[Fri Aug 26 18:00:13 2016] >Input file: TMQ6ZXV5S2D.pdb >TM segments: A551-592 MAIDEN score = 3.1520 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 ----------- ---------------- L573A-K578A 7.24226258206733 L574A-P579A 1.78945811878352 K563A-L590A 1.14613799740399 L574A-K581A 1.03729684544298 R569A-A582A 1.03437924440977 K563A-K588A 0.98592777913016 K563A-A589A 0.777063631386962 L573A-P579A 0.740009455774794 D561A-L592A 0.683832017461847 A555A-F562A 0.60958334849301 I567A-K588A 0.607907895312602 I567A-A589A 0.572207040895188 I556A-Y566A 0.522497402048494 P560A-E591A 0.468565417336252 F562A-A589A 0.456531131938902 G570A-K583A 0.435278124400534 I556A-R569A 0.43458929838607 G570A-K581A 0.411904036347003 R553A-A565A 0.406886262681904 N577A-K583A 0.400415197987599 I556A-F562A 0.390982493157786 I567A-A585A 0.379886905628895 E571A-K581A 0.379182413396809 E571A-K578A 0.377254149873286 L574A-K583A 0.372493748252331 I567A-Y586A 0.368921428564429 A555A-A565A 0.368359440131602 L572A-A582A 0.355587550564192 A555A-P560A 0.355309616980878 L551A-R569A 0.349996110621658 R569A-N577A 0.345266804280081 Y552A-S568A 0.32536724237956 R569A-K575A 0.324958802427631 K575A-A585A 0.320930455948116 R569A-K583A 0.30990472468783 P560A-K588A 0.304355841922405 R569A-L574A 0.289103270303346 E571A-K583A 0.284259819927119 A555A-S568A 0.270281443009404 E571A-A582A 0.268423300572515 Q564A-E591A 0.26608726003937 K563A-R569A 0.265316204808109 R569A-E584A 0.265011509192842 L573A-A582A 0.26445405172872 R553A-A585A 0.247159593207816 S557A-Y566A 0.244869336859541 R569A-K588A 0.243836329157231 K575A-K581A 0.242344947695912 K581A-Y586A 0.235672468706781 L574A-A582A 0.233547817393361 A565A-A589A 0.231331646699933 F562A-A585A 0.230036781202514 S568A-K578A 0.228276656589731 D561A-Y566A 0.228072550048139 Y552A-A585A 0.216844518386846 E571A-Y586A 0.210897241674351 R553A-Y566A 0.209678106676383 K578A-Y586A 0.201258343565367 Q564A-R569A 0.199945071316558 Y586A-E591A 0.19816292508845 F562A-L592A 0.193781593813888 D561A-A589A 0.192140951466081 E571A-K588A 0.185180383414524 R569A-P579A 0.174647011569963 L572A-K578A 0.172196488234027 Q554A-R559A 0.170190822278634 S568A-Y586A 0.169241384181936 S557A-K563A 0.156290312781497 Y552A-Y566A 0.15481174916909 Q564A-L592A 0.154764117890286 L572A-N577A 0.154647568664587 K563A-Y586A 0.154451781149958 Y566A-E571A 0.153972825358863 K563A-E584A 0.15313742386158 I556A-A565A 0.149839170140191 E584A-A589A 0.148712310682361 I567A-L590A 0.148546949007327 I556A-I567A 0.145992621292486 M576A-Y586A 0.141290901912979 K563A-E571A 0.139707340616973 L551A-P560A 0.136865642930905 L551A-G570A 0.136849816576259 Y552A-Y586A 0.135445821728906 P560A-Y586A 0.130465066215452 K578A-E584A 0.129351336733865 N577A-E584A 0.128022863738467 L573A-K583A 0.125775505205194 I556A-K563A 0.124203639401704 R559A-K588A 0.122803694820322 Q554A-R569A 0.122533942443606 R559A-A589A 0.121962976918412 I567A-L580A 0.118011930315307 L573A-L587A 0.114804680726952 L551A-L573A 0.113755031291244 L551A-A585A 0.112935147749955 L574A-L587A 0.112684345442451 S557A-S568A 0.11263419135665 Y552A-M576A 0.111837681369751 Y566A-P579A 0.110607291309551 R569A-Y586A 0.108079879847375 Y552A-A589A 0.108010209490861 R569A-E591A 0.107957469873692 K581A-A589A 0.106251282924511 K563A-A582A 0.104432862403058 R569A-M576A 0.104039548232607 L580A-K588A 0.103696188083386 A565A-L590A 0.101214752637114 R553A-K581A 0.0990441328909428 Y552A-D561A 0.097508734256289 S557A-A589A 0.0972391494383176 I567A-K575A 0.0971032228868571 L551A-Q564A 0.0953601460501901 Y552A-A582A 0.0945185923194178 I556A-L587A 0.0912202508758357 G570A-L590A 0.0904399212020248 Q564A-E571A 0.0892369786980893 K581A-K588A 0.0869344044162563 I556A-D561A 0.0848982839632875 L573A-E584A 0.084088582950803 I556A-Q564A 0.0799945733948126 E571A-A585A 0.0779623961619942 Y552A-L573A 0.0770101902060492 D561A-A585A 0.0739603459446836 I556A-S568A 0.0720882473471156 E584A-L592A 0.0706583743728856 M558A-A565A 0.0684568172074718 D561A-I567A 0.0681533875050762 Q554A-D561A 0.0672422131227651 L573A-A589A 0.0663190349225016 L551A-I567A 0.0644998073565599 Y566A-L587A 0.0634095614045975 G570A-N577A 0.0625596802856423 S568A-K581A 0.0623392188546124 A555A-A589A 0.0618839660544666 L551A-M558A 0.0616076405535901 I556A-A589A 0.0606844931365007 Q554A-Y566A 0.0588630721908578 E584A-L590A 0.0588436121856084 R553A-L572A 0.0587477550218907 R559A-Q564A 0.0587406618318442 G570A-E584A 0.0578774004265062 I556A-Y586A 0.056827462155975 E571A-L590A 0.0538024630439091 S568A-L590A 0.0522812941685611 L572A-A589A 0.0515592440713295 D561A-S568A 0.0509406344462064 R553A-R559A 0.0507340676417709 M558A-Y566A 0.0497370762024589 Q564A-L573A 0.0489331214268773 Y552A-E571A 0.0452682808962661 R559A-A585A 0.0450943818109515 G570A-E591A 0.0446640858959593 I556A-A585A 0.0445673685908363 I556A-G570A 0.0428169929780267 S568A-L587A 0.0425549172719246 R553A-K588A 0.0419293458400887 R569A-L587A 0.0401497084876521 A585A-L592A 0.0391399584629601 R553A-D561A 0.0390973958636196 I567A-P579A 0.0390343536212292 S557A-A585A 0.0383541193626549 P560A-R569A 0.037906369247581 R553A-S568A 0.0374134254199383 K575A-L580A 0.0372440242849352 K583A-E591A 0.0365921155962479 Q564A-L572A 0.0335578801526255 D561A-L587A 0.0300153638524148 M576A-A585A 0.0257188495654227 M576A-E584A 0.0253119484465039 K563A-G570A 0.0209976838434145 Q554A-L572A 0.0208004430170963 Y566A-Y586A 0.0200200018427017 A565A-E584A 0.0192515538402782 L551A-Y566A 0.0181088828256657 P579A-A589A 0.0173394258219064 N577A-Y586A 0.0163423765035171 Y566A-E584A 0.015606073950345 S557A-F562A 0.0150076927353231 S557A-Q564A 0.0148571964104947 R569A-K578A 0.0142675051480685 S568A-N577A 0.0137203140933613 A565A-A582A 0.0118008786067459 I556A-K588A 0.0112196402000704 R553A-G570A 0.00928955804306941 Y552A-K588A 0.00860833870773114 G570A-L587A 0.00705039849490241 K583A-A589A 0.00607648773409752 F562A-L590A 0.00454334518374289 S568A-K583A 0.00438847000201603 G570A-L592A 0.0042459589923487 Q554A-S568A 0.00224150910456666 I567A-K583A 0.00101585252234848 F562A-E591A -0.00151520886327372 S557A-K588A -0.00214726668313947 N577A-A585A -0.00363703111773356 P579A-L587A -0.00416447203148529 I556A-L592A -0.0049525393745542 L572A-L580A -0.0052623865991297 Q554A-Q564A -0.00668972477102558 S568A-E591A -0.00879226186932328 R569A-K581A -0.00919693809648159 A565A-K588A -0.0110388049693748 I556A-E591A -0.0116289581857518 F562A-E584A -0.012193262232064 F562A-G570A -0.0123454132591592 L572A-E584A -0.0123885359766605 A565A-E591A -0.0133580236627751 P560A-I567A -0.0142041181781843 I556A-L572A -0.0145026212000054 D561A-G570A -0.0148440095825444 F562A-E571A -0.0165831648782286 S568A-K588A -0.017138530898004 L572A-K581A -0.0181346987770077 R553A-R569A -0.0199062728658574 Q564A-A589A -0.0199916980107631 Y552A-K581A -0.0209298617367786 K575A-E584A -0.0241770052832784 Q554A-G570A -0.0246813514636668 Q554A-A585A -0.025191391375702 K563A-K583A -0.0252584238420841 R553A-I567A -0.0265522979749538 A565A-L574A -0.0275432645758675 A555A-A585A -0.0287250446070648 L551A-A565A -0.0305923544937221 G570A-P579A -0.0314183482827213 Q564A-E584A -0.0314288166886519 A565A-L592A -0.0337775883025397 R553A-A589A -0.0338109612279016 L551A-L572A -0.0339337051468007 P560A-G570A -0.034346367605059 D561A-L590A -0.0352900988387395 R559A-R569A -0.0374086112050501 S568A-A582A -0.0402649593132223 K563A-A585A -0.0409075422488998 I556A-E584A -0.0409443709522574 R569A-L590A -0.0429867826445367 E571A-L580A -0.0443110959258508 P560A-A585A -0.0467323142487644 D561A-Y586A -0.0489676398944334 Q554A-F562A -0.0492105597637007 F562A-K588A -0.0504011898363954 S568A-L580A -0.0508415543577039 S568A-K575A -0.0508544089374255 Y552A-E584A -0.051610816224799 I567A-M576A -0.0525850194395936 R559A-A565A -0.0540494356809236 R553A-Q564A -0.0552404888733933 A582A-E591A -0.0561398001805871 P560A-Y566A -0.0565813625808433 S568A-E584A -0.0587653589150603 R553A-Y586A -0.0596593402863395 L551A-E571A -0.0599526582469321 K575A-Y586A -0.0600392422440135 Q564A-A582A -0.0603346740277941 A555A-G570A -0.0605350030758234 E571A-L587A -0.0620817760660723 Y552A-S557A -0.0643221600386257 S568A-L574A -0.0643253906070953 L574A-K588A -0.0644095262214606 S557A-I567A -0.0656512766005539 F562A-S568A -0.0666546331916613 A565A-K581A -0.066881645604461 Y552A-K575A -0.0681855163084588 L572A-Y586A -0.0683352785313129 G570A-L580A -0.0688114925933201 R553A-E584A -0.0706010317457073 A582A-K588A -0.0726580922080231 P560A-L590A -0.0728518506199851 L551A-F562A -0.0731946308899341 R559A-S568A -0.0752763947405504 R553A-K563A -0.0766036188721397 R559A-Y566A -0.0773086759699655 F562A-L587A -0.077343708841358 S568A-L592A -0.0776956889344449 S557A-R569A -0.080617056248383 A565A-K583A -0.0807357639934043 M576A-K581A -0.0808995795896563 I567A-K581A -0.0838662390266949 K563A-E591A -0.0844713147042597 L572A-L587A -0.0855071387351796 L573A-Y586A -0.0855256935862272 S568A-P579A -0.090553469902189 R553A-A582A -0.0906997028248497 Y566A-L592A -0.0915775738688049 F562A-R569A -0.0919356143860499 I567A-K578A -0.0941102091636692 A555A-I567A -0.094472610933509 Y566A-L574A -0.094897934897235 A582A-L590A -0.0957470374865883 Q564A-A585A -0.0964218939711694 Y552A-L572A -0.0966604532084538 Y566A-K578A -0.0975816220901775 Y552A-R559A -0.100170456043551 D561A-E591A -0.106634805100535 A565A-L587A -0.107130886724598 Y552A-K563A -0.107502696688933 A565A-L573A -0.107513747533457 R553A-L573A -0.109061185132618 R553A-M558A -0.109154540179313 L572A-K588A -0.109522515359844 A565A-E571A -0.110697629561979 D561A-K588A -0.112364254008136 L573A-K581A -0.112478695131233 D561A-R569A -0.112825090734342 K575A-A582A -0.114607808155147 Q554A-K563A -0.115342836027382 Y552A-Q564A -0.115700142528219 L580A-A589A -0.115746632807259 Y566A-K581A -0.120418141052701 Y566A-L590A -0.120549138562884 Y566A-L580A -0.121548577693849 R559A-I567A -0.123343914695113 P560A-L587A -0.124668430869659 M576A-A582A -0.124831793154852 Q554A-A565A -0.12805890612227 M558A-Q564A -0.128314976444234 K575A-K583A -0.135313316073422 A555A-L572A -0.138584012195929 P579A-K588A -0.139804038362367 Y566A-K583A -0.142703057118573 Q554A-I567A -0.143901194072756 L574A-A589A -0.144760344739055 A565A-Y586A -0.14502835404463 Y566A-K575A -0.145128815319011 L551A-R559A -0.145569536521597 P579A-A585A -0.145620187979148 E571A-P579A -0.147904797383377 A585A-E591A -0.149685414845031 R569A-L580A -0.150826455690038 R559A-L592A -0.151923735432511 Y552A-P560A -0.152634925384053 R553A-E571A -0.153267717411596 Q564A-L587A -0.154006441910421 K578A-L587A -0.15448505272984 R569A-L592A -0.154620526792747 P579A-Y586A -0.155959508073683 A582A-L587A -0.156026585968227 K563A-L587A -0.157098980579015 P560A-A589A -0.159146466354291 A555A-K588A -0.159515604689007 Y586A-L592A -0.160297311483433 K583A-L592A -0.160333241042783 S568A-M576A -0.161381394166739 F562A-Y586A -0.163732810738476 K563A-S568A -0.165589743691956 L580A-Y586A -0.166940411320093 Y552A-F562A -0.168867202319069 L580A-L587A -0.170153729960041 I567A-E591A -0.170601240323724 P560A-S568A -0.172563620100772 R569A-A589A -0.174636518909421 Y552A-G570A -0.175527938140053 R569A-A585A -0.177341711005429 Y552A-M558A -0.177696779435125 G570A-M576A -0.178606862058337 E571A-N577A -0.17866472185023 Y566A-L573A -0.178727692094461 L574A-Y586A -0.178998697973972 Y552A-I567A -0.179956024659781 L551A-K563A -0.180558421906349 Y552A-L574A -0.183232879097027 K581A-L587A -0.183759275361094 G570A-K588A -0.184579028736925 M558A-K563A -0.184906537396764 F562A-I567A -0.186085064413329 I567A-E584A -0.187432669549 E571A-A589A -0.189104081607309 Y566A-E591A -0.190232623794126 M576A-K583A -0.191218484387427 L574A-E584A -0.193786665106208 A582A-A589A -0.196534660008025 G570A-A585A -0.19836269178244 A565A-L572A -0.199642284787766 E571A-E584A -0.199916435771048 L551A-S568A -0.201151940422137 S557A-A565A -0.201465696914092 P579A-E584A -0.205407429469064 K581A-L590A -0.205519503034164 L572A-K583A -0.207980511731724 A555A-Y566A -0.208487898228526 A555A-Q564A -0.208533047632427 E584A-E591A -0.209781335634105 L573A-K588A -0.210496979820061 A565A-A585A -0.211571464939388 Y566A-L572A -0.212221269605977 E571A-M576A -0.213760867379425 R553A-P560A -0.216856618652736 Q564A-K588A -0.217879943941466 A555A-D561A -0.220547502759715 K563A-L572A -0.220703389606907 R553A-F562A -0.221073118046152 Q564A-K583A -0.224497080799086 I567A-A582A -0.225030976911277 N577A-A582A -0.229742176913877 Q564A-G570A -0.233152084709384 K583A-L590A -0.239700786804866 A555A-R569A -0.243462710757491 I567A-L587A -0.250182176429995 Y566A-A582A -0.255422726462625 G570A-K578A -0.256746836683063 D561A-E584A -0.258023825261944 L580A-A585A -0.265053963036321 L587A-L592A -0.272656619810256 S568A-A589A -0.27384231374881 G570A-K575A -0.278812712916616 L572A-A585A -0.297530638258563 I567A-L574A -0.298806244146327 A585A-L590A -0.303016228831671 L573A-A585A -0.303084571360433 P560A-A565A -0.304856090866128 L574A-A585A -0.305555337935106 P560A-L592A -0.312519404740284 M558A-R569A -0.316892686031359 Q564A-L590A -0.322923768437567 K578A-A585A -0.331589151979547 P560A-E584A -0.333269081183827 A555A-K563A -0.335597355113943 L551A-S557A -0.338805807664883 I567A-L572A -0.339534719469164 S568A-L573A -0.340346848133403 Y566A-A589A -0.352786665949891 L551A-I556A -0.375325528046725 A565A-G570A -0.377100054218245 L574A-L580A -0.381222138949395 K578A-K583A -0.391796489755673 K583A-K588A -0.392979183770581 I567A-L592A -0.394162964872919 Q564A-Y586A -0.395567383359583 L573A-L580A -0.400253310179761 I567A-L573A -0.417904601587395 Y566A-K588A -0.420436124092378 K563A-L592A -0.425105350843026 Q554A-P560A -0.436431779106323 G570A-A589A -0.482135207674587 S568A-A585A -0.500852846958026 Y552A-A565A -0.536550798281255 L572A-P579A -0.563173552055853 Y552A-R569A -0.683581562969898 Y566A-A585A -0.68764133419005 G570A-A582A -0.76421157398825 G570A-Y586A -0.794654860850876