[Mon Aug 29 17:49:11 2016] >Input file: TMQ8BRH0S4G.pdb >TM segments: A433-446_A450-463_A467-479_A484-495_A500-515_A517-527 MAIDEN score = 5.6896 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 ----------- ---------------- G458A-A470A 8.34126140636192 M489A-K523A 1.29632892504408 K452A-A477A 1.0922975810862 I485A-Q517A 1.06137962823182 F474A-H488A 1.02938718679558 H459A-F474A 0.956464367364918 W454A-F474A 0.944531076096086 K512A-K523A 0.929377142309394 F474A-V491A 0.922115059829912 E436A-A460A 0.918931684851533 A511A-K523A 0.87719188966262 A477A-D484A 0.86892376706542 W433A-A460A 0.78939139294717 F440A-V457A 0.775445041959706 H488A-L510A 0.752721944197675 L461A-F467A 0.684539011645772 W454A-Q476A 0.679034905886891 F467A-Y495A 0.677869269799549 L444A-L453A 0.674054256787938 Y437A-L461A 0.642486096921377 L471A-V491A 0.62066674970158 A470A-V491A 0.612747243901553 W433A-L461A 0.610547080168258 L471A-Y495A 0.604891995366334 N450A-A477A 0.580778836199347 T478A-H488A 0.579433067477055 R493A-A504A 0.538609151144765 E462A-L471A 0.532961976458388 I485A-K512A 0.530403949166564 F440A-W454A 0.525876908869115 M489A-A511A 0.5097836891864 A451A-T478A 0.503061737832811 Y508A-A526A 0.466770443531334 V457A-A470A 0.45910799101576 K512A-K522A 0.452541565342742 T494A-E505A 0.446447067880837 F440A-N456A 0.439230671428954 E505A-A526A 0.43708687346906 N463A-K469A 0.433622145585375 N490A-K522A 0.433065597892491 F440A-L453A 0.432320138601018 Y508A-Q517A 0.429092591855758 Q517A-K522A 0.417061929885636 A477A-A487A 0.413408670116306 N455A-H479A 0.412168071309495 L475A-V491A 0.411549691329131 T494A-A504A 0.410258968811293 V491A-A504A 0.407916036980152 R493A-A526A 0.397718465893602 Y437A-S442A 0.397102489237342 K512A-Y524A 0.391633092899574 N450A-H479A 0.381853853841463 A511A-A526A 0.378167648944147 A470A-T494A 0.37065813761743 W433A-N463A 0.366517833329818 L461A-A470A 0.366274171577652 E505A-K523A 0.361767441573746 A506A-A526A 0.359945547569119 L444A-W454A 0.359559380154276 Y437A-A460A 0.3523729847337 A443A-L453A 0.350535905262367 N455A-R493A 0.343504517419449 N455A-A460A 0.339062555003061 F474A-D484A 0.336895745012381 K469A-A477A 0.336501619051309 D484A-A511A 0.335321075359476 L510A-M515A 0.334147617675568 E436A-G458A 0.33246745519074 F474A-A487A 0.330739104595338 H488A-K522A 0.32830263973907 G458A-K469A 0.327670311784728 G492A-A525A 0.326777184475136 Y473A-G492A 0.32344210292029 M509A-K523A 0.32276506086802 N455A-K469A 0.321840252962151 G458A-K472A 0.315021863301111 E436A-L461A 0.307705194687411 H488A-S513A 0.30346146767401 G458A-Y473A 0.300339643398538 L453A-A477A 0.299272406617401 N490A-M509A 0.29598952175494 H459A-A470A 0.295594091751764 V491A-M515A 0.293721321897376 K452A-H488A 0.291993037649128 Y473A-G486A 0.2861848895901 I485A-M515A 0.284822878111239 M489A-Y508A 0.283411575484976 E468A-Q476A 0.283091921130415 E436A-V457A 0.279288397129794 R493A-M509A 0.278202876195246 N456A-E468A 0.27389968923611 Y508A-Y524A 0.271652260456973 N456A-M489A 0.271175403719139 F474A-N490A 0.269066046704458 K472A-H488A 0.266758903890628 R493A-E505A 0.263923342542246 Q517A-Y524A 0.263470506343848 W454A-G486A 0.261051177827952 E462A-V491A 0.259729529866238 R493A-Y508A 0.258209787025918 Y495A-R502A 0.25805702604395 T438A-W454A 0.257794416111272 M489A-S507A 0.25561308966351 K472A-N490A 0.255137924102363 L475A-G492A 0.253051196921776 Y437A-V457A 0.251870417900966 V457A-E462A 0.247183421309283 W433A-G458A 0.243135905944053 L475A-T494A 0.240562782684593 S507A-K522A 0.239956426780734 H488A-Y524A 0.238465391773604 Y508A-R527A 0.235833468805946 M441A-V457A 0.23503011936258 G492A-E505A 0.234291649387601 A451A-D484A 0.233034464857092 K445A-A451A 0.231771382786963 V491A-S507A 0.227016560656541 Y495A-A526A 0.226501022163065 N455A-G492A 0.22573061789588 L471A-Q476A 0.225505090921262 Y437A-K445A 0.223119114400872 A443A-A451A 0.221638124708598 N450A-G458A 0.219469820311833 N450A-Q476A 0.216709581626234 A504A-K512A 0.214235418060069 M489A-R527A 0.210332966639501 R493A-A506A 0.207259795844538 R493A-K523A 0.207118491107105 S435A-A443A 0.207001259168097 N463A-G492A 0.206288646845375 S435A-V457A 0.204644913351155 V491A-S501A 0.204602959984414 L475A-A487A 0.200180576250108 G486A-G521A 0.200146847945782 H488A-R493A 0.197903932899999 H459A-R493A 0.197788927679645 T438A-N456A 0.196252569331514 E503A-A526A 0.196128691551066 R500A-Y508A 0.196050728242886 A506A-R527A 0.19539124099146 A460A-A470A 0.195232944898381 S507A-Y524A 0.194334033771205 N490A-L510A 0.193762040639591 L444A-N450A 0.193680192578623 E503A-Y508A 0.193374679383548 F440A-K445A 0.190806219456475 N463A-M489A 0.189558875464103 Y437A-F467A 0.188832591022637 H479A-V491A 0.188683807945875 S513A-P520A 0.187821956806108 Y473A-Y495A 0.186890752380789 E462A-H488A 0.185920207307586 E434A-K469A 0.185206569597573 D484A-K523A 0.185069574832311 H459A-A477A 0.184439296232835 H459A-Y495A 0.1824417127618 L471A-T494A 0.182200320634477 G458A-L471A 0.182122503489 E468A-Y495A 0.181999088660114 L439A-G458A 0.179587166078725 D484A-R493A 0.179118881959581 G486A-L514A 0.178491622622767 G486A-L510A 0.176033680807345 Y437A-W454A 0.175859859693561 G458A-H488A 0.174308656884495 G486A-Y524A 0.173789452306678 H459A-G492A 0.173085712260905 N455A-S507A 0.171407394872042 E468A-H488A 0.17020544111349 A511A-G521A 0.170039600471545 S507A-R527A 0.167695584677578 N455A-L475A 0.167561295238179 N455A-D484A 0.167556899930207 F474A-H479A 0.167163413268678 T438A-K469A 0.164752862946763 P520A-R527A 0.164478783635031 G486A-T494A 0.164213809768905 T494A-K523A 0.162617311513523 N456A-F467A 0.159717638066752 V457A-F467A 0.15969784402338 T478A-D484A 0.1584888591584 L439A-V457A 0.158118567767399 M489A-K522A 0.155362982915714 G492A-K522A 0.155287967992593 K452A-A470A 0.15384077067062 G486A-M509A 0.153623925788885 A451A-Q476A 0.152927551417438 G492A-K512A 0.152007699050579 S513A-Y524A 0.15135739320348 T478A-G492A 0.151335296970612 A460A-H488A 0.150598299357809 K472A-D484A 0.149854940365802 T478A-T494A 0.149235505379389 Y473A-M489A 0.148388740722997 G458A-M489A 0.146008161872238 G458A-G486A 0.145121709027402 H479A-A511A 0.144985176292242 E436A-E462A 0.144531994128825 Y495A-E505A 0.144075421915705 S442A-N456A 0.143779461908897 E434A-N463A 0.143419479093171 Y495A-M509A 0.143235961553901 S442A-N450A 0.142998066719734 A511A-R527A 0.142970288360628 D484A-N490A 0.142939399304991 R500A-A526A 0.14279864259125 I519A-A525A 0.141876925915441 E505A-K522A 0.141400255067399 T438A-G458A 0.140613306561699 A460A-R493A 0.140444043505545 E436A-N463A 0.140304557153313 Y495A-R500A 0.139928994264651 A470A-G492A 0.139038340494924 R493A-A511A 0.138917679899294 I485A-N490A 0.138495108358832 K469A-R493A 0.137586331747209 M489A-I519A 0.136524241949804 I485A-I518A 0.133538566082261 H459A-L475A 0.133376070293322 M489A-Q517A 0.133120982932727 L453A-T478A 0.132900974312363 N450A-Y473A 0.13226898430646 A460A-A477A 0.132209422765834 L453A-L471A 0.131809007925408 G458A-H479A 0.131407841949589 D484A-Y508A 0.130998404630287 A443A-N455A 0.130586734392675 L453A-K472A 0.130087641670251 L461A-V491A 0.12914404873366 L439A-V446A 0.128708028867663 N490A-A525A 0.127819576120537 N455A-E468A 0.126261471386586 L461A-K469A 0.125894450810517 A443A-A460A 0.125051503310395 A451A-A470A 0.124937241698311 L461A-Y495A 0.124681094478396 V491A-L510A 0.123396355565261 E468A-Y473A 0.121815557280371 M515A-G521A 0.121604788706773 K512A-Q517A 0.121281514608196 E462A-T494A 0.120959006091881 N463A-F474A 0.120955478729435 M489A-L514A 0.120516894409757 E503A-M509A 0.120050550743813 I485A-K522A 0.119971501886551 M489A-E505A 0.119949379596616 G492A-R502A 0.119811158076584 S513A-A526A 0.119747420467136 D484A-S513A 0.118268052402541 L510A-Q517A 0.117967636945429 V457A-L475A 0.117910408465947 V457A-F474A 0.117738863573588 N450A-L475A 0.117619800902515 T478A-S507A 0.117583104869181 A470A-S507A 0.11709676592676 H459A-T478A 0.116770678623763 K452A-L475A 0.116734190403282 V491A-E503A 0.116569825433142 N463A-Y473A 0.116501089679822 R502A-A526A 0.116452149025063 A443A-H459A 0.115932404417314 L475A-S507A 0.115429245499973 A451A-N490A 0.115042298553127 W454A-H488A 0.114918450746826 V446A-A451A 0.114821717670813 Y473A-H488A 0.113871661521563 N455A-Q476A 0.113565220259476 I518A-K523A 0.113514681341513 A504A-A525A 0.11252069895633 N463A-Y495A 0.112315010692266 I485A-A511A 0.110488353313168 A460A-G486A 0.110472556422853 V457A-K469A 0.110382060412412 L461A-L475A 0.109624183236321 S507A-A525A 0.108403620464603 W433A-K469A 0.10763424267564 A460A-E468A 0.107630022115681 S435A-L461A 0.10710371106912 F474A-M489A 0.105259210302856 N456A-L475A 0.105236479782818 A451A-K472A 0.104776102283925 L453A-D484A 0.104630971852066 M441A-Q476A 0.104612005969004 G458A-T478A 0.101266210139709 T478A-A511A 0.100919012762682 S501A-A511A 0.100147265783672 R493A-E503A 0.0990212217986537 H459A-E468A 0.0980075953226481 A451A-A477A 0.0964534531296 L453A-N490A 0.0960876280931666 R493A-A525A 0.0948041373349859 E434A-A460A 0.0946670132841181 F440A-A451A 0.0932547800391035 E434A-H459A 0.0929258439612903 G458A-G492A 0.0923428634593768 S442A-K452A 0.092217483253219 A487A-L510A 0.0920804558844894 L510A-A526A 0.091866098233967 L510A-A525A 0.0917437975221169 M489A-K512A 0.0914574669069719 L471A-M489A 0.0913464073731234 L471A-A504A 0.0906762127858789 T494A-A526A 0.0898922466579934 V446A-K452A 0.0896748764235507 M441A-L461A 0.0896543629216131 E434A-G458A 0.0891221023330626 K472A-G492A 0.0888582581826279 N490A-R500A 0.0873342124609371 F440A-F474A 0.0863385155643233 G486A-K522A 0.0859412151381835 L475A-R493A 0.0858952400394164 F474A-A506A 0.0856966203654661 T438A-N455A 0.0837305521018261 L461A-A487A 0.0833700780893896 M441A-A451A 0.0826489350442945 K452A-H479A 0.0825986300609083 H479A-G486A 0.0819211871264125 N456A-T494A 0.0816156033390754 G492A-S513A 0.0799102994761027 K472A-V491A 0.0793888992784368 T494A-A506A 0.0788688556029289 H459A-N490A 0.0786297980824511 R493A-R500A 0.0783925411192361 F440A-Y473A 0.0783673178635627 S442A-G458A 0.0774858835596293 I485A-P520A 0.0773978063848932 V491A-A525A 0.077294153474873 V491A-R502A 0.0768243927056186 A470A-A504A 0.0765982357057391 Y473A-S507A 0.0764160115979253 M509A-P520A 0.0763619602146053 Y437A-N450A 0.0761341414893733 H488A-S501A 0.0759966500755511 I485A-A506A 0.0747103975069736 L444A-A477A 0.0746869328617747 H488A-L514A 0.0746006449249066 M441A-E462A 0.074433140824719 R500A-S507A 0.0732803281780624 F474A-Y495A 0.0730592239109096 A487A-Q517A 0.0728278890449716 S501A-R527A 0.0726553573479769 L471A-G486A 0.0723671614684616 W454A-H459A 0.0720676935691446 Y508A-L514A 0.0719554379914 E503A-A511A 0.0718259406213022 L444A-F474A 0.0712926949568091 E462A-L475A 0.0711083624363717 E505A-M515A 0.0706113654968337 A470A-G486A 0.0697981533396641 A460A-T494A 0.0694274823828671 E434A-N456A 0.0693927810424642 S507A-S513A 0.0684618828678295 E468A-G492A 0.0682058303663811 K469A-Q476A 0.0681313266573511 L471A-G492A 0.0678880368381511 H479A-S507A 0.0677517792677798 T478A-A487A 0.0674780352901152 S442A-W454A 0.0667946781390016 R493A-K522A 0.0667776200630605 I485A-L514A 0.0665635955547294 S435A-G458A 0.0664514806223311 A451A-L471A 0.0662599852757813 L471A-R500A 0.0662444223700267 Y437A-N455A 0.0660381076901349 W433A-N456A 0.065875916400786 T478A-Y495A 0.0649997510795748 N455A-Y495A 0.0647656484106636 S442A-A451A 0.0643336382968913 E468A-E503A 0.064232059538173 H479A-M489A 0.0639970804640959 G486A-A506A 0.0632134914570281 M441A-L471A 0.0623570844393573 A511A-A525A 0.0617468320688193 G486A-A526A 0.0617175163264951 K472A-R493A 0.0614139193369709 A487A-A506A 0.0609720573493284 Y508A-S513A 0.0609215502659719 A451A-G486A 0.0604766391517213 Y473A-R493A 0.0602354409743748 L514A-I519A 0.0600094907684252 G486A-A525A 0.0598930003705931 L453A-G486A 0.0595218717383956 M441A-A470A 0.0592497959637002 T494A-R502A 0.0586527606425288 T478A-Y508A 0.058544109802225 N490A-Y524A 0.0584332464322851 F474A-A511A 0.0582513800525049 Y495A-Y508A 0.0579708991266688 H459A-V491A 0.0573006485885044 F440A-A477A 0.0572746261056887 G492A-E503A 0.0570116791656547 L444A-G458A 0.0569356361453259 S513A-G521A 0.0560113946555023 S435A-N463A 0.0557289430563241 L461A-R493A 0.0551896278402331 A460A-G492A 0.0550734810858802 F467A-A487A 0.0536608638527083 W454A-D484A 0.0536577956590474 L475A-G486A 0.0530076899262459 N463A-A487A 0.0520257657740721 L471A-S507A 0.0519656034715408 N450A-V457A 0.0519450190509732 G486A-K512A 0.0519448770886566 L471A-H479A 0.0515412514764494 I485A-Y524A 0.0508545966206149 I485A-T494A 0.0503859368621167 L444A-L475A 0.0502348767624827 T438A-Y473A 0.0501634640231221 L444A-A460A 0.0494028588568711 I518A-Y524A 0.0491898596366278 S435A-N456A 0.0491582519211233 E468A-T494A 0.0481863777189329 F467A-T494A 0.0470473781763641 L475A-E503A 0.046888505181045 D484A-S507A 0.0460306423401267 H488A-K512A 0.0459859905643363 H488A-Y495A 0.045784414229729 K445A-K452A 0.0456930157821898 T478A-M515A 0.0453413679996335 E505A-L510A 0.0452702150981557 N455A-F467A 0.0450991955494411 A504A-Y524A 0.0450192723222398 E505A-K512A 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