[Wed Aug 24 18:03:00 2016] >Input file: TM3CSLATD.pdb >TM segments: A225-237_A243-252_A258-267_A271-279_A326-335_A339-347_A383-391_A397-405_A437-445_A451-460_A489-497_A499-508_A623-630_A639-646_A767-775_A779-786_A813-821_A824-832 MAIDEN score = 83.3162 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 ----------- ---------------- A277A-R327A 10 L274A-K330A 10 Y816A-S830A 10 W397A-S443A 10 N627A-K643A 10 T770A-T785A 10 W397A-R444A 10 S261A-S278A 9.37882823973882 L243A-L266A 8.73232256425291 G267A-D272A 7.23887712163599 F400A-N441A 6.53440205526937 F490A-R508A 4.45820651185556 V628A-A642A 1.85395599500179 K779A-K820A 1.73545932385765 Q629A-V641A 1.40988171698364 I273A-V331A 1.35603085979323 Y457A-A491A 1.32696461775447 V769A-V786A 1.29152701974094 A385A-Y405A 1.28974337071314 I263A-A276A 1.27177472209677 L815A-V831A 1.26624221592889 L247A-I263A 1.24530732930991 I263A-L275A 1.22290833929763 R774A-L780A 1.20474155008182 L780A-K820A 1.14244982723449 L266A-I273A 1.10400187500123 V628A-V641A 1.09592356681871 V331A-L343A 1.0897477163122 W333A-L341A 1.08364512469608 T442A-N456A 1.05273071772689 F445A-F453A 1.04480417745582 Q339A-L390A 1.04296605296242 A385A-K403A 1.03151067971682 W397A-F445A 1.03117642606695 V786A-F813A 0.979878238477932 L264A-L275A 0.952608439932406 K246A-I263A 0.911505341392205 L343A-F386A 0.90446328473961 A233A-K330A 0.89906893701996 F490A-L507A 0.879164011505846 A265A-D272A 0.811928210836243 L346A-N383A 0.782493799517328 V784A-F813A 0.77701263935014 L390A-F400A 0.754667846574762 V784A-L815A 0.751412003277048 I259A-S278A 0.748938490977921 S250A-I259A 0.74563072359931 L275A-L328A 0.744909527910997 L266A-L274A 0.723959115816352 N627A-V641A 0.713579258088131 L264A-L274A 0.70730046581397 L237A-L243A 0.700798354838119 L459A-F490A 0.687293358362746 F236A-A265A 0.680233771725309 L771A-V784A 0.67761102763437 L780A-A817A 0.67291400034461 L237A-A265A 0.671730669938823 D387A-Q401A 0.660020327222404 F626A-V644A 0.634625200188393 F626A-A645A 0.631238048808689 F490A-G506A 0.624252693921399 G252A-F258A 0.623993430848406 A391A-F400A 0.617826179897487 S818A-G829A 0.612943053151378 T251A-F258A 0.609968942213705 F813A-E832A 0.602032521823725 G271A-V331A 0.597577960778398 F258A-E279A 0.592186328568371 Y457A-L489A 0.57834581065495 W333A-Q342A 0.577303525604868 G262A-S278A 0.563628693474528 Q438A-E460A 0.563181604937935 L237A-L266A 0.555956152219949 A233A-L266A 0.555892901714175 L821A-L827A 0.555523990282053 N383A-Y405A 0.54973167237458 N441A-G458A 0.545388877426147 Q440A-N456A 0.543979760547263 S326A-L346A 0.542405773842265 S250A-F258A 0.532426367978968 L341A-F386A 0.529980395075275 A249A-F258A 0.527903602988302 L398A-R444A 0.525321402967549 F400A-A439A 0.518800415670199 F236A-L243A 0.517595159125559 L459A-L489A 0.515363945925337 E623A-A645A 0.511605724445745 Q339A-Y388A 0.505061619389138 F400A-T442A 0.50310113952046 A775A-D781A 0.501864405672444 L328A-S344A 0.496867806654379 I263A-R327A 0.496286233114853 Y345A-A384A 0.494246765639765 L341A-S389A 0.491798100330868 L275A-A329A 0.491377991997445 Y495A-L501A 0.486050493338622 I263A-L274A 0.478004594163891 L274A-V331A 0.471739806848301 K330A-Q347A 0.455289775211719 F236A-G244A 0.442880105993107 T251A-E279A 0.442407874953714 L328A-L346A 0.441842053948623 Q630A-K643A 0.434545492471813 A276A-L328A 0.429137751800074 F386A-L404A 0.423740854429012 S818A-L827A 0.423606649711961 L275A-R327A 0.421021852529603 L459A-R508A 0.413201009835743 L815A-S830A 0.400352326151999 F453A-L493A 0.398375070230768 Y816A-R828A 0.39717619635183 F445A-R454A 0.396457734493534 L404A-A437A 0.395488895044586 S818A-T826A 0.386744107406698 F236A-K246A 0.385706797264442 H248A-S824A 0.383735407343033 W397A-N441A 0.382579728422747 N492A-G505A 0.380935918376425 L343A-A384A 0.379349264654722 Q438A-G458A 0.373476758564501 A249A-I259A 0.370713777629586 T785A-F813A 0.366939294163636 L247A-S261A 0.364350196966006 Q630A-L640A 0.359708427332345 L390A-L398A 0.356988513312842 L346A-A384A 0.354888109365356 A329A-L346A 0.354863721667286 K330A-N383A 0.354358274423961 D814A-E832A 0.352529427316123 G625A-K643A 0.3499167455211 A391A-D399A 0.349852411691473 A775A-A817A 0.349392158866133 S261A-A276A 0.347618155472999 Q347A-Y405A 0.345747979622741 D399A-R454A 0.345593083594143 G458A-A491A 0.33931942171546 E279A-Q347A 0.336935238300201 Q401A-Q440A 0.336662537367019 K403A-E460A 0.330943839017197 D272A-R340A 0.329109208025459 S768A-T785A 0.327663215777082 G332A-A385A 0.322608247710348 A439A-E460A 0.320583917010965 T251A-I259A 0.318346307985311 A265A-L275A 0.316918512117414 A265A-L274A 0.316326932297576 A276A-S344A 0.313015982662031 G245A-A277A 0.31234619619234 T494A-T502A 0.308027614051927 D781A-Y816A 0.30680637822213 H248A-G829A 0.306021069977006 A782A-L815A 0.305764786536147 Q401A-E460A 0.303505583146328 L341A-Y388A 0.301684275879515 Q629A-A642A 0.299894625294109 A455A-L493A 0.299834934795666 V331A-L341A 0.29863601698735 L780A-Y819A 0.298343114276836 V769A-Y816A 0.298119982312555 T770A-G783A 0.298042085775252 G783A-A817A 0.297660089417536 S344A-F386A 0.296000713133539 L815A-E832A 0.295018090746501 D387A-L404A 0.294052954804013 A775A-L780A 0.293755437527715 A329A-L343A 0.289916646030238 L780A-G829A 0.285952130711464 V231A-D272A 0.281990459970643 L274A-L328A 0.277354913728613 V628A-L640A 0.272481945462715 G271A-L343A 0.272073913981084 G458A-L489A 0.270311474085628 G332A-R340A 0.268321889328944 S768A-V786A 0.267527215309428 S389A-F400A 0.267188360447695 S232A-G244A 0.266813204397799 A402A-A437A 0.26276878110607 G332A-S389A 0.262309967483046 A265A-G332A 0.26191009285808 Q339A-Q440A 0.261261152883744 Q342A-Q438A 0.261015204204661 S443A-G458A 0.259520429473 Y345A-D387A 0.258440044696705 G783A-L815A 0.255263071413713 G267A-I273A 0.254983906736206 F386A-Y405A 0.249406692013748 L237A-G267A 0.247900534932107 I273A-G332A 0.245934496087818 G458A-L507A 0.245262854245 S234A-K246A 0.244786665672642 S232A-L275A 0.244698796664686 L390A-N441A 0.243936498541666 T785A-L815A 0.24304222897956 A249A-G829A 0.242919883348703 L398A-T442A 0.242666330843519 A775A-G783A 0.241026733789038 A455A-A491A 0.241014337937854 N456A-F490A 0.238865507028766 S234A-Q342A 0.236748432592132 V784A-Y816A 0.236645195688503 A391A-R444A 0.235506720412505 A391A-Q401A 0.232941661978986 G245A-I263A 0.232845745674316 A233A-L274A 0.232308870315024 T494A-L503A 0.231713443950529 A233A-L264A 0.231524138824396 D387A-Y405A 0.227399792925073 S344A-S389A 0.225335068588791 F453A-G505A 0.225322473677101 Q342A-A385A 0.224286330542283 S232A-S278A 0.222165847572194 D272A-W333A 0.221495020727144 G244A-L264A 0.220746933817605 G773A-L780A 0.220400941752812 V628A-V644A 0.220113958993878 D272A-D387A 0.217091380569044 G244A-L266A 0.216979197420249 D781A-D814A 0.21652806452009 D781A-G829A 0.216483836767588 S232A-S261A 0.214957347395542 S232A-A277A 0.214672231177719 H451A-L503A 0.213018449704387 N441A-A455A 0.209580980280837 L275A-K330A 0.209349063825814 S234A-V331A 0.209075193830109 S278A-R327A 0.208925087468078 Q440A-L459A 0.206214878225931 T770A-V786A 0.205595209539204 S443A-N492A 0.202552034411598 K403A-A439A 0.201982956487173 L390A-Q401A 0.201045538260939 G244A-A276A 0.200652623086587 A782A-D814A 0.2002394673746 L328A-N383A 0.198871158554128 T230A-N383A 0.198378815546675 R444A-N492A 0.197682320606476 D399A-N456A 0.196883848127109 D452A-D496A 0.196252805132026 L237A-D272A 0.19622442234812 R454A-E504A 0.195661448007066 V784A-V831A 0.194502391632355 G252A-I259A 0.193190081588581 K779A-S824A 0.192706005384756 N627A-Y646A 0.192468494350773 S232A-G267A 0.191721590314346 Y495A-W500A 0.189122332380712 S389A-Q438A 0.188804773058344 D496A-E504A 0.188419812238511 S232A-L237A 0.188402506197107 R340A-L390A 0.186401550086461 V231A-S261A 0.186377752623461 T785A-Y816A 0.185384472550698 S232A-N383A 0.185114095252876 L237A-G271A 0.184969344751577 L243A-G267A 0.184797208573772 S232A-L274A 0.184761520420559 L771A-T785A 0.184552371823812 G262A-A329A 0.183527404501833 S443A-Y457A 0.18308584569418 F386A-A439A 0.182433530069662 R340A-Q440A 0.182066487967223 N334A-S344A 0.181840345541601 D399A-A439A 0.181448028585872 E623A-K643A 0.181303313348266 D272A-A329A 0.180614968221373 L274A-S344A 0.180376410735533 G458A-G505A 0.179293431588787 Q440A-G458A 0.179140842414784 G252A-Y816A 0.178909048763019 L237A-G332A 0.178652571100717 D387A-D399A 0.178469356478825 L247A-G260A 0.17712647309389 D496A-L501A 0.175956162778778 N334A-Q342A 0.174820887761885 A782A-A817A 0.174564954803058 K330A-L346A 0.17356507396898 A233A-S344A 0.173416862697017 H451A-E504A 0.173236679852824 L328A-Y345A 0.173076968553316 T251A-T826A 0.172300371364956 G772A-Y819A 0.172086587979291 G271A-Y388A 0.170887790175501 Y819A-L827A 0.170821159643651 G260A-A276A 0.169911988948937 G772A-V786A 0.167731050277489 Q401A-R444A 0.165545976035573 N627A-R639A 0.165158435548689 A276A-G332A 0.16508919808427 G244A-A277A 0.164664409994625 F228A-N383A 0.163742566765011 E460A-R508A 0.163285121510108 N334A-L341A 0.163183712606444 Y816A-E832A 0.162848266416825 T770A-D781A 0.161783098584746 G244A-D272A 0.160495199451878 G271A-W333A 0.160178815481813 G244A-G262A 0.159648810456084 R444A-D496A 0.158556895680572 L274A-A329A 0.158309701291672 G267A-L275A 0.157914385676412 A782A-T826A 0.157323491424689 V231A-S278A 0.156436444708237 G772A-K779A 0.155685824291519 A817A-E832A 0.155036288636831 S344A-Y388A 0.155026357972766 K403A-G458A 0.154744263919534 G332A-L343A 0.154678191060024 V628A-K643A 0.154024368690918 A437A-G458A 0.153866072038425 K330A-Q342A 0.153832733811994 Y816A-V831A 0.153624092756662 W397A-L493A 0.15243581709548 K246A-L827A 0.152011158181755 A265A-I273A 0.15166125361754 G244A-S824A 0.151582536324241 T494A-G499A 0.151441009051403 R454A-N492A 0.151047116503106 I263A-A277A 0.150384846484836 H248A-A265A 0.150341224227815 A233A-R340A 0.149770992776636 D235A-K330A 0.149749525235782 F490A-G505A 0.149585326611161 A233A-I273A 0.14954999081547 A265A-G271A 0.146993701875636 A391A-A402A 0.146712939017283 G260A-L827A 0.145861428213519 G773A-G829A 0.145845199566921 S389A-N456A 0.1448878262419 G267A-A276A 0.142524946210846 G332A-Q342A 0.141906298656458 S250A-L827A 0.140651746383016 N456A-D496A 0.140551716592972 W333A-S344A 0.140315420255916 D399A-N492A 0.139845804043313 R327A-A384A 0.137044391322905 L328A-Q347A 0.136986304654776 D452A-W500A 0.136046256653403 K246A-L264A 0.135474127117823 S234A-L266A 0.135315682856293 S261A-E279A 0.134133312424316 G245A-G267A 0.133191209164333 E460A-N492A 0.130926589459736 Q629A-L640A 0.130560089494776 A645A-G767A 0.129981726188447 K820A-G829A 0.129718582540708 H248A-L264A 0.129112211408809 V331A-S344A 0.128031353566958 L335A-L341A 0.127901028855614 K779A-L825A 0.127411384931588 H248A-A276A 0.126905482120389 T230A-S326A 0.126707600693341 N229A-D387A 0.126478204672859 D272A-S344A 0.125503478454815 N441A-T494A 0.125142498551027 S443A-A491A 0.12452116343156 G267A-K330A 0.123895868162904 F453A-G499A 0.123888343639718 T502A-N627A 0.122143700848941 Y388A-L398A 0.122095465880133 I273A-A329A 0.121516344966373 L390A-K403A 0.12117797023011 L390A-W397A 0.121125313327731 S234A-N334A 0.120903535951353 A391A-A439A 0.120782005318491 Y495A-L503A 0.120194205811163 A455A-D496A 0.120066806950033 A265A-L328A 0.119740445508315 N456A-E504A 0.119534540343606 I259A-S326A 0.119477799290338 L780A-L825A 0.119196779326121 I259A-A277A 0.118948168768793 G783A-G829A 0.118576776912025 S232A-L328A 0.11831630230235 N334A-A391A 0.1175021633131 L274A-L341A 0.117414992993233 N229A-A385A 0.117317821228244 A277A-Y345A 0.117175133514074 Q438A-F490A 0.116963414466743 A249A-A276A 0.116900471074266 L341A-Y405A 0.116351583096364 Q401A-S443A 0.116071246065649 Y457A-Y495A 0.115898053741271 S232A-A384A 0.115791095927722 V231A-K330A 0.115673825219059 S234A-L264A 0.115429437853001 T230A-L274A 0.115145095373483 L275A-S326A 0.115014563111864 W333A-L343A 0.114859372317964 D781A-T826A 0.114499924599807 R327A-Y345A 0.114243735128979 S389A-T442A 0.113897027123657 S250A-G262A 0.113809404815358 I273A-L346A 0.113682314791678 S278A-L346A 0.113656846853635 S250A-V831A 0.113071625270045 S234A-S344A 0.112714129953028 G245A-A329A 0.112669351652718 I273A-N334A 0.112599402304034 D452A-N492A 0.111720253680058 A265A-S278A 0.111339594481119 D781A-S830A 0.11087370884677 T230A-A384A 0.110585808485334 N456A-L493A 0.1104584030855 T230A-L275A 0.11018531324957 L341A-L404A 0.11001626742036 S232A-L343A 0.109743712368295 D814A-G829A 0.109412812978323 T770A-V784A 0.109393543559994 S232A-S326A 0.10901567520955 V784A-D814A 0.108613550467483 G783A-E832A 0.108290070915643 V231A-G332A 0.10820476897685 Y345A-Y405A 0.108181674619451 L237A-L275A 0.108126453348662 L398A-N441A 0.107881865517 G458A-T494A 0.107285371115 V644A-G767A 0.10675658162742 A233A-G262A 0.106648146430863 V769A-V784A 0.106235680943897 A402A-S443A 0.106110159769099 N229A-S344A 0.105926897597489 I259A-G829A 0.105513357337754 W333A-Q339A 0.104993177630059 A277A-L328A 0.104864844793007 A233A-A277A 0.104350643260482 A402A-F490A 0.104262061780654 D387A-F400A 0.104258735812216 S234A-A329A 0.104188794793075 F400A-G458A 0.104178261381489 G773A-T785A 0.103966393089269 G772A-F813A 0.103679246441688 S344A-A437A 0.102953667009545 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