Q174A-M238A 10 P132A-L172A 1.93771783456032 L116A-I184A 1.23143450957046 F135A-Y173A 1.0196695655957 V178A-D231A 0.977384444913984 Y131A-F176A 0.970821331066742 F153A-C159A 0.952656404798672 V178A-F230A 0.949961467615551 R187A-A223A 0.90852261377662 P27A-F69A 0.900009015876476 D167A-L172A 0.886832181691999 L86A-K91A 0.881379751031014 F164A-L169A 0.86782054306578 Y186A-V226A 0.810965295590448 I163A-L172A 0.801439944097257 T83A-V130A 0.709859003982361 I160A-L172A 0.69440876253859 T154A-C159A 0.689528317344658 F135A-L172A 0.68868577670729 Q181A-F230A 0.68003470070663 K95A-N115A 0.679391240464862 Y131A-L172A 0.67405157124154 G175A-V233A 0.673252654811678 A75A-L156A 0.672690550363845 I163A-G168A 0.671183574594287 A18A-Y80A 0.668596574665079 K22A-V77A 0.661291850129967 L34A-A141A 0.656947070405233 G15A-V77A 0.652962951119879 L140A-F153A 0.652070445445663 A26A-F69A 0.650596767842116 R139A-C159A 0.635358069007734 F90A-A122A 0.634863710267392 T23A-V77A 0.611646880766605 L33A-R235A 0.602900961543704 I183A-S227A 0.59197074170187 V193A-A223A 0.583445037017992 R139A-I160A 0.581592195938827 Y190A-V222A 0.578797659164459 W70A-A141A 0.575084941975088 G72A-R139A 0.569167649573608 A197A-P202A 0.56299589233924 L172A-S241A 0.551913557995299 G123A-V180A 0.534189500183483 F135A-M238A 0.530897101073023 Y94A-A121A 0.525718485767172 A18A-V77A 0.516675386004657 A189A-V226A 0.514351426101317 V37A-A142A 0.509019343876207 Y194A-A216A 0.508048775414307 L33A-A142A 0.506592967408958 L140A-C159A 0.487583861592034 K95A-G114A 0.473936639295487 L74A-L156A 0.473167984473212 N158A-I163A 0.472259923290475 F176A-R234A 0.469831921167088 F135A-Q174A 0.460865026414305 P132A-I160A 0.45619325782632 G119A-I183A 0.450834396523335 Y94A-A122A 0.445610105574445 L33A-A141A 0.443347679495414 I28A-F69A 0.441593339157392 I163A-R170A 0.437885102867552 R137A-L156A 0.434614990663447 T138A-M238A 0.433320007325777 N87A-K95A 0.433195695190774 R30A-A142A 0.431027518195926 Y194A-V219A 0.430548842803642 L74A-R137A 0.42799194977552 L33A-T138A 0.427440624498926 A19A-Y80A 0.424418576389737 F164A-L172A 0.422880386548691 L127A-F176A 0.420339130139473 N76A-R137A 0.418233246464847 R139A-M238A 0.415409124617499 F153A-K162A 0.413420693071042 Y190A-V219A 0.411393918370026 A189A-V222A 0.407119856622634 S166A-G242A 0.404410596491637 G123A-I183A 0.397058346917884 V37A-T232A 0.385985011038917 P82A-N87A 0.385935214639852 S126A-Y131A 0.381509572068233 K91A-N115A 0.37301956940497 A136A-I160A 0.372927374037315 D134A-Y173A 0.372137445135025 L172A-M238A 0.370518204280766 C159A-G171A 0.370387032604819 N73A-A141A 0.362978364793735 L86A-T125A 0.36162321898035 Y173A-V233A 0.356402124622276 L116A-A188A 0.35475296919965 V16A-V77A 0.350023305650695 Y80A-G123A 0.349562471686473 L140A-G155A 0.339628211853427 V25A-R30A 0.338005884831968 V193A-V219A 0.334796860560298 K91A-C128A 0.334577261691929 G119A-I184A 0.334538691463996 A75A-D134A 0.332662305168668 V77A-D134A 0.329359798012081 A113A-G192A 0.320942679190272 G15A-F81A 0.31430040019122 G72A-A136A 0.313679362055608 F164A-G171A 0.313348310130537 V37A-M239A 0.311284372779967 D134A-R234A 0.306788303834849 R30A-L35A 0.303979758419183 Q181A-Y186A 0.303715859694052 P132A-N158A 0.301852545477476 V25A-W70A 0.299758138831331 L140A-L156A 0.29740989179011 N76A-R139A 0.296598895891168 P27A-T138A 0.294431319191699 L74A-R79A 0.294083889211892 P27A-N76A 0.293504847003671 R30A-F69A 0.292874206997503 T196A-T218A 0.292805320318156 I185A-V226A 0.291539277336145 I20A-V77A 0.287343286942724 P132A-R137A 0.286396784774701 Y80A-P132A 0.284687699303749 L116A-G182A 0.284488415108638 D195A-V222A 0.280787319998548 D134A-V180A 0.280665852083005 I185A-A223A 0.279637663857527 A136A-L172A 0.279010321440131 G175A-R236A 0.278565104145193 L140A-T154A 0.277709100108847 P27A-N73A 0.277347490021317 T125A-P132A 0.276292820322844 N87A-C128A 0.276014531477323 A197A-S212A 0.272238930319997 D143A-G155A 0.272206852104927 G119A-R187A 0.271029596770362 L86A-S126A 0.269799925783147 V193A-V222A 0.268786856221691 Y190A-D195A 0.268513864786134 Q36A-M239A 0.2647852216274 C128A-V178A 0.26257947998867 G175A-M238A 0.262057779191099 R137A-Y173A 0.26101309032796 W70A-G155A 0.260947296739704 R79A-A136A 0.260180311485755 Y80A-D134A 0.25952641893979 R187A-G192A 0.258553535360144 A189A-A197A 0.25711749006045 N177A-R236A 0.256132266814337 R79A-Y131A 0.253808368359898 R170A-M239A 0.253805783662612 D134A-G175A 0.252017798212291 L169A-G242A 0.251670746892821 Y194A-G224A 0.250554014270788 L127A-S179A 0.249300687103045 D134A-D143A 0.248591773401245 G14A-A85A 0.248153703369544 T196A-T220A 0.245733854572763 P202A-H208A 0.245251623215043 K91A-A121A 0.244409195412624 P202A-V207A 0.242960951364195 L133A-G155A 0.242870507471999 L34A-D143A 0.242679193125775 G192A-G224A 0.242073602159796 S179A-F230A 0.241870509734571 A24A-R30A 0.241833664090839 G72A-T138A 0.24126281765829 D92A-G119A 0.239957268501894 F153A-G242A 0.239684221078234 V37A-V233A 0.239547659447838 W109A-G192A 0.239487137137094 C159A-F164A 0.239397619491854 S68A-G155A 0.238753646706358 Q174A-T232A 0.23623719219311 R137A-M239A 0.23483348779313 L127A-D134A 0.234749537598301 K22A-N73A 0.234675704304435 T83A-L127A 0.234073971145035 Q174A-S241A 0.233219553074071 G72A-L156A 0.232358282739257 L74A-T138A 0.231871665508685 I185A-V222A 0.231209456590056 N158A-G242A 0.229646352583715 P202A-W213A 0.228914043439105 K22A-D134A 0.227603687629386 L33A-P229A 0.227071150048913 S118A-A188A 0.224383799435572 G175A-M237A 0.224036160797617 N73A-C159A 0.223355453007518 K95A-R110A 0.222297319410268 K32A-R71A 0.221327961432005 G119A-F191A 0.221293319254888 L33A-R139A 0.220804003386272 K32A-R137A 0.220502705046002 R139A-F153A 0.220445698445476 N158A-K165A 0.21833250830574 A13A-S21A 0.217338546492218 P132A-S166A 0.213602029138386 G171A-M238A 0.213586075278708 K162A-R170A 0.213549570457722 Q36A-T232A 0.21339628743122 R137A-C159A 0.21295069893957 F135A-R235A 0.212726025179578 R71A-N158A 0.212200606150749 M200A-V207A 0.211807210571524 N76A-L133A 0.210754205859081 R79A-N87A 0.210184313319822 L34A-T232A 0.209364361279712 Q36A-Q240A 0.209091380125122 W70A-T154A 0.209019151845685 P27A-R71A 0.208136700780082 A122A-F129A 0.208030225958647 R170A-M237A 0.207275683175764 A75A-L133A 0.207129011183954 Y190A-K198A 0.206143151594836 Q64A-T154A 0.206076836771149 C128A-I160A 0.205590345547366 V178A-V233A 0.205238988158926 P82A-F129A 0.203381294030916 K32A-R236A 0.202887602195964 C128A-Q174A 0.202783891889315 N73A-G157A 0.202441516616594 G72A-I78A 0.201394250494912 G192A-T218A 0.201390327599393 P132A-G242A 0.201152985536709 A142A-S241A 0.200627342995473 Q174A-R235A 0.199926143485146 D92A-A121A 0.199851584124299 V16A-R79A 0.199784355455796 N177A-R235A 0.199067499376615 R30A-N76A 0.198104848586924 R137A-N158A 0.197251419295091 T232A-Q240A 0.196122728799394 F112A-Y186A 0.196074520950329 G114A-I184A 0.195225619486552 D167A-G242A 0.194414596449312 P229A-R234A 0.194034947334809 R170A-N177A 0.193561549392052 G120A-Q181A 0.193536671113862 P132A-S179A 0.192911036589995 T138A-D231A 0.192416809678707 P27A-L74A 0.192077930021773 A85A-A122A 0.19171862966636 G120A-I183A 0.190903633547188 R187A-Y228A 0.190572115434879 I160A-G171A 0.189769354794105 T83A-D134A 0.189382348166743 R79A-Q84A 0.188545885473826 N115A-G123A 0.187233533213115 K93A-S126A 0.18718989148203 A19A-T83A 0.187080243647003 W70A-T138A 0.185953050009265 S126A-Y173A 0.18538436682584 K91A-L116A 0.184303589182334 Y173A-M238A 0.184248927580547 R170A-R236A 0.184109701067311 E29A-R71A 0.183768598405867 Y173A-R236A 0.183452198024989 G123A-N177A 0.182882522602811 G14A-S21A 0.182856455458682 V37A-Y228A 0.182804473026112 V31A-Q36A 0.182287570968475 T196A-A223A 0.182282472963748 P82A-V130A 0.181964491828208 G123A-P132A 0.18179483686515 T138A-F153A 0.18175092542098 P82A-C128A 0.18112098722197 K22A-R71A 0.181081042613432 T23A-A141A 0.180687545835173 P27A-L140A 0.180603221951467 N76A-G155A 0.179876013998931 K32A-R139A 0.179510918216225 G15A-L74A 0.1793674132191 K91A-G119A 0.179316519864265 N87A-G120A 0.179295296179525 G175A-R235A 0.179194492718457 F11A-T83A 0.179017966588849 L172A-N177A 0.178913373193033 L12A-P82A 0.178644663357 P82A-D134A 0.177906641808708 F69A-N76A 0.177856164718432 F88A-K95A 0.177603096369538 A75A-A136A 0.177485387726595 G192A-M200A 0.176868210936548 N73A-Y80A 0.176713776986968 A136A-L156A 0.176180942990084 R139A-R170A 0.176151537282933 K32A-D143A 0.17537178809361 I28A-A141A 0.17489624876623 I160A-K165A 0.174459187880884 R30A-D231A 0.173688923172084 T138A-T161A 0.173553772016394 C128A-L169A 0.173256463963059 G120A-R187A 0.172884885539413 Q174A-Q181A 0.172627617120205 G120A-Y190A 0.171480191257889 A75A-I160A 0.1711164600523 S118A-Y186A 0.171077737752542 T138A-L172A 0.170920098496666 Y190A-Y228A 0.17090814005975 A117A-I185A 0.170901334921206 K198A-H208A 0.170197995543318 K95A-T125A 0.168980920780542 Q181A-T232A 0.167823526077478 Y131A-M237A 0.167789678136196 N73A-D134A 0.167393678216827 R234A-S241A 0.167293788535908 K22A-F69A 0.166902365973429 R139A-D167A 0.166892607001368 T125A-I184A 0.166286365701211 Y94A-Y111A 0.165438883146996 F135A-N177A 0.165281821843582 G182A-G192A 0.164251458647103 G175A-R234A 0.162676188485297 A189A-Y228A 0.162182912178836 R139A-D231A 0.162175846919736 T138A-T154A 0.162044339991358 S179A-M239A 0.161640032725562 G120A-A223A 0.161636831452177 G192A-G199A 0.161332187568454 T196A-D203A 0.160785805968667 I28A-T138A 0.160694141297428 S21A-L74A 0.160686880530998 N73A-F153A 0.159760529951798 A121A-R187A 0.159566958081051 P132A-Q174A 0.159174483532659 Y228A-R236A 0.158266141188403 F81A-Y131A 0.157958099619986 S118A-F191A 0.157712881952477 G119A-G182A 0.157235647969887 N115A-G192A 0.156491244243893 Y194A-A221A 0.156145095543599 L133A-G175A 0.155301073697647 D134A-L172A 0.154257278126601 P132A-D167A 0.15402118738161 F81A-C128A 0.153506069002918 G123A-I184A 0.153432314871772 R110A-S118A 0.152144447556681 G114A-A188A 0.152014926777683 A75A-R139A 0.151962592354836 T125A-F176A 0.151477479706058 T196A-P202A 0.151421281577971 N73A-L156A 0.150587796343577 K198A-I215A 0.150446920609717 Y131A-F164A 0.150366568283413 L74A-N158A 0.150304557990543 G171A-Q240A 0.149953482482257 A13A-I78A 0.149523744183769 G72A-N158A 0.148758743733644 D195A-A216A 0.148196664362764 A26A-A75A 0.148174314864868 W109A-G114A 0.148140834859916 I163A-G171A 0.148027884040519 K165A-R170A 0.147977777394558 V130A-V180A 0.147429900107146 R30A-A75A 0.147028024515851 A122A-R187A 0.146973750182785 N177A-D231A 0.146806579857806 G15A-I78A 0.146117053955817 I28A-A142A 0.146017920565178 A121A-I185A 0.145402564796394 R137A-I160A 0.144886098972211 F191A-S227A 0.144577510334549 I185A-G224A 0.144518433758327 D134A-N158A 0.144252616197261 A142A-T232A 0.143663936296425 C128A-G171A 0.143627113283719 F108A-G192A 0.143483656706432 K22A-G72A 0.143462861127649 T83A-A121A 0.143434295731269 L35A-Y228A 0.141803098927007 V77A-A136A 0.141369499920567 Y131A-I163A 0.141231971752361 V207A-A216A 0.141083473173232 A136A-R234A 0.140852486657414 M200A-V219A 0.140477790418352 F112A-Y194A 0.140428554511104 Q181A-P229A 0.140036464041529 P27A-W70A 0.139554944967507 S166A-Y173A 0.139332068544834 F112A-A189A 0.138383254381884 A17A-F81A 0.137453844181207 R236A-G242A 0.136652622303719 F135A-C159A 0.136469936390017 G15A-A85A 0.136314013437405 V16A-V25A 0.136199337425756 C128A-S179A 0.136146611127312 R139A-L156A 0.136008946874743 Q181A-R235A 0.135813790261581 R71A-F135A 0.135777078061332 H208A-A216A 0.135618068307475 F129A-R170A 0.135405583598915 K22A-R79A 0.135391984125588 A124A-R187A 0.134983284657065 G114A-A189A 0.133568333186953 R139A-G175A 0.133504557987613 R30A-R236A 0.132987935764774 R79A-G123A 0.132906045054052 F164A-R170A 0.132847959019355 A141A-R236A 0.132554604384372 N73A-N158A 0.132146483980746 L169A-Q174A 0.130972546714515 G171A-R236A 0.130712406038922 R187A-A221A 0.13063119474416 G171A-R234A 0.130474919124451 R187A-F230A 0.130471809175495 A121A-N177A 0.130428352903902 R139A-F164A 0.130342969808509 F11A-R79A 0.129511845448555 K22A-P27A 0.128836362857633 T23A-T138A 0.128703196846128 A122A-Q181A 0.128417317909108 A136A-R236A 0.12827691422285 N115A-A189A 0.127946216837616 P132A-L140A 0.127764832427154 I183A-T232A 0.127654202851518 L225A-T232A 0.127498985512338 G168A-M238A 0.126874615190295 N115A-Y186A 0.126812255530882 S68A-T154A 0.12634131079279 T154A-G242A 0.12621630946017 P132A-R234A 0.12615430071841 C159A-R170A 0.125692247171794 A18A-A75A 0.125065958028154 Y173A-G182A 0.125009158969402 L127A-G175A 0.124812940545228 V193A-G224A 0.124555549526347 H208A-I215A 0.124200213204102 P202A-A216A 0.123925319795513 Q36A-R236A 0.123853764268953 A188A-A221A 0.123485748675895 A17A-V25A 0.123224455769864 E29A-A141A 0.123114611691994 L140A-K162A 0.12306410222566 Y186A-Y228A 0.123035450350857 A136A-S179A 0.122742941299466 F90A-G120A 0.122725653843032 A13A-Y80A 0.122348089732879 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