[Fri Aug 26 17:48:30 2016] >Input file: TMI6XQ27M1D.pdb >TM segments: 413-430_ 440-521 MAIDEN score = 48.1154 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 ----------- ---------------- A492 -R497 10 E501 -P506 10 P491 -Q512 10 D489 -E515 10 W459 -A469 3.15757104687583 F485 -S519 2.13060206219301 V498 -A509 1.83146781988984 A492 -V511 1.77008385998051 A461 -I466 1.56190536010143 F485 -I518 1.22701498676832 L486 -I518 1.22584599574399 L422 -I466 1.10991842938987 L422 -S465 1.10573680489122 V487 -T517 1.01567532803973 M484 -A521 1.00205342142574 P491 -R497 0.976294262077134 D489 -V511 0.975701709782371 A449 -R478 0.962763830872307 V496 -D510 0.923040500483412 L422 -D463 0.896358806479294 V487 -V516 0.87876794264111 P447 -R452 0.85297552329699 L422 -E464 0.827568632635272 V487 -I518 0.805121775124568 G429 -W453 0.77211953171588 M488 -E515 0.738723529585313 P447 -R478 0.721904398088274 M488 -V516 0.717431773358044 D489 -Q512 0.687810895725569 W459 -A473 0.661951738519003 S417 -G481 0.624941382949327 F485 -A521 0.611051568069151 D489 -E514 0.610483046829514 P491 -G513 0.592092009546871 W459 -A468 0.588245578545934 N451 -F479 0.581183018231037 N451 -Y477 0.570235858418255 A494 -D510 0.557729770620163 T450 -F479 0.529734527470595 Y441 -W459 0.500972985913131 V500 -A509 0.500220373890205 P491 -D510 0.499978688519949 A492 -V498 0.497430141853963 E501 -G507 0.48986197505689 M488 -I518 0.485050633362 Y421 -S465 0.475464385864857 N430 -W453 0.454484759307741 W459 -T467 0.447874014369306 T413 -E483 0.42547071914321 T450 -Y477 0.422582237469628 W453 -L475 0.422094242668266 L455 -A473 0.417620647931424 S456 -L475 0.415928131209655 L486 -V516 0.397643762643547 R452 -F479 0.395739184239678 L486 -T517 0.392650658495427 N430 -P447 0.384295680470573 T424 -S465 0.382553364557841 A509 -A521 0.370142393388189 L455 -L475 0.366862652369479 S428 -R452 0.364744349275066 S428 -S454 0.363261393330201 P447 -S456 0.360409858031355 W459 -I466 0.360358995973932 G423 -I466 0.359581423964372 W453 -M484 0.349236721896711 G429 -A449 0.345366289169262 L486 -S519 0.343678976099658 F485 -E515 0.34068589045303 E419 -G481 0.332813205953289 P447 -N476 0.330955670848368 R482 -A521 0.330574588525855 S428 -W453 0.327094117666908 E483 -T517 0.325345857268144 Q416 -Y477 0.317103289895863 S417 -F479 0.315657844967436 G442 -G448 0.314517834461671 M484 -S519 0.313264155407031 A468 -Q474 0.311979846694011 G503 -G520 0.311345385236433 D440 -L455 0.307589331767534 S458 -G472 0.307497068544657 G508 -A521 0.306271640463555 G462 -A468 0.305198618931253 N476 -M484 0.30481536995249 P418 -W453 0.303050165695668 G508 -S519 0.299165387745563 T420 -T517 0.297114585419408 D489 -R497 0.296765177106343 D489 -V498 0.296280948414323 V500 -D510 0.296070755766462 T413 -P418 0.295578157292349 D463 -M488 0.293140718242213 R426 -E464 0.287597185593514 Q443 -N476 0.284874349288012 Y441 -S454 0.283251197222304 E419 -R426 0.281105585412822 T420 -R452 0.280838949099784 L422 -A461 0.278632901470547 K495 -G508 0.276463667596154 M488 -Q499 0.275476918068468 G490 -V511 0.274357438735697 T420 -A427 0.2728199317567 G490 -D510 0.269063489836497 N444 -R478 0.268897046018504 P418 -E483 0.268226475417762 A449 -A480 0.26817051983404 P418 -N451 0.263103064240999 A468 -R497 0.25959995629163 Q499 -G508 0.258604713505883 P447 -S454 0.257444842924283 Q474 -P506 0.25731965315345 R426 -A461 0.254525384700904 P491 -Q499 0.254328712080449 V496 -V511 0.25232330880453 D471 -R497 0.247523953728455 D440 -G472 0.247260185589788 P447 -Q474 0.246817757204193 D463 -D489 0.246041915509304 R497 -G508 0.24531346483829 G442 -W453 0.244834693946878 Q443 -G472 0.244815352634116 Q416 -F485 0.239467627443048 G490 -E515 0.238998084815443 G507 -S519 0.234096649483521 M484 -G520 0.233078343274905 V487 -D510 0.231134151452308 A446 -R452 0.230392284210986 D489 -G513 0.229774818316268 T460 -T467 0.228422657097251 S458 -A468 0.227951995775408 L455 -T467 0.223903956250434 Y441 -A468 0.22235443975799 G457 -D471 0.222094000042122 R452 -M484 0.221459382408826 P491 -V511 0.221430807272181 Y477 -Q499 0.221356462849426 S428 -A461 0.218872150691061 T467 -L475 0.217471875977393 V500 -I518 0.217194989814086 P445 -Y477 0.21552266997195 Q499 -G504 0.215499937121451 N444 -G457 0.21534049384061 Q416 -F479 0.214221067508939 S456 -G472 0.213983704222841 Y441 -A461 0.211192425589983 M488 -T517 0.210114118152663 V511 -S519 0.209998059262075 P418 -L486 0.209435941466106 T420 -E464 0.208927552956983 N476 -G520 0.208104740538613 T420 -G481 0.206702107689115 G429 -P447 0.20578695250091 N476 -G503 0.205548694868044 T450 -A480 0.205134873197055 G429 -S456 0.204560419800696 G442 -Y477 0.203771824982392 D471 -V498 0.202882912213715 L475 -M484 0.202333975911675 Q499 -Q512 0.199504465852908 E419 -R452 0.197169390928042 G457 -N476 0.196925476159679 N430 -R478 0.196210869634376 G457 -R470 0.195896159824638 F485 -V500 0.19546510148659 N430 -Y441 0.195363185871532 Q416 -R482 0.194316407794861 Y441 -P447 0.192585790033364 T424 -G429 0.192265380332815 Q443 -S458 0.191454901003175 S456 -Y477 0.191412420133758 N430 -G457 0.190297332624406 Q416 -N451 0.189923422786636 K495 -Q512 0.189427390823928 P418 -S428 0.188734723816783 L475 -V500 0.188193121125563 P505 -S519 0.186290482885285 A468 -D489 0.184763648081912 M484 -V516 0.183868699087254 Y421 -E464 0.182716598596353 S428 -Y441 0.181037699393313 G429 -G457 0.180450885624824 D440 -A469 0.180115668672376 N451 -R482 0.17903580500367 A446 -Y477 0.178957212510874 S465 -L475 0.178317563889498 Y477 -E483 0.178170605743536 G423 -A461 0.177128535857265 P445 -N476 0.176986950926331 P447 -L475 0.176295348895959 E464 -V487 0.175481078339427 P418 -R482 0.175355792524892 T460 -Q474 0.173983586080974 R497 -Q512 0.173686942219359 T420 -T467 0.172889075922076 M488 -V500 0.17273726820879 M488 -G493 0.170454176212841 R426 -W453 0.16764674107472 G429 -A461 0.167121025600951 N430 -G442 0.166787672602871 D440 -A461 0.165783644043072 A461 -G490 0.164639844885255 P418 -R426 0.164429471029828 Q499 -P506 0.164290542640826 G457 -A469 0.164135818320844 G429 -A480 0.163897491010458 L422 -A427 0.162908003398702 G442 -S454 0.162724947679598 D440 -T467 0.162096896604192 A492 -G520 0.161636831452177 V487 -A521 0.161538552304408 G448 -A480 0.161256394558569 E483 -G502 0.160551179653546 Q474 -E501 0.158839373648564 L422 -T467 0.158837795163518 L422 -N476 0.157841629465215 A492 -E514 0.157435792946793 G493 -Q499 0.155197041752157 A469 -V496 0.155043809180182 D440 -N476 0.155025689587079 Y421 -F479 0.154698964411857 Q443 -L475 0.154293674709802 T424 -W459 0.153706532154223 P445 -S456 0.152475482693315 I466 -M488 0.15125482334088 T424 -I466 0.150935457531852 Y441 -Y477 0.150850045449919 L486 -G520 0.150228550522048 S458 -S465 0.150218812679329 E419 -Y477 0.149684655683337 V500 -P505 0.147992321513433 L455 -T460 0.147831290826199 V487 -A509 0.147341486018995 S454 -S465 0.145403853578427 W453 -W459 0.144835824462116 E419 -E483 0.144266836905615 N430 -N444 0.144242345168998 A427 -G462 0.14296348945246 M488 -A509 0.142015948222445 A468 -Q499 0.141350743435158 L455 -S465 0.141261714642405 F485 -T517 0.141061093812324 Y421 -L455 0.140489914182469 A509 -V516 0.139794215423604 V500 -G520 0.139295779000363 W453 -F479 0.138831231393569 T420 -S454 0.137539559332204 T467 -G472 0.136834906719832 R482 -G502 0.135868610260989 G472 -R497 0.135717615093798 A461 -R470 0.134172809013531 N430 -T450 0.133976293271054 A446 -N451 0.133088986665004 A427 -N476 0.133075490690525 L422 -G429 0.13281644393725 G442 -P447 0.132167654605884 P491 -G508 0.131351828574754 Y421 -A461 0.131026476679075 Y477 -G503 0.130235631258151 N451 -E483 0.129738292932486 E464 -E515 0.12939153927544 S454 -W459 0.129257980922541 G429 -F479 0.128693355305285 G490 -T517 0.128653565492986 G429 -G448 0.128180173180162 V498 -V511 0.127615298283692 N476 -L486 0.127012725896675 D510 -T517 0.126180213956897 V498 -V516 0.125868313350273 D510 -S519 0.125683587182829 P418 -R478 0.125493715332797 N444 -L455 0.1252951214494 S454 -A469 0.124891682016846 G481 -G520 0.124576671487432 D440 -S454 0.124007135124506 A473 -R497 0.123961848576627 F479 -G502 0.123060995270685 T424 -E464 0.122828028200679 S465 -Q474 0.121358727227008 R452 -G481 0.120906225372214 N444 -N451 0.119926722478767 Y421 -N451 0.119896876466962 T420 -R426 0.119691263958607 N444 -R452 0.119410711373484 Y421 -D463 0.119296380932403 S456 -Q499 0.119222036038593 L455 -A469 0.118500280167934 A427 -W453 0.118062822769053 Y421 -M484 0.118056736672157 R478 -F485 0.117776291860962 L422 -W453 0.11729301684908 T420 -R425 0.117279711187903 F479 -F485 0.117169888436256 G490 -V496 0.116430322171407 E483 -S519 0.116242206193187 M488 -V511 0.115844128138773 Y477 -P506 0.115713489047395 G503 -G508 0.114975195267589 D471 -A492 0.114727664505397 E419 -T517 0.114639216219628 A427 -S456 0.113405543264431 L486 -A509 0.113244454532756 G415 -E483 0.113093017553797 T420 -V516 0.112661124512426 R478 -A521 0.111808051086657 R470 -A492 0.11115642801536 T467 -V487 0.110124102349543 S454 -A461 0.10913330375133 A461 -A473 0.108779000839235 Y441 -S456 0.108143640684054 T460 -D471 0.107304632988261 T467 -V516 0.107292741253665 S417 -A427 0.107065830254911 V498 -A521 0.107059747194022 A446 -S456 0.106944781863056 A480 -A521 0.106469819749913 A469 -G490 0.106256051398891 Y441 -G462 0.105960012449742 S428 -L475 0.105576984493872 G493 -V498 0.105476776534106 G423 -A468 0.104508876285176 M488 -G520 0.104153266681824 S428 -R478 0.104070654544369 D510 -E515 0.10379282191616 A473 -A492 0.103717336462117 K495 -G507 0.103670900281154 Y477 -L486 0.103342371452925 L422 -W459 0.102666086469112 F479 -G503 0.102202166860416 F485 -G502 0.102054336460519 D440 -A473 0.102044344675492 G472 -V500 0.101929757744363 E501 -A521 0.101781285149226 A449 -N476 0.101702466026775 R414 -E419 0.10141263919337 A427 -V487 0.100416318095585 Q512 -S519 0.0999655516086344 G457 -T467 0.0999336737511668 T413 -A480 0.0999257309469471 N451 -L475 0.0976264623450747 G490 -A509 0.0970512663193708 G429 -G442 0.0969839989075272 S428 -T450 0.0953345501779275 Q499 -S519 0.0939666228078604 L475 -V498 0.0938856569353468 M488 -R497 0.0927530979529316 A473 -V496 0.0925413936164249 G481 -G503 0.091989182567175 S456 -A461 0.0918540652899722 S454 -A468 0.0903178980858179 E464 -G490 0.0901875242437167 E419 -R478 0.0900179193364585 G442 -A461 0.0899966276801125 L455 -F479 0.0891079276539009 T450 -G481 0.0890960900716932 Y441 -G448 0.0887553246096111 N444 -S454 0.0884953912422932 G504 -A521 0.0874307038690727 M484 -G507 0.0868902618336467 T424 -S454 0.0859843565505893 L422 -F479 0.085684813011893 S465 -L486 0.0851351831444438 A468 -V500 0.0850402084196413 G502 -G508 0.0850228040819052 T420 -M488 0.0843148585170581 R425 -G462 0.0842892965135995 G481 -G502 0.0842729936151763 A427 -N451 0.0838379840340067 S465 -T517 0.0817305993087192 S454 -T467 0.0814328908385649 D440 -L475 0.080736842855206 G442 -R470 0.0806621079810741 E419 -E464 0.0801288383029435 G493 -G507 0.0799951210408301 R478 -E483 0.0796333878416267 R478 -G520 0.0795278878690922 L486 -R497 0.0787047026137657 R478 -E501 0.0786840541877551 L422 -F485 0.0783114136636716 S465 -G490 0.0782464021176619 L475 -V487 0.0778384345974945 I466 -A492 0.0775946790998402 G423 -G429 0.0773097792614936 V498 -G513 0.0769378890805932 T420 -A449 0.076616092425986 S454 -T460 0.0759991373936153 S417 -S454 0.075975624699181 D440 -A468 0.0754018342002478 L475 -F485 0.0743158394564203 R482 -S519 0.0742775407740376 A492 -I518 0.0730321583493785 W453 -I466 0.0728085375798136 A427 -P447 0.0720781043598668 S428 -N444 0.0719494568729853 K495 -D510 0.0710267758742126 R452 -Q474 0.0708071965723664 L486 -E515 0.0700633913401869 W453 -A480 0.0700131790808109 G508 -I518 0.0692759839990931 E483 -E501 0.0692479586389673 R470 -Q499 0.0680035609557722 N430 -L455 0.0674940883960398 Q474 -G520 0.0669579944534466 L455 -L486 0.0667413015016045 D489 -V496 0.0654479981894642 S465 -V516 0.0650659083232208 G502 -A521 0.0649381354279956 G472 -Q499 0.0648590476821416 A468 -V496 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0.0522321880129211 P506 -G520 0.0522174950700067 R478 -V500 0.0521206211872967 T420 -I518 0.0518944802135133 E483 -G520 0.0515998648060605 G442 -W459 0.051441120292095 A473 -Q499 0.0513605218038257 T467 -R497 0.0513385049485233 G493 -V511 0.0511140118952444 S417 -L486 0.0503616110696949 R497 -E514 0.0496716094907379 P445 -L455 0.048446579141352 Y421 -T517 0.0481262235037709 N430 -N451 0.0469897160989017 P445 -R478 0.0466106068933598 A469 -A492 0.0460487587643804 Y421 -W453 0.0455726423981222 R470 -V498 0.0455230402852971 T460 -G472 0.0454455538891176 N430 -D440 0.0454326456328826 A446 -L475 0.0454002958366893 T413 -M484 0.0453515405713604 V498 -G520 0.0450506790410063 S428 -G462 0.0449135686230271 R478 -L486 0.044907419768867 L422 -D489 0.0442587064369033 L455 -A461 0.0439714017702464 G448 -L475 0.0434510617047188 S417 -A449 0.0427665007917621 R497 -G520 0.0425578189698399 P491 -I518 0.0419535493720915 Q474 -G507 0.0411612932599104 A480 -G503 0.0408485991612242 T467 -Q512 0.0405916588596968 Y421 -S454 0.0405118876731239 S428 -L455 0.0402614516807809 N430 -A461 0.0400740048699966 G415 -A480 0.0400662393522655 I466 -G490 0.0398990668886103 G448 -S456 0.0398191384699791 S428 -Q474 0.0395902658983585 L486 -G507 0.0395297954832303 W453 -G520 0.0382981760026904 G415 -M484 0.038224596055187 N430 -S458 0.0379775716254889 A427 -T460 0.0373614276837775 M484 -G508 0.037174705195171 Q443 -A473 0.0368601364104957 T420 -G462 0.0365639236343345 Q499 -T517 0.0365045326339986 F485 -Q499 0.0362538406152028 D489 -S519 0.0359849966389613 S428 -G442 0.0356491907073186 Q474 -G508 0.0353534029498412 N451 -N476 0.0352876261286825 S428 -D463 0.0351300133326408 M484 -G502 0.0345477258181281 A480 -G502 0.0344847053525883 L475 -G502 0.0341902004250483 R426 -T460 0.0335546721169493 A427 -Y477 0.0335315980308541 T450 -R482 0.0328419566813006 A461 -L475 0.0327173401453627 T467 -E515 0.0325610970441774 T424 -Y441 0.0323040168451576 G448 -N476 0.0318656112088171 M488 -A521 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