[Wed Aug 24 18:32:09 2016] >Input file: TM4MNDATD.pdb >TM segments: A371-398_A427-455 MAIDEN score = -12.8860 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 ----------- ---------------- P440A-R446A 1.0007972820219 I429A-V435A 0.958985905948887 D382A-F387A 0.490093077467489 E445A-C454A 0.421726607483892 L381A-D386A 0.32768080324856 E445A-F453A 0.311329285025843 S428A-R434A 0.30261299273428 R383A-L388A 0.281660501351758 V385A-D444A 0.271152641409069 N437A-R443A 0.267459894051303 I429A-R434A 0.238194317420463 R383A-K442A 0.234083651954012 K442A-I447A 0.211647173207563 R443A-M451A 0.20639687528714 G375A-D382A 0.202932575734688 E427A-R434A 0.201053535913612 D382A-K442A 0.192048165683838 V385A-R443A 0.187286487085 D444A-L449A 0.184053868269408 L390A-P398A 0.183795003564941 S379A-K442A 0.182475792502919 G441A-I447A 0.174145159967038 K373A-L381A 0.172649842896105 L436A-K442A 0.168900901640467 Y397A-C454A 0.166909965676505 P440A-E445A 0.154529244141257 A391A-I450A 0.149986843031366 S428A-L436A 0.149481444606113 R383A-A391A 0.142541476094535 L396A-C454A 0.141104544143123 I429A-Y438A 0.139266795914814 F389A-R443A 0.134389863646061 Y376A-F384A 0.13164800731434 P440A-L449A 0.131425231964727 D386A-I447A 0.120767523641437 K442A-I450A 0.119958027834492 D386A-A391A 0.117269099162382 F389A-Y397A 0.113886576837894 V435A-P440A 0.112135517797256 Y376A-S428A 0.110044256575148 K373A-D382A 0.107499476259366 G375A-R383A 0.10630418694153 L390A-L455A 0.103546888565857 Y438A-E445A 0.103475971492782 F384A-R443A 0.0990340710588229 E445A-M451A 0.0989593847913406 I429A-K442A 0.0977177634317354 R383A-R443A 0.0937421409352127 S379A-R443A 0.0915660319643339 F387A-R446A 0.0897254179955302 L381A-R443A 0.0829112317994911 F387A-I392A 0.0816745830300185 L390A-R443A 0.0815768014082206 L381A-A391A 0.0813635178851175 S379A-S428A 0.0802039684759626 P440A-I447A 0.0794454411549534 G375A-S428A 0.0764526419546125 L390A-F448A 0.0717581898526776 I429A-L436A 0.0672301110808311 L390A-L449A 0.0653158275480048 L388A-I450A 0.0641395833357297 F384A-I447A 0.0616374303009789 F387A-K442A 0.0613831742583102 D386A-E445A 0.0611781474642061 R383A-I447A 0.0597668217015701 I393A-L455A 0.0584020958271481 S428A-N437A 0.0524450610742606 F387A-M451A 0.0506511882205885 L436A-G441A 0.0501507362890514 D386A-K442A 0.0499479291877121 V385A-R446A 0.0490117869142861 I392A-I450A 0.0483102431619127 I429A-P440A 0.0467617944596563 S371A-D378A 0.0465857138737347 F389A-L449A 0.0449533990394739 S379A-D444A 0.038093129770891 V385A-I393A 0.0379635112358354 L390A-I452A 0.034998656530167 P440A-I450A 0.0336776979652995 P440A-F448A 0.0319147879696648 A394A-C454A 0.0308576948758814 V377A-D382A 0.0300136604236485 G441A-I450A 0.0300010565321354 D444A-M451A 0.0299010576833956 D382A-F389A 0.0281764558240489 E427A-V435A 0.0276248170663536 K372A-S379A 0.0263687293257081 V435A-G441A 0.0254654112723331 K372A-I380A 0.0253800221611367 D382A-L390A 0.0245400839751553 F448A-L455A 0.0223709492076198 F389A-R446A 0.0198907825777894 S428A-K442A 0.0189801818424264 I392A-M451A 0.018191475275291 Y376A-R383A 0.0179723729246382 I392A-C454A 0.0170800601387189 Y397A-F453A 0.0169031971800084 S371A-S379A 0.0154615513195645 V385A-K442A 0.0115867656029209 S379A-F387A 0.0114081251474764 D386A-I450A 0.00750757529391155 L388A-P398A 0.00649637299718009 L390A-M451A 0.00434926157137383 I429A-I439A 0.002614863310483 V385A-I450A 0.00250242771732667 V385A-A394A 0.00183123486433168 L390A-I450A 0.000258568539441395 L381A-L390A -0.00121393310037732 F389A-P398A -0.00247082124280174 D378A-V385A -0.00465431426592744 L390A-R446A -0.00606139097806935 V377A-F384A -0.00777549880458395 I393A-M451A -0.00798601703537383 I393A-I450A -0.00976316747239014 D382A-I447A -0.00982831315437149 F387A-R443A -0.0105447598814673 L390A-C454A -0.011134627675041 Y376A-V385A -0.0153132357231018 A394A-I450A -0.0161437618231388 V385A-I447A -0.0178939376477008 K373A-D378A -0.0208432368026781 L388A-C454A -0.0224752338928533 D386A-I392A -0.0226852931959143 D386A-I393A -0.023830950665424 A391A-C454A -0.0256698864224707 K372A-V377A -0.0271976373097695 S371A-I380A -0.0277738185942722 K372A-E427A -0.0281187212525016 S379A-D386A -0.02845480317479 G375A-I380A -0.0286837373670643 I439A-R446A -0.0291196158789004 F387A-I447A -0.0294385521443541 L388A-I447A -0.0302674953174655 R383A-L390A -0.0304098817823526 R443A-F448A -0.0336500913115838 D378A-R443A -0.0340808787869307 N437A-R446A -0.0343998071474874 D378A-F387A -0.0363141654419632 D386A-L449A -0.0383504139453197 F389A-D444A -0.0393391579188442 G374A-D382A -0.0426383122668104 R443A-I452A -0.044796499534419 Y438A-R446A -0.0457786166681928 I439A-L449A -0.046648759653019 D444A-I452A -0.0468301255935587 N437A-E445A -0.0477172456940329 L388A-M451A -0.048437596500909 I439A-D444A -0.049260089658594 R383A-R446A -0.0514241842735154 G375A-F384A -0.0533651856103973 L388A-R446A -0.0537624840115506 D386A-F448A -0.061297309595145 K373A-S379A -0.0616048776730589 I380A-R443A -0.0632427537473959 L449A-C454A -0.0667323811282934 D386A-A394A -0.0693596787583273 F387A-I450A -0.0695139920525092 F384A-A391A -0.0695606948364547 D378A-R383A -0.0751356877049627 F389A-I452A -0.0775824683260229 Y438A-R443A -0.0781057875554472 R446A-L455A -0.0786989821700126 F389A-L455A -0.0802554749340714 D386A-R446A -0.0815285502427203 F387A-L396A -0.0835708318614015 D386A-R443A -0.0840776302431374 R383A-D444A -0.0858811318535013 F384A-I392A -0.0864882502525868 I393A-F453A -0.0873054880674906 K442A-M451A -0.0897950997332755 V435A-K442A -0.0910929630587116 K372A-S428A -0.0913836687990845 F389A-M451A -0.0921185975792902 K372A-L381A -0.0921945880253325 G375A-L381A -0.0943765955735716 R446A-F453A -0.0952396556755266 V377A-V385A -0.0962519297113753 L388A-R443A -0.098555412114139 F389A-L396A -0.103972609411017 I393A-P398A -0.104160834646838 I429A-G441A -0.104309542369032 D386A-M451A -0.104974706504046 I429A-N437A -0.106611536677121 G441A-F448A -0.106769826526 D382A-R446A -0.108405541495459 R446A-M451A -0.109478354463442 D444A-F453A -0.110208198761116 F387A-D444A -0.116788546384903 I380A-F389A -0.117503256172673 F384A-L390A -0.118516959452342 I393A-I452A -0.119022511669354 L390A-L395A -0.121981666523291 F389A-F448A -0.123615797567405 L381A-F389A -0.123775874804583 D444A-I450A -0.12582253819133 I447A-I452A -0.126441345912895 V385A-F448A -0.126967341869392 S371A-Y376A -0.132149942251066 F389A-C454A -0.132742621829763 D382A-F448A -0.134659241090535 D378A-D386A -0.135145113254304 D386A-G441A -0.137184882982739 N437A-D444A -0.138522428396819 G441A-R446A -0.140925198207924 A391A-I447A -0.142952571874803 E445A-I452A -0.143845034910049 I380A-D386A -0.144506784137708 G374A-R383A -0.145881512440987 A391A-P398A -0.146308317619002 F384A-I393A -0.146334885533284 D382A-A391A -0.147091645875165 F389A-F453A -0.149758040670581 I447A-L455A -0.150104570590975 I380A-L388A -0.150286223406472 D386A-D444A -0.154697428117062 R446A-C454A -0.156178483955205 N437A-K442A -0.156393502750209 V377A-R383A -0.156516831862715 F389A-I450A -0.16057602135983 G374A-L381A -0.160803552365396 L390A-F453A -0.161347162308601 V385A-M451A -0.161937068074818 I393A-I447A -0.162239276584744 L390A-Y397A -0.162529633409344 R383A-I392A -0.16364066559614 F387A-L395A -0.163685934515116 I380A-F387A -0.165889298291391 K373A-I380A -0.16871568282039 D386A-L395A -0.170435289728336 F389A-L395A -0.170804025143777 A394A-F453A -0.172524960762818 Y376A-L381A -0.174450831146675 S379A-L388A -0.174500657822267 K372A-D378A -0.174547978813191 D382A-D444A -0.174737304171568 F387A-A394A -0.176430562496922 Y376A-D382A -0.178877063901624 V385A-I392A -0.181069955120718 Y438A-D444A -0.181366251237911 L388A-I393A -0.182752870399206 R434A-I439A -0.182922647018532 I439A-E445A -0.184317809013827 L390A-L396A -0.187510681513311 E445A-I450A -0.188880360431427 L388A-A394A -0.191935363222139 F448A-F453A -0.195286236954553 L381A-L388A -0.195815303806463 F389A-A394A -0.195899578323653 K442A-F448A -0.196883862354285 L388A-Y397A -0.197654728960468 L388A-L396A -0.201507477381963 A391A-Y397A -0.201641080514267 G374A-I380A -0.204625481138092 K442A-L449A -0.206565884342508 G441A-M451A -0.207555664400547 D378A-F384A -0.21279930464839 I447A-F453A -0.220393914920901 D382A-R443A -0.222407358332196 D382A-E445A -0.226213670516954 A391A-L396A -0.233590026137954 S379A-F384A -0.233742997209498 I392A-Y397A -0.235093855457395 R383A-F389A -0.238697554547805 V377A-D386A -0.238910012430914 G374A-S379A -0.242372944522822 I447A-C454A -0.244499724803802 L390A-I447A -0.244541989547779 L381A-F387A -0.248789481589842 D382A-L388A -0.249693877701833 I393A-C454A -0.265963589942007 F387A-I393A -0.268938884175759 F389A-I447A -0.270555104525698 D386A-C454A -0.270875172521098 L388A-L395A -0.270901642029004 R443A-L449A -0.272901088183918 I392A-P398A -0.276130310337646 S371A-V377A -0.276543740687238 S428A-V435A -0.28881247893352 R446A-I452A -0.3014501877224 V385A-A391A -0.30390507888522 G441A-L449A -0.322390061212327 I450A-L455A -0.343069693143551 S379A-V385A -0.353792037373218 R443A-I450A -0.356494703939642 V385A-L390A -0.409027343246732 L449A-L455A -0.4209347309606 F384A-F389A -0.433298544159883 I380A-V385A -0.439903349152214 F448A-C454A -0.824179269645702