[Thu Aug 25 00:20:48 2016] >Input file: TM3QE7CGG.pdb >TM segments: A18-32_A40-58_A64-71_A155-172_A179-200_A231-244_A259-275_A279-290_A303-323_A325-347_A360-375 MAIDEN score = -49.7876 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. ----------- ---------------- BBeads pair Empirical energy ----------- ---------------- L45A-I311A 1.14071755172728 L66A-T283A 1.13417109075033 V171A-I347A 1.01885203512725 L44A-I311A 0.999689423536012 N47A-L66A 0.984714085663255 E287A-L338A 0.967354896791296 V167A-V341A 0.806255419263303 P40A-A320A 0.783235364974834 E287A-I342A 0.758467010760896 I57A-S263A 0.75084614340794 S170A-I342A 0.748619807863951 H21A-N288A 0.738562352106275 V235A-N282A 0.716814201974012 V43A-T280A 0.680552138639157 L168A-A344A 0.658442981247533 A41A-V316A 0.64361363031958 S367A-I372A 0.642356008321639 I57A-R262A 0.638816256326873 A71A-V235A 0.634083842663837 A64A-I303A 0.625804293759345 T51A-L66A 0.623915345641942 A64A-Y285A 0.617163492180267 G48A-I311A 0.617106766645154 N47A-A310A 0.61422881252869 T29A-V43A 0.613815642131071 L31A-M331A 0.608283758867007 I326A-M331A 0.608061364686881 C58A-R262A 0.602518299289789 H242A-T284A 0.592819813894794 V186A-A191A 0.579735033882953 S314A-L319A 0.570259321709742 L53A-C58A 0.558950203874153 G27A-V334A 0.551055001014582 A64A-N288A 0.550544949767275 G290A-I342A 0.526639717381476 K318A-I323A 0.524998972333621 A71A-V234A 0.511861388124458 I273A-S279A 0.504117910359463 V171A-A344A 0.496260772094463 G48A-I308A 0.492434397537005 V171A-G346A 0.485921848024248 Y54A-S263A 0.483397104678248 V32A-S68A 0.475829500878321 L52A-A307A 0.475046954511814 T29A-S68A 0.471058966246703 Y54A-A64A 0.469425064471368 I49A-S270A 0.462883823764712 S314A-A320A 0.461319170005522 V30A-S68A 0.460726895454491 L370A-S375A 0.457459445941768 T51A-G304A 0.444466062461863 I57A-A266A 0.441500237002281 Y65A-T284A 0.435807203178717 Y190A-A195A 0.432502831535043 V32A-S69A 0.420710442243147 Y65A-N288A 0.416275730789573 V30A-V43A 0.414740230238847 G50A-S270A 0.411603708685667 V272A-S279A 0.402661063626104 F46A-S279A 0.400095145356154 T42A-S314A 0.399088383808104 F46A-I273A 0.397140386419949 S69A-T280A 0.396056273444377 L336A-V341A 0.395866170774517 L19A-A306A 0.394143845658619 T42A-S279A 0.392380060968578 I184A-G189A 0.391882260346557 S68A-T280A 0.389454910286432 T271A-S279A 0.388491767903909 F46A-S270A 0.387627560394455 A71A-A237A 0.379512627497135 Y339A-A344A 0.379374638923693 G67A-P281A 0.378082184880026 L53A-A266A 0.377968542358274 T166A-V341A 0.372577425778986 T29A-L44A 0.36896035181199 N267A-P281A 0.367230638595648 T166A-L337A 0.357454585917432 V165A-S170A 0.355369138800194 A41A-L313A 0.351525923375153 L55A-A64A 0.351517872982799 M25A-G67A 0.349482806832747 G27A-E287A 0.344143680155905 M264A-L269A 0.342823127090278 M25A-L66A 0.342684982869229 G48A-L66A 0.341411341286404 V234A-Y285A 0.336189809985858 H239A-T284A 0.334640789996681 P40A-K318A 0.332448989443522 M331A-L336A 0.330775302284052 T271A-T284A 0.326378933036493 A195A-A321A 0.325702306122236 G67A-A307A 0.324671751710368 V234A-H239A 0.324288200934948 L52A-G304A 0.323937289513716 G27A-M331A 0.32120735757106 T29A-S69A 0.320615882470664 G50A-Y285A 0.320569636691423 L313A-L319A 0.319756427768217 Q20A-A306A 0.318872688677331 L31A-P40A 0.318675794399974 A64A-T284A 0.318467679765945 Y65A-I303A 0.31474106176464 G286A-I342A 0.312958152536503 L44A-S314A 0.308854263708771 L233A-E238A 0.308260664324937 I157A-T162A 0.306447792463419 S314A-A322A 0.305334192945653 P40A-P327A 0.30219389099942 S159A-A164A 0.301372706566105 I369A-V374A 0.300137676173187 Y65A-V240A 0.29869110050839 G27A-G286A 0.296782597338586 N47A-I311A 0.296517970742274 A41A-C315A 0.295977144289206 P327A-S335A 0.295683846831159 G241A-G259A 0.295638335094671 T51A-P281A 0.295336037393917 L19A-A24A 0.295107596157 A41A-L319A 0.292366420842528 T29A-T280A 0.29032169037596 A28A-S69A 0.289831364912968 G27A-S335A 0.288145602923186 C58A-H239A 0.288123968306257 Y65A-V235A 0.287261922059721 V43A-G48A 0.286365512183435 E287A-Y339A 0.286357109558053 P181A-Y190A 0.284955245120432 L45A-A307A 0.284521546767025 L66A-Y285A 0.284455718582733 G67A-H242A 0.283161294063801 S68A-T284A 0.281329899441713 L55A-G259A 0.280932794509054 L22A-A310A 0.28010086709764 A24A-L338A 0.279758550367424 G67A-T283A 0.279574261694973 Y65A-G241A 0.279569247828226 L163A-L337A 0.279073190397508 G48A-S274A 0.278870612806562 T166A-G340A 0.278669020876497 N267A-N282A 0.274811958535516 L183A-V188A 0.273185726134247 Y54A-N267A 0.272859951407742 T162A-P329A 0.272495234310664 N47A-E287A 0.272363326413749 L168A-G346A 0.271315642189862 F46A-T280A 0.270560328675089 G50A-G275A 0.270041180320082 I198A-M325A 0.268849767737811 G241A-G343A 0.268713610653504 S18A-G305A 0.268713375815198 S69A-T283A 0.267205769797702 A360A-L365A 0.266014856139496 V188A-S193A 0.264598693238066 L31A-S335A 0.262869452602708 H21A-A306A 0.261519370155555 I49A-A307A 0.261431724382371 I49A-Y54A 0.260210557619092 E287A-V341A 0.260070234493495 L55A-S263A 0.259994024206853 H239A-T283A 0.258905062405923 N47A-S314A 0.25851508103423 N47A-G268A 0.258464588474632 V330A-S335A 0.257790026811374 G48A-N267A 0.252827943860492 L163A-L168A 0.251397850010287 G67A-T280A 0.25080560823389 G275A-T280A 0.250643153427634 T155A-P327A 0.249901363198404 R262A-N267A 0.248294416356348 L66A-G268A 0.246929823347757 G169A-Y339A 0.246782731830562 T42A-T51A 0.246555135910674 S69A-H239A 0.246394780963144 Q20A-G27A 0.246348886515048 L44A-P281A 0.24480345524025 P40A-S274A 0.242823309471834 L172A-G343A 0.242706782691099 L269A-T283A 0.241761733258324 T161A-L337A 0.240879502039636 T162A-L338A 0.240612883699974 Y285A-G340A 0.240531715635438 G48A-N282A 0.239783609604136 N47A-G305A 0.236999516438936 A64A-G305A 0.236630406110618 V368A-G373A 0.236229719319683 Y54A-G305A 0.235728006211726 V368A-V374A 0.235598945005074 G27A-S69A 0.235097045796132 S68A-Y285A 0.233885097320059 V235A-T283A 0.233818414114892 N288A-G340A 0.231925435410005 G275A-N282A 0.231454750639931 G241A-N288A 0.229743114722619 L260A-F265A 0.229595920925291 N267A-S274A 0.229513993050772 L187A-P327A 0.228491115230908 L66A-N267A 0.228300397725979 V316A-I323A 0.228257032760654 S18A-N288A 0.228159623577542 A41A-F309A 0.22751378485176 N47A-L53A 0.227030875560994 Q20A-G286A 0.225608103529576 T155A-I160A 0.224986716574207 T51A-A307A 0.224151781347988 N288A-G304A 0.223762543032401 Y65A-E287A 0.222180192616392 T29A-E287A 0.221892945194286 L187A-S193A 0.221656867566253 G50A-S263A 0.220634524306757 H21A-T51A 0.218352120012646 H21A-T284A 0.217876775785962 S69A-A237A 0.21689870971114 T161A-T166A 0.213842293138931 S170A-P181A 0.212848666152487 L363A-V368A 0.212839056899867 L22A-A306A 0.212084065562141 F46A-S274A 0.211199774141553 N47A-Y65A 0.21106658734407 T51A-I303A 0.210986898703931 L187A-V334A 0.210831853969309 L66A-N282A 0.210040182812649 N47A-G67A 0.209546678150302 T29A-G286A 0.209333878212465 G48A-Y285A 0.209133756172894 V334A-Y339A 0.209123742433761 N47A-L52A 0.209111573722089 T166A-G346A 0.208663150409258 V330A-L336A 0.207116145906925 F265A-S270A 0.206537463875627 G286A-S335A 0.206310449496735 L22A-N288A 0.203558718149006 G241A-S263A 0.203275330737414 V244A-G286A 0.203079468445925 V188A-M331A 0.202593095535988 T29A-G333A 0.202413672841058 A64A-G290A 0.201962736648618 A64A-H239A 0.201778316015138 L45A-S314A 0.201137713099473 H21A-I303A 0.201133269196164 L31A-S69A 0.199515405629645 N267A-Y285A 0.199168063133228 P40A-G275A 0.198688673803106 T366A-I371A 0.198396317280111 I49A-T284A 0.198076816146724 P181A-S335A 0.197565357057572 I157A-T166A 0.197336827473183 S170A-V341A 0.19731239766062 I156A-T161A 0.197056104299605 H21A-T29A 0.196807225342984 G27A-Y65A 0.19677625539424 Y54A-N282A 0.196189915492603 C58A-H242A 0.195261914526688 F194A-M325A 0.19513189722238 V235A-S263A 0.194624068843725 Y285A-V341A 0.194503263143205 V240A-R262A 0.193437172561971 G27A-P281A 0.193115412847479 V167A-I179A 0.193062172318468 F26A-M331A 0.192721165014603 L168A-S345A 0.192482474945837 H242A-H261A 0.192252208595065 G268A-N282A 0.191261604120422 G48A-C58A 0.190462638764361 I158A-L163A 0.189643999091996 S279A-S314A 0.188778909638206 C58A-N267A 0.188700187369953 M25A-E287A 0.188618634228204 L233A-N267A 0.18833708919535 G67A-E238A 0.187948360669226 M25A-N282A 0.187199654164669 L243A-S263A 0.187014564221166 H239A-E287A 0.1863954465685 G185A-S193A 0.186105661663467 L31A-S68A 0.185634817822379 I57A-G259A 0.185487389044053 L187A-G333A 0.185394508977152 S69A-N288A 0.185314990782703 A195A-I326A 0.183844005976843 S159A-P327A 0.18298095097921 F70A-T284A 0.182137673026539 T284A-I342A 0.181774229705938 F26A-L31A 0.181478816602796 H261A-L269A 0.180863501889948 A24A-S68A 0.18047373540596 G241A-I289A 0.180257647881122 Y54A-Y285A 0.180071027412455 V186A-L192A 0.179534538312896 L187A-G332A 0.179497747527103 C58A-S263A 0.179455851768284 A232A-T284A 0.179374419712761 G259A-N267A 0.179136006190251 Y65A-G268A 0.178987240023455 P329A-L337A 0.178895315530463 Y285A-S335A 0.178836748645146 L163A-V341A 0.178579134377598 G48A-T284A 0.178434714114683 G67A-L269A 0.178404670161475 L44A-G304A 0.17837492274679 Y65A-A266A 0.178182544035993 Y190A-P329A 0.178024840799142 L53A-G305A 0.177915546632299 I364A-I369A 0.17762239863685 N288A-G346A 0.177582739393078 N47A-G275A 0.177413593460386 V32A-I323A 0.176843465656735 N267A-G275A 0.176474046757095 N47A-P281A 0.175994760413611 G67A-Y339A 0.175798785862564 V32A-P40A 0.175119828666675 T162A-V167A 0.175081852770326 S68A-L336A 0.174751851888588 G333A-G343A 0.17425535176735 T161A-G340A 0.173325920361404 G50A-L66A 0.173293490668645 A71A-I236A 0.172612727201482 G50A-I311A 0.172554749759136 G169A-A344A 0.172225241956211 V32A-F70A 0.172109415235754 G286A-A344A 0.171063596068672 Y54A-H239A 0.17021127967473 L243A-H261A 0.169996207943814 A24A-I342A 0.169748194608473 Y285A-G346A 0.169675333108418 L187A-M196A 0.168779748614474 A71A-A232A 0.168233238926183 L44A-S69A 0.168021073965004 G268A-S279A 0.16777383773726 S69A-Y339A 0.16733587174986 G241A-A344A 0.167229921154705 T42A-L319A 0.166788264468435 T162A-A344A 0.166781205051486 S263A-Y285A 0.166289255733397 L269A-S274A 0.166108764455297 V43A-A306A 0.166099021538248 G48A-I303A 0.165921115998802 T29A-P40A 0.165867059481829 I289A-V341A 0.165801058860636 L269A-N282A 0.165125582418144 S159A-V167A 0.165037084201404 I236A-H261A 0.164929418689931 A232A-G275A 0.164268202323748 T42A-K318A 0.163323165923038 V330A-Y339A 0.163132376479275 G197A-P327A 0.163106283853406 M25A-G305A 0.163075430470689 G286A-A306A 0.162962882215354 A191A-I323A 0.162446174474383 V235A-V240A 0.162191500996393 F56A-G259A 0.162187275352208 L163A-G340A 0.161991768921689 A71A-G286A 0.161687098473422 A28A-G290A 0.161636831452177 G27A-A71A 0.161636831452177 Y65A-S263A 0.16103736748415 L31A-G332A 0.160815316161022 F46A-T283A 0.16072495447617 S170A-Y339A 0.160685996643155 A28A-T42A 0.160134293907494 G27A-M325A 0.159980000104095 G67A-M264A 0.159888325785277 Y285A-Y339A 0.159276436485107 H242A-G290A 0.159007513884995 Y65A-H239A 0.156808173500089 V43A-S69A 0.156743538693526 G290A-G340A 0.156639715326331 T166A-I182A 0.156326863895768 T166A-P181A 0.156248884027823 V244A-G259A 0.156020330755631 H21A-F26A 0.155860486305777 F56A-Y65A 0.155499270228844 T51A-A64A 0.155486896670245 G50A-S279A 0.154963715290437 S69A-M331A 0.154461716158341 V43A-S314A 0.154014694723057 H239A-G259A 0.153926724565395 C58A-L269A 0.153908607617288 L53A-T271A 0.153817949263475 V43A-L66A 0.153273736411924 Y54A-H261A 0.152902386760475 L52A-I57A 0.15235869377897 A24A-G185A 0.15214217631769 F70A-S279A 0.151829361242394 Y65A-Y339A 0.151775641572386 N47A-A307A 0.151604387719416 H239A-A266A 0.15098522283389 L45A-N282A 0.150838140838295 F23A-E287A 0.150728353447689 I182A-V188A 0.150501146150406 G50A-A306A 0.150264111757431 A231A-T271A 0.150131423565679 G48A-A306A 0.149608112672891 S68A-A232A 0.149215990970674 I308A-L313A 0.148677286140828 G27A-G48A 0.148349873401934 R262A-S270A 0.148226013303887 A164A-G169A 0.147768787281431 G189A-G197A 0.147754879638333 G67A-S274A 0.147688041360861 V171A-Y339A 0.147460162787128 H261A-A266A 0.147284552815904 A64A-R262A 0.146736662616809 F23A-V30A 0.146074284207444 A28A-I326A 0.145791988222969 L22A-G67A 0.145426799412473 I289A-I347A 0.144485668175344 T29A-I311A 0.144060506496436 N47A-S69A 0.143765214792665 A232A-M264A 0.143687114145045 V171A-I342A 0.14363321109611 G290A-A344A 0.143563177588478 L52A-G268A 0.14334884187474 V167A-V334A 0.143255207331905 Y190A-I323A 0.143060649676905 E238A-E287A 0.14269345152919 E238A-I289A 0.142454895870425 S170A-I347A 0.142388568459348 I57A-Y65A 0.142370058815871 L328A-G333A 0.142012110082654 Y54A-I273A 0.141534786083289 I158A-M331A 0.141494588079849 Y65A-E238A 0.141434652413302 T42A-T283A 0.141399365645237 I49A-G304A 0.140875455274291 T51A-T280A 0.140850249097199 L363A-I372A 0.140610767535351 L22A-S68A 0.140460025234887 G27A-L187A 0.139735012691516 A232A-V272A 0.139697141926366 T155A-P329A 0.139644370850543 I347A-L370A 0.139508307317328 S263A-P281A 0.139445007072632 V43A-S279A 0.139161812061605 G67A-G241A 0.139157444077355 A164A-I342A 0.138961365483111 Q20A-A64A 0.138214927038066 D200A-A322A 0.137829182499684 M25A-I323A 0.137693428933185 Q20A-I303A 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