[Thu Aug 25 00:34:59 2016] >Input file: TM3VMAATG.pdb >TM segments: A197-231_A285-299_A302-316_A409-423_A434-450_A473-479_A482-489_A499-520_A529-550_A557-587_A669-684_A746-757 MAIDEN score = -7.3852 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 ----------- ---------------- V477A-V484A 9.75086798180848 V475A-M487A 2.06648718621153 I474A-V488A 2.05689823806163 V476A-A486A 1.83085842824103 N530A-M564A 1.38475574650277 I533A-M564A 1.27893492603316 I533A-L565A 1.22953986441823 I538A-W548A 1.21752108159078 I533A-V563A 1.21510205128375 L540A-W548A 1.20568287944304 I474A-M487A 1.13121573271659 F442A-R485A 1.09126869358151 V678A-R684A 1.08339700113603 T570A-V677A 0.99378560293231 W532A-M564A 0.980646750137414 F221A-V226A 0.944995166034132 R541A-V547A 0.912139640599238 K513A-L569A 0.892503783674972 L529A-L565A 0.885020982248178 I533A-L580A 0.837477967462934 F414A-M487A 0.83425933138999 V488A-R500A 0.811422036930428 A568A-M573A 0.796544885102183 F414A-V488A 0.790162809745816 V216A-F221A 0.789008806432044 Q542A-W548A 0.778224942855724 L540A-V547A 0.776593054621131 W532A-L565A 0.772705358678948 Q447A-A486A 0.76734424716757 V476A-V484A 0.745716483797088 V445A-Q750A 0.740104126132268 W532A-V563A 0.735515626974598 L529A-D567A 0.725148319623912 V216A-N312A 0.713708505636513 F442A-V484A 0.708579502477684 V475A-R485A 0.703492895392957 W672A-L757A 0.690877587839484 A536A-R562A 0.690387721089714 I202A-Q411A 0.683708455996598 T531A-M564A 0.680836016749142 D443A-V484A 0.679652869184594 V216A-E308A 0.677661722562326 Y517A-L569A 0.66394210640538 Q447A-V488A 0.634283965927389 L529A-V566A 0.620896227746408 F442A-A486A 0.618396472138895 A520A-L584A 0.607527113366983 Y517A-L565A 0.592909240583449 A450A-N749A 0.59080295444406 V488A-N499A 0.572970861673972 I533A-N579A 0.572470100516162 I538A-V575A 0.566603784930061 I533A-P576A 0.544488479837955 M204A-Q212A 0.543314291460007 F414A-A486A 0.539319959594603 R218A-I306A 0.535072362095767 I538A-N579A 0.516883106988883 L214A-N312A 0.516432852489203 M487A-A501A 0.511042275567521 A446A-V476A 0.506150927117413 N499A-A504A 0.502483155264462 A450A-I474A 0.502173255082761 A534A-R562A 0.500545672191073 V477A-A486A 0.496383634384953 P222A-E308A 0.492972409504516 Y517A-L580A 0.492827061710337 P537A-E559A 0.492531946866904 R562A-P576A 0.489396008240993 I474A-G489A 0.486838523292047 A534A-V575A 0.470294539148966 A413A-M487A 0.464138831168962 P217A-E313A 0.459203456685577 A539A-P550A 0.453998843230609 P514A-L569A 0.451795315738386 A473A-M487A 0.442851740117064 A536A-V575A 0.435382980448359 R218A-L307A 0.420876984123703 I205A-M415A 0.414007812603508 D298A-I306A 0.40412518865176 L540A-S549A 0.401766847035481 T516A-T577A 0.400494226971716 S572A-T682A 0.393849090931483 S510A-S572A 0.393570441054199 F442A-Q447A 0.386807259604348 Y517A-T577A 0.385932144151823 K513A-P576A 0.381223801836213 I202A-M415A 0.369997778656863 M204A-I438A 0.361926022407046 D448A-Y746A 0.357546752649693 Y517A-V575A 0.356878916412549 P514A-W672A 0.356587417603258 L569A-T673A 0.354732614214322 D448A-R485A 0.353077678392598 P550A-V575A 0.351526468021832 V678A-G683A 0.350551205677648 T519A-L584A 0.349993111469915 R479A-N756A 0.345362313249001 L569A-M674A 0.344234759532322 L569A-T577A 0.343634273773775 A446A-Q750A 0.343308254759128 L565A-P576A 0.342834326248912 P217A-N312A 0.342104226910201 D478A-E483A 0.336497909957055 V547A-M582A 0.336433635386711 I474A-A501A 0.332103732739989 A539A-S549A 0.330875258530436 R562A-N574A 0.328471201536105 L747A-P752A 0.328347794982751 W532A-M573A 0.326873841743897 A568A-P576A 0.324707865953469 T570A-M674A 0.323984685324631 L417A-M502A 0.32376115715774 A534A-G581A 0.321287506576979 Y517A-V677A 0.320592832098988 A568A-N574A 0.320302134495988 W548A-M582A 0.319325772804842 A536A-S558A 0.31735944329778 M573A-V678A 0.316987342741665 I202A-P410A 0.314645840064713 T516A-T673A 0.31458582315768 A446A-A748A 0.314450614775125 R218A-K303A 0.312160397172573 S206A-Q212A 0.310827280390053 T516A-L580A 0.310202425415913 A568A-T577A 0.309525130273359 G489A-M502A 0.309197253806789 Y517A-R571A 0.3082466618838 Y557A-R571A 0.30790302051283 E421A-T441A 0.305922970469652 P537A-V575A 0.304893454586653 S444A-A486A 0.304431207855488 L307A-E313A 0.302124775686449 T516A-T570A 0.298273103674652 M674A-N756A 0.297505949995128 P412A-N499A 0.296512514679541 S219A-K303A 0.29516731082989 M204A-Q411A 0.291197883241599 L569A-G683A 0.290777900314461 L529A-M564A 0.289384022068105 L417A-G489A 0.289356091599646 A520A-L580A 0.288720616179938 L518A-T670A 0.28760863341606 W532A-V566A 0.286982179961242 P537A-T577A 0.280373557250732 A449A-L747A 0.279709947427533 R218A-L309A 0.278701547908161 T203A-S409A 0.27801869605571 I533A-A568A 0.277840622935774 L565A-G581A 0.274334468692984 A450A-V488A 0.274189332275096 A473A-V488A 0.273976637429602 F414A-F442A 0.273433023420071 A473A-N499A 0.27295722611785 D304A-L309A 0.266288513721481 L529A-L669A 0.266063279034763 W672A-V677A 0.264653263077492 A449A-R485A 0.263956527699442 F439A-E483A 0.263170649160138 S507A-K513A 0.263009472135386 M415A-Q447A 0.263006360338553 P537A-W548A 0.262710861691751 W285A-E290A 0.261973887106342 I538A-P550A 0.258458379978519 R541A-M582A 0.258063614686786 T570A-R680A 0.257879866653865 Q420A-M502A 0.257744276536063 P410A-Q416A 0.256213880726911 A473A-R506A 0.254896140445466 L569A-V677A 0.25470854309337 Q447A-P752A 0.254190065170352 V566A-T673A 0.252822336331497 V566A-W672A 0.252036646502916 R419A-M502A 0.250763695597786 Q416A-Q447A 0.249729074132842 S206A-K437A 0.249557452935607 V475A-V484A 0.248411862191698 A450A-M487A 0.247272429710471 T516A-T531A 0.24699180644761 Q420A-T440A 0.246772619983588 T531A-T670A 0.246533436670162 T519A-T673A 0.246004015181824 T531A-T570A 0.245946265123102 Y557A-V578A 0.244757904493628 A473A-R505A 0.242767859335748 T673A-L757A 0.240887280104857 F414A-Q503A 0.238865388510126 L511A-T682A 0.238553702503669 T670A-L757A 0.238034571312279 E421A-F439A 0.236847197499926 Q447A-T751A 0.235995719653965 M415A-Q423A 0.235841016686403 P514A-N574A 0.235732897651421 V566A-R571A 0.235707138607181 M204A-N209A 0.234871662470691 P217A-P222A 0.233552606406445 V475A-V488A 0.233242617342055 A534A-L580A 0.232238477780563 S549A-N574A 0.232091648532758 T577A-T670A 0.231974922859876 V563A-P576A 0.230466670674268 A299A-R305A 0.229902848799012 S558A-V563A 0.229047591410255 R562A-D567A 0.228969945705762 M415A-R500A 0.228730434361575 T519A-L669A 0.22565793198701 M415A-R485A 0.22550645099681 T519A-T531A 0.224299732983191 L580A-P587A 0.223161373617481 Q542A-M582A 0.2221532426932 A413A-F442A 0.21885128300738 V476A-M487A 0.218787054609431 Q411A-Q420A 0.218591165536654 Q416A-F442A 0.217186110314745 P412A-Q447A 0.215860700616208 V418A-T440A 0.214059010665374 L569A-N574A 0.213055634479526 M204A-R419A 0.211689355833721 Q411A-T441A 0.211550608139228 R562A-M573A 0.210678771720862 T440A-G482A 0.210563157506385 F414A-M502A 0.20987951561331 Q675A-P754A 0.208972824598883 P550A-S558A 0.208418520171375 V578A-A583A 0.207051428043833 A534A-G561A 0.206576440784306 L417A-V484A 0.206123709646247 A413A-A501A 0.205649716761492 S510A-V578A 0.205572455679729 R200A-S444A 0.205545851817436 A512A-G581A 0.204737332083717 Y517A-N574A 0.204698313650645 V476A-E483A 0.202930804065714 S219A-S302A 0.201843242238067 S444A-R485A 0.200364310394766 Q676A-R684A 0.199945432060836 N530A-T673A 0.199681336608226 T516A-N574A 0.199431929716921 P410A-S444A 0.199348012555749 T203A-T441A 0.198917090632232 P576A-G585A 0.198201960526662 V216A-L309A 0.197501749509681 S302A-L307A 0.197382156565706 Q416A-T440A 0.197097860416178 P514A-G683A 0.196969705855251 S444A-V484A 0.196880146441869 V566A-R680A 0.195557139250494 M204A-V216A 0.195166603746475 P222A-L229A 0.194355866195567 R213A-R218A 0.194226765384452 P410A-Q447A 0.193508056133976 L747A-P754A 0.192560078921643 T531A-A583A 0.192335230599242 Q675A-R680A 0.192327188405973 I538A-S549A 0.192094196833544 K513A-R571A 0.19127278811473 S510A-P576A 0.189762236822487 P410A-L417A 0.189168303261583 G561A-N579A 0.189103807016156 Q212A-N312A 0.188501828107206 S572A-V678A 0.18818510447877 K287A-Y292A 0.187775374252774 I533A-T570A 0.187621235766271 R286A-A294A 0.18569519361312 Y517A-V563A 0.185678138324326 I202A-V418A 0.185125425766699 D478A-T753A 0.185114482536373 A446A-D478A 0.184258591799252 S302A-Y310A 0.183938913782499 K513A-L671A 0.183784953059228 R286A-A291A 0.183717923020986 V475A-G482A 0.183604930217363 S444A-P752A 0.183601333575472 D535A-V566A 0.183481203797293 R541A-Q546A 0.183259950941634 A294A-S302A 0.183211099961287 Y517A-T670A 0.183168369159091 G220A-Y310A 0.182234467511962 P514A-L565A 0.182060155816708 L295A-K303A 0.181587577272196 Y557A-M564A 0.179681649627581 R213A-K437A 0.179362338788692 T203A-F439A 0.179286981099311 L540A-G581A 0.178696936183513 W532A-T577A 0.178114665290285 S549A-P576A 0.176733526424326 D478A-P752A 0.176712843386871 P410A-R419A 0.17621412352231 F215A-V436A 0.175982548318959 Y557A-S572A 0.175915225874839 R541A-P550A 0.175143650016615 V566A-L669A 0.174977709848138 D567A-M573A 0.174963804275164 P514A-R571A 0.174339433516558 G220A-N312A 0.174320856338239 P410A-D448A 0.173914660831093 R305A-Y310A 0.173881551744967 A520A-T673A 0.173279841174932 T577A-T682A 0.17305998881195 L197A-S444A 0.172340215944642 A486A-Y746A 0.17217311258298 L230A-K303A 0.172050506874877 D567A-T670A 0.17107633612037 M297A-I306A 0.170983946525599 T203A-Q416A 0.170747240049759 A450A-A486A 0.170709024655692 M415A-V475A 0.170346725709678 S510A-N579A 0.170012894059505 Q411A-T440A 0.170008505360721 V418A-D443A 0.169863531299616 L529A-P576A 0.169702231315829 L201A-S409A 0.16849005297378 Y517A-D567A 0.167904066223589 S409A-M487A 0.16696786282793 S206A-P412A 0.166690950366579 Y517A-Q676A 0.165305821029337 V445A-V477A 0.165242465145488 N312A-S434A 0.165129717976345 A446A-G482A 0.164668271386331 V566A-V678A 0.163746650367885 A450A-V484A 0.163366340487056 M204A-L422A 0.162872778064842 V477A-Y746A 0.161958432489848 A512A-G585A 0.161636831452177 D448A-T751A 0.161381410310083 A504A-G509A 0.160567135740493 T516A-L586A 0.160465821429692 Y517A-N530A 0.160436287595939 P208A-R213A 0.159539912579902 V216A-V314A 0.159359611583729 K513A-L518A 0.15924046501687 T531A-T673A 0.159097887002958 P514A-D567A 0.158901971126699 L307A-N312A 0.158481898444532 N499A-R506A 0.158457256394977 S207A-V436A 0.15796013322003 K513A-L586A 0.157927148911723 D567A-W672A 0.157532711196921 P537A-S560A 0.156257296514863 G509A-T516A 0.156218614147823 Y310A-Y315A 0.155891175007464 W672A-R680A 0.155268104764654 G581A-L586A 0.155108744535701 F439A-S444A 0.154510891385057 T441A-E483A 0.154256718979984 G509A-T577A 0.154198071539023 W532A-S558A 0.154001698591205 N530A-D535A 0.152887029614162 P514A-G681A 0.152842173179017 A534A-V566A 0.152444533025771 S549A-M573A 0.15181493772905 K287A-L295A 0.151122983701466 P550A-T577A 0.151022673213302 K513A-D567A 0.150514360904656 G482A-M487A 0.150383696046922 P199A-R485A 0.150276378812021 S558A-R571A 0.150156227526973 L229A-N312A 0.150034101731423 Y557A-R562A 0.149855396501196 R485A-A501A 0.149343174438165 T577A-T673A 0.14927196861484 R479A-A486A 0.149051268325704 A413A-R485A 0.148538014746253 G561A-M573A 0.148252101617905 L518A-T577A 0.147648400010107 Q447A-N749A 0.146999568318793 S558A-L565A 0.146578891117513 S207A-K437A 0.14654288096629 M573A-G683A 0.146239382765671 A486A-Q750A 0.145909814239535 M204A-Q416A 0.14586190460575 S572A-T577A 0.145155896778137 A568A-M674A 0.144721549154018 S444A-V476A 0.143781665443118 R506A-A512A 0.143767083899702 N209A-S434A 0.143363460073504 Q675A-L755A 0.143178964725945 N289A-D298A 0.143118965965945 A568A-R680A 0.142280621252671 P537A-S549A 0.142018761284783 K513A-T577A 0.14179805198149 D443A-A450A 0.141610849833272 Q411A-R500A 0.141449427766731 V566A-V578A 0.141190432664301 V563A-S572A 0.141132185642677 L511A-S572A 0.140965026705594 A536A-M573A 0.140622654302556 D443A-V475A 0.140166733387681 V216A-R305A 0.140002618780317 R485A-P752A 0.139891618737642 F414A-E483A 0.138829201104068 S558A-N574A 0.138679922878556 A512A-T570A 0.138003017309134 I533A-E559A 0.137737048484073 S560A-P576A 0.136704882193192 S444A-E483A 0.136357036388687 D567A-G681A 0.136322022366314 M293A-D298A 0.135988968743014 G220A-R305A 0.135832939910372 I202A-L417A 0.134721755042466 S560A-M573A 0.133754555377612 P217A-D223A 0.133679739689653 F215A-R305A 0.13351270989882 P514A-T519A 0.133475461529849 A539A-N574A 0.13304390353704 I533A-V575A 0.132845547824154 M293A-Y310A 0.132494935979783 R200A-K437A 0.132096336670256 G509A-G581A 0.131964690457962 Q679A-P754A 0.131875760024494 Q447A-I474A 0.131836710878352 F414A-A473A 0.131730934439437 F215A-M311A 0.131691587014915 M487A-Q503A 0.131626427698338 D448A-A486A 0.131546430564542 L417A-I474A 0.13142795068307 A446A-E483A 0.131155109909283 D198A-K437A 0.131076326798562 V445A-V488A 0.130813314896252 L529A-T670A 0.130747834520188 P199A-T441A 0.130594390817105 S302A-M311A 0.130494841991044 D448A-A748A 0.128418239719476 L518A-V566A 0.128133430252366 L229A-L309A 0.128051992897248 A473A-I508A 0.127714461231991 V216A-L307A 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