[Wed Aug 24 23:56:57 2016] >Input file: TM2LHFATG.pdb >TM segments: A7-13_A40-46_A57-63_A73-79_A96-103_A116-126_A137-150_A161-175 MAIDEN score = 41.2227 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 ----------- ---------------- S79A-T98A 10 L8A-I44A 10 Y119A-N147A 6.29771282254336 N75A-V102A 2.4161038631591 Y141A-F171A 2.32787198971613 L8A-R45A 1.83114238954488 I137A-A175A 1.55597945976903 T9A-Y172A 1.2432295031512 W42A-I62A 1.12315429263739 W10A-L173A 1.0584587350757 L77A-L99A 1.05342150611435 L77A-G100A 0.934725190523691 G122A-L144A 0.928290770710431 A97A-L123A 0.925744916062083 L76A-L101A 0.883759580156385 L144A-Q170A 0.872711960246392 L123A-L144A 0.851350517906847 I44A-E60A 0.841901568757677 L8A-W42A 0.84120853889319 A120A-T146A 0.805414806617973 L77A-L101A 0.750826480290673 T41A-I62A 0.698630656141371 Q124A-L144A 0.691527349639578 L99A-Y119A 0.690017536101664 A57A-L76A 0.672727002056747 T13A-F171A 0.659296209971466 R145A-S168A 0.643042334617533 R142A-S169A 0.639151398890531 V102A-Y119A 0.634879986922612 E12A-L173A 0.633937938314192 V102A-D116A 0.624922265058721 G139A-L173A 0.598123548908168 W10A-F171A 0.57543974577304 L101A-V117A 0.550452212582487 T13A-T41A 0.540204637065354 Y119A-A148A 0.539016475936384 L76A-V102A 0.529122979126553 G11A-R142A 0.525166803353255 L99A-A121A 0.521911561847027 T58A-L77A 0.521384712762279 Y59A-L77A 0.508823664522607 I62A-Q73A 0.506487814675022 T9A-W42A 0.495560446929384 W10A-G40A 0.478842146224751 R145A-H166A 0.471957877980618 W10A-T41A 0.470096040022023 W42A-S63A 0.466862548718095 Q74A-Y119A 0.461255181294685 T9A-L173A 0.457392740838426 I44A-Y59A 0.454955411649419 G126A-Y172A 0.445791773543021 G122A-R142A 0.440545196758578 K103A-N147A 0.433462578622853 L144A-S168A 0.432434847839735 S79A-G96A 0.421969265340477 V102A-A120A 0.421719993868737 A121A-Y143A 0.410652252008116 K103A-G118A 0.409721219662323 Q73A-V102A 0.407440099798762 T98A-Q124A 0.407435626186806 A57A-A97A 0.379221041751989 I62A-N75A 0.370468888091494 A46A-T58A 0.362513331386433 L99A-R145A 0.361147905907966 I137A-L173A 0.359894620828401 Y141A-S169A 0.358422121899335 L144A-S167A 0.356869441870119 L123A-R145A 0.354340251947738 T58A-L76A 0.353483512117947 W42A-N61A 0.348580766188415 A121A-L144A 0.346647752176375 A121A-T146A 0.344741704217245 E60A-G100A 0.343861941220511 L77A-A120A 0.339055921854238 Q124A-G140A 0.338272054629181 V117A-N147A 0.331243956180001 Y119A-R145A 0.330950047875596 Y141A-L173A 0.329277927741725 G140A-A175A 0.319543653049467 L8A-T58A 0.318863748330402 G11A-F171A 0.318259599103333 T13A-S169A 0.317435546794308 A120A-L144A 0.317009395738747 G40A-G174A 0.312271450913141 S79A-L99A 0.308949713308239 T98A-L144A 0.307255469771174 W10A-G43A 0.30715355546914 Q124A-Y172A 0.305009504203779 L123A-Y143A 0.299691474518649 G43A-G78A 0.298761733704559 G7A-G139A 0.298185670899485 A120A-S168A 0.297952974872209 L8A-A46A 0.294297420561917 Q124A-E138A 0.29174665587923 G140A-S169A 0.291043569851497 A120A-S167A 0.290486921956104 L123A-G140A 0.289699091685995 L8A-G139A 0.289391050872913 L144A-S169A 0.288911877581969 T98A-A120A 0.286532918846069 T98A-L123A 0.284760671535761 I44A-A57A 0.280025529771843 L99A-G122A 0.280017909218101 L77A-G118A 0.277269488140842 E138A-Y172A 0.27687550002956 T9A-A175A 0.275734989941594 Y59A-L76A 0.27442680923552 E12A-N61A 0.273894873165022 G7A-Y172A 0.273061281783328 V102A-V117A 0.271239529666166 R45A-E60A 0.264664432785703 G11A-G126A 0.256941641154497 Y59A-Q74A 0.255366621576141 G96A-L144A 0.252770443520989 G7A-W42A 0.251701738813714 G100A-A121A 0.250755544308874 Y59A-S79A 0.250478442485746 Q73A-G118A 0.248692557209558 Q124A-S167A 0.247522237665064 T9A-T98A 0.246809939577385 G11A-L144A 0.245718405207705 T9A-L77A 0.241253712056002 L77A-V102A 0.238109286903114 G122A-N147A 0.236364139154808 T9A-Q124A 0.235417213263453 G140A-L173A 0.23017526701606 G7A-I44A 0.222124749995086 T13A-L173A 0.221413908693831 G11A-L173A 0.220242808828977 G11A-N61A 0.220229840125043 T41A-Q73A 0.220158070699688 G78A-Y143A 0.217272438213385 W42A-E60A 0.21714505090159 T9A-G126A 0.212120625049612 A57A-L77A 0.211136580815614 G11A-I44A 0.209962763653108 T58A-Q124A 0.209239265449973 A148A-S167A 0.207617892073001 G7A-A46A 0.205087163003746 W10A-Y172A 0.204564534787163 L77A-T98A 0.201640606228445 R45A-N75A 0.200300111592116 G43A-I62A 0.200190975458562 S79A-Q124A 0.200067605120152 A46A-E60A 0.199383274312086 L99A-A120A 0.195059180933227 T58A-S79A 0.192816681037233 W10A-Y59A 0.191314867386861 E60A-V102A 0.189791296735344 L8A-G43A 0.189574102218062 G43A-Q73A 0.188618149147521 G78A-L144A 0.188127363963838 Y141A-S167A 0.187666640125283 T58A-A97A 0.187214373894476 G43A-N61A 0.183588681099953 E60A-G78A 0.183042541141186 G7A-I137A 0.182636847495028 Y59A-G174A 0.181859916105669 N75A-L144A 0.181703102458804 T13A-G140A 0.177761914143851 R145A-S167A 0.177426240150918 L101A-N147A 0.175863015250855 S79A-L123A 0.175663253896795 G122A-L165A 0.175193428152067 W10A-Y141A 0.172583167819577 G11A-W42A 0.17216349329924 A120A-S149A 0.170511493206314 G40A-Y141A 0.170424462885699 G43A-A175A 0.170005283330706 G122A-Y172A 0.169928682471986 L101A-D116A 0.167292349130946 I62A-Q74A 0.166594724291473 G96A-Y172A 0.166294914984517 T98A-A121A 0.166123212225985 A121A-S149A 0.166016927671595 G100A-Y143A 0.164363259845169 T9A-I62A 0.164255092997609 G7A-L173A 0.163561731665062 Y59A-K103A 0.162799324438144 L101A-T146A 0.162138907971053 G126A-G174A 0.162013609876897 A97A-A121A 0.15891989034504 L8A-E138A 0.158250315219403 G7A-R45A 0.15727721886748 G139A-Y172A 0.156691088523113 G43A-L173A 0.156160017570739 S79A-Y172A 0.154598897445076 Y59A-Y172A 0.152061416552839 L8A-A175A 0.151220641840074 V102A-A148A 0.150841677688979 A57A-R142A 0.150201494582594 S79A-Y141A 0.149286451313814 Q74A-L101A 0.149013920046043 G11A-G78A 0.148216102619976 E12A-R142A 0.147671161088899 V117A-S149A 0.147313238771525 N75A-D116A 0.146701782271283 R142A-F171A 0.146664277714389 L8A-T41A 0.145799490511246 G126A-Q170A 0.144365204077984 A57A-V102A 0.14305593549652 D116A-N147A 0.141235338996236 L76A-K103A 0.140954636528177 R45A-Q74A 0.139348930342191 N147A-S167A 0.139292755704308 Y143A-H166A 0.139055984019873 G40A-L173A 0.138281016187021 E60A-S79A 0.137589566281549 G96A-A121A 0.137001571844787 N75A-N147A 0.136960995911984 E12A-W42A 0.136229442667771 S79A-E138A 0.133814379508496 G40A-G140A 0.131610335006052 Q74A-A120A 0.13139127537198 N75A-Y119A 0.131338815797463 G11A-A175A 0.130486533514418 T9A-A125A 0.129806611823239 Y143A-L173A 0.129737673990911 T98A-N147A 0.127967335373448 Y119A-Y143A 0.127715609207038 R45A-N61A 0.12719467619686 G7A-E60A 0.126945769184109 G11A-E138A 0.126248654803151 G40A-G139A 0.125728286137127 Y59A-G118A 0.125009158969402 S63A-Q170A 0.123462089478139 S79A-Q170A 0.122436988805357 Y119A-S149A 0.122211131045376 T9A-G78A 0.121968425761608 G11A-Q124A 0.120885914256389 W42A-Y172A 0.119934912660057 D116A-T146A 0.118726007592731 A120A-R142A 0.117808721264983 L123A-L165A 0.116813221664159 W42A-A175A 0.116225145580131 A125A-G174A 0.115977391863511 R145A-Q170A 0.115466409380528 L77A-L123A 0.11477587656527 W10A-N61A 0.114767967516446 T9A-S63A 0.112988835068458 A57A-A121A 0.112947604247415 E12A-E138A 0.112289979206296 A97A-Y141A 0.111658220599666 G43A-V102A 0.111542818609106 G40A-E60A 0.109702427511436 T41A-Q74A 0.1094235275781 G126A-F171A 0.106602672185121 A57A-L101A 0.106012274022947 T58A-R142A 0.105657558539363 T41A-E60A 0.105594108498974 L77A-A121A 0.105502036179473 L8A-L77A 0.104805555589249 A97A-S167A 0.104503742568128 G96A-R142A 0.103823313765544 V117A-T150A 0.103293686237782 A57A-G96A 0.103189240595027 Y59A-A120A 0.102667421822367 G96A-G140A 0.10097386533441 T41A-G174A 0.10087705122179 A125A-S167A 0.100706444393961 G11A-A125A 0.10058235271491 G11A-Y172A 0.100430150199692 Q124A-F171A 0.0989867960955095 E12A-G43A 0.0988732994556409 G100A-R145A 0.0986874948370384 W10A-E138A 0.0981043119906326 A46A-L76A 0.0975482820501505 A46A-L173A 0.0975066798393991 E12A-I62A 0.0974114593272097 V102A-R145A 0.0962339103317724 R45A-Y172A 0.0951755735132505 W10A-I137A 0.0951370509312284 G139A-Q170A 0.0948637185901089 L8A-L76A 0.0947297625144685 T41A-R142A 0.093909358793733 L8A-I62A 0.0938017842234385 L77A-V117A 0.0931011854681478 T58A-G174A 0.0930289574693242 G40A-R142A 0.0910280656062872 G118A-T146A 0.0910166609255163 A46A-L99A 0.0907844172646275 G78A-R145A 0.0906815295068388 A57A-A175A 0.0887456653940508 A148A-L165A 0.0880193864404595 Y143A-S167A 0.08799832539313 G122A-F171A 0.0876627609575698 I44A-I137A 0.0875556940528752 G139A-F171A 0.0875242633893105 G118A-R145A 0.0874470665292506 T58A-G140A 0.0868307497218916 A148A-S168A 0.0863670364504747 T41A-S169A 0.0860126504634016 G43A-G139A 0.0860076801316891 L99A-V117A 0.0855593978196385 N75A-R145A 0.0851996189733004 T41A-S168A 0.0845563731357948 T13A-S167A 0.0840776776699182 T98A-Y172A 0.0834049923179343 T98A-S167A 0.0825519947527095 T98A-Q170A 0.0825478551277374 G122A-A148A 0.0821077331931588 T98A-S168A 0.0819087158457984 A57A-Q124A 0.0811307923988898 G11A-S168A 0.0807781790523077 A121A-S169A 0.0787074409905473 G122A-H166A 0.0781935388304973 A46A-G174A 0.0778254611417371 E12A-F171A 0.0764203979268701 N61A-G100A 0.0761097083643296 S149A-H166A 0.0752580130831127 G126A-R142A 0.0752392394526504 E12A-Y143A 0.0742118823075999 T9A-G140A 0.0741623528869297 A97A-F171A 0.0741010376035609 R45A-Q124A 0.0739212287911912 G126A-A175A 0.0737305048987045 G122A-G140A 0.0731453537847092 V102A-G122A 0.0731200062579807 L76A-R145A 0.0728228907035011 G11A-G122A 0.0725483719631531 S149A-S167A 0.0724494713583752 G96A-G139A 0.0715661233904734 Y143A-Y172A 0.0713932963604342 T146A-Q170A 0.0708235503241204 G78A-G118A 0.0703384703309609 T41A-E138A 0.0701280330166965 T58A-A121A 0.0698178536672973 G40A-N61A 0.069643221457051 Q73A-G100A 0.0683588972617897 T58A-V102A 0.068128843762877 G96A-A125A 0.067726828546796 I44A-Q74A 0.0676765338938266 G43A-E138A 0.06738347220378 I44A-S63A 0.0670610594944327 I44A-G78A 0.0666117644124489 Q124A-G174A 0.0665499522509405 I44A-E138A 0.0660867815950912 T58A-L173A 0.0648166202723285 T58A-Y143A 0.0648163593664846 E12A-E60A 0.0645106902076853 G100A-N147A 0.0643762386237927 A57A-A120A 0.0638832976686206 L123A-T146A 0.0635947592881324 L101A-A120A 0.0627872240772263 R45A-T98A 0.0625083741844561 R45A-G139A 0.0623700223038637 N75A-L101A 0.0622495961438245 A121A-L165A 0.0622472663754139 R142A-A175A 0.0616411759943977 G118A-L144A 0.060702683834198 L77A-G96A 0.0606060146382887 L77A-R145A 0.0594023277208731 Q73A-V117A 0.0591293632882433 R45A-L173A 0.0586977166882674 W10A-I62A 0.0582385175463944 G96A-A120A 0.0579477255920757 N75A-G122A 0.0578044847889148 L76A-A121A 0.0570863385010085 T9A-S79A 0.0567827576674507 G100A-L123A 0.0557626844649248 G126A-E138A 0.0554247429474991 L99A-A148A 0.0548718705443849 T58A-S63A 0.0547380397747759 G11A-I62A 0.0546616847458035 S79A-G126A 0.0535979553951319 T58A-N75A 0.0529235412780693 A121A-Q170A 0.0523758657732829 N75A-A121A 0.0520559116318089 L76A-V117A 0.0516568737544265 T9A-Y143A 0.0516134656892042 A125A-Q170A 0.0513014359249457 T58A-K103A 0.0512827964149165 V117A-A148A 0.0485415492554577 N61A-L76A 0.0484376261847062 T41A-L144A 0.0481945031951003 I44A-G174A 0.0471866780822499 A57A-L144A 0.0469404987005644 L99A-L144A 0.0464834720816159 W42A-G78A 0.0461825301063719 W42A-F171A 0.045698326206308 R142A-S168A 0.0455426453525027 G11A-S79A 0.045037101562408 E12A-L144A 0.0449171085069704 D164A-S169A 0.0448766108292369 W42A-E138A 0.0447294916791844 A121A-H166A 0.0446857223054257 A46A-A175A 0.0439825531915581 L101A-G122A 0.043952541692041 G40A-S63A 0.0438805819229593 T146A-S169A 0.0431548623216278 T58A-L101A 0.0424990316648515 R142A-S167A 0.04086528066146 T13A-Q124A 0.0405266042133163 W10A-L77A 0.0397586715064495 A125A-S169A 0.0397549963369084 G11A-Y143A 0.0384222661609726 A57A-L123A 0.0380651334900286 T98A-F171A 0.0379026647920044 Q74A-T146A 0.0377586515558636 V117A-R145A 0.0377546094828558 T41A-L77A 0.0363353797987189 D116A-S149A 0.0356306849354677 A57A-G174A 0.0347737738847593 W10A-G78A 0.0347388117827514 T58A-R145A 0.0335546721169493 A125A-G140A 0.0334389684673173 G40A-S169A 0.0330306704142109 A120A-T150A 0.0328422977326721 N61A-G78A 0.0322687198383234 G43A-Q170A 0.0321592700175568 G11A-T58A 0.0320637025992097 S79A-L101A 0.0300526925956612 G100A-R142A 0.0300437397242224 R45A-G100A 0.0300276360149025 L76A-D116A 0.0292920935304142 T9A-G40A 0.0290085396956934 W42A-R142A 0.0282048643584689 W42A-G140A 0.0281836173939189 Y143A-F171A 0.0280160327527845 T58A-L144A 0.0279669978517632 T9A-E60A 0.0278071109569568 L8A-G140A 0.0268411550322698 G43A-F171A 0.0263838221313297 E12A-Y172A 0.0263141724283642 G7A-T41A 0.0247923184716752 Y119A-H166A 0.0246358584663195 W10A-G174A 0.0245607194509878 W10A-E60A 0.0245230627943571 A148A-H166A 0.0243610940039813 T41A-A120A 0.0241760262896198 Q74A-G118A 0.0237192484999631 R45A-I137A 0.0223340317404959 V102A-T146A 0.0221209667130244 I44A-R142A 0.0221197803104806 A120A-H166A 0.0219893844009293 G11A-I137A 0.0219435542872439 A57A-G122A 0.0216085229406291 G122A-Y143A 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