[Wed Aug 24 17:30:36 2016] >Input file: TM1WP1ATD.pdb >TM segments: A82-98_A113-133_A293-309_A322-340 MAIDEN score = 31.2553 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 ----------- ---------------- A306A-W324A 10 N305A-W324A 10 I300A-I330A 7.17946059292029 I88A-T121A 2.23841517515548 P298A-L332A 1.34572344671579 L126A-I300A 1.19561220489423 W124A-L302A 1.13812320143612 R131A-A295A 1.07866092869958 N305A-L325A 1.03918713465014 G92A-V117A 0.880317143451464 A304A-W324A 0.849497106132278 I88A-L119A 0.805822196010357 L84A-E125A 0.740307191788061 F129A-F297A 0.731437950734552 L302A-P328A 0.715048511640859 F297A-L332A 0.687814195548837 L84A-D127A 0.687742468888342 D83A-L132A 0.673934846593289 L84A-L132A 0.664425444970224 V90A-L119A 0.647211005239328 F85A-W124A 0.636274194038133 F296A-P333A 0.584416131041969 E125A-S301A 0.576624207383647 L128A-S299A 0.542760304414685 L126A-S299A 0.526307010111524 A295A-L340A 0.514047113030053 L128A-I300A 0.51148326840018 L302A-F326A 0.511374937542809 R87A-G120A 0.507574802387345 R293A-L340A 0.501940698270189 T303A-F326A 0.49469309784419 V90A-G120A 0.444347192697022 Q114A-M309A 0.438858659581246 F296A-L340A 0.437712848902891 F296A-L332A 0.428415601303628 A306A-L325A 0.420774922729565 I300A-P328A 0.417195450197537 S299A-S329A 0.412344980113421 G92A-Y115A 0.407993797768469 F129A-S299A 0.407573267237587 S299A-L332A 0.402188357462663 S301A-I330A 0.395813076591459 E125A-P298A 0.392650447431736 F297A-P333A 0.391128731062334 G120A-T303A 0.385691646327732 L302A-S329A 0.375558409222366 L84A-R133A 0.357863729363527 P298A-N331A 0.355848235938032 E125A-Q327A 0.337053369309876 P86A-N305A 0.334587181781758 T121A-L302A 0.332134778975818 D83A-R131A 0.330868071485057 D127A-I300A 0.326602987132683 M309A-G322A 0.317324337783702 T303A-L325A 0.309426039001863 L126A-L302A 0.308547388531515 A123A-L302A 0.303196960943594 L84A-L126A 0.29816034659028 T122A-A304A 0.294363242584185 F129A-P298A 0.294162305104595 W124A-T303A 0.289208946538369 R87A-T122A 0.287867941838944 G92A-A306A 0.284083436142153 A123A-S299A 0.283711492330306 V90A-Y115A 0.261362163610978 F129A-A294A 0.256918321092649 S93A-G307A 0.250799279824105 Q114A-S323A 0.249126183205983 S299A-I330A 0.242821743179027 G92A-N305A 0.242395952742681 G120A-A306A 0.242040500186619 F296A-I334A 0.24000036458785 L119A-A304A 0.238800614787783 P298A-I330A 0.238614213960583 G130A-F296A 0.236683990093228 N305A-P328A 0.234856679051074 P298A-L340A 0.231690588412703 D91A-G120A 0.228776479773694 E125A-R131A 0.227035078148055 D91A-G116A 0.225824529840798 I88A-G120A 0.225681032367936 T308A-L325A 0.222980797742135 I88A-T122A 0.218888558887485 T118A-M309A 0.21518544481544 V90A-M309A 0.214407149268369 G120A-S323A 0.213247030590895 A123A-T303A 0.2122991610558 A304A-S329A 0.209502323103258 T122A-L302A 0.209281151307749 F85A-A123A 0.208554647690893 G94A-S113A 0.207766426246106 A295A-P333A 0.205624530696259 R87A-N305A 0.204153072556749 R96A-Y115A 0.204104467908036 S93A-V117A 0.201120699726907 D91A-N305A 0.195811305982552 F85A-D127A 0.193995788272179 V117A-M309A 0.189266053090942 E125A-A295A 0.189176699622582 G92A-T121A 0.187754962488582 N305A-Q327A 0.187104533367804 L119A-G307A 0.186802364080606 G89A-T121A 0.186796815384779 E125A-A294A 0.184096986823675 A304A-L325A 0.182612917496103 L128A-S329A 0.179298060554951 L119A-A306A 0.170444428369253 R87A-E125A 0.169875246695005 L126A-R131A 0.168863627030227 R87A-D127A 0.167554395938926 D127A-R133A 0.167242084938425 D127A-A295A 0.167010480325975 T121A-W324A 0.164597425780858 A82A-G89A 0.164322080508914 P86A-T122A 0.164038384484563 A294A-G338A 0.163650053934977 R293A-S299A 0.162482818102459 G92A-G120A 0.161932866721603 D91A-T303A 0.161897653332052 L132A-S301A 0.16143802017132 G89A-A306A 0.161058419652462 G116A-M309A 0.157835984427702 F129A-F296A 0.152873178651778 R293A-S339A 0.150726382728266 R133A-A295A 0.148751156050163 I88A-E125A 0.14718693346435 I88A-A306A 0.145029781578173 E125A-I300A 0.144667891199141 T95A-T308A 0.144040764067809 W124A-N305A 0.142495276347361 D91A-A304A 0.141232189019101 D91A-W324A 0.140151305559152 P86A-L119A 0.1388504149089 E125A-S299A 0.13676558563252 I88A-L325A 0.135292211407644 M309A-S323A 0.13364834039537 T95A-T118A 0.132362222528656 G89A-A304A 0.132328549771637 G120A-T308A 0.129977658659248 E125A-N331A 0.129607314542729 L126A-L332A 0.129253276133129 D83A-T121A 0.128777705213771 T121A-G307A 0.127760418266333 G89A-G307A 0.127506682724938 Y115A-S323A 0.127058046614202 R96A-Q114A 0.123771470963628 T122A-W324A 0.119369397590789 A304A-S323A 0.118488388148835 A82A-W124A 0.11816169250346 L126A-Q327A 0.117722788756733 G89A-G116A 0.116357228194672 A306A-G322A 0.115770651421896 L132A-S299A 0.115432535989578 L128A-A295A 0.111913692498622 S93A-A304A 0.110428116231532 F296A-G338A 0.108668479667426 S301A-L332A 0.10709314282687 V90A-G307A 0.106489242858331 T308A-S323A 0.105444427141515 P86A-W124A 0.104847921943456 S93A-L119A 0.10145556037629 D83A-A123A 0.101334512579915 T122A-S329A 0.101322762738537 G94A-T118A 0.100943520172631 F85A-G130A 0.0997416357221868 A295A-I334A 0.0988155333966709 A82A-L126A 0.0983478020941093 A304A-F326A 0.0956213325107331 L84A-A294A 0.0951580383283197 G120A-Q327A 0.0946394094703944 G94A-T308A 0.094228455061331 A123A-I330A 0.0941105723541988 L126A-A304A 0.0932020998723249 G120A-P328A 0.0931763367372431 R293A-N331A 0.0931718127003962 G116A-L325A 0.0924937919721254 A306A-Q327A 0.0922170331978522 S93A-T122A 0.091377120216769 L119A-G322A 0.0909599810988846 D83A-E125A 0.0903035499930942 I334A-S339A 0.0901285471634283 A294A-S339A 0.0894486777566676 L332A-A337A 0.0893687697712906 A82A-E125A 0.0890528954749774 G89A-T303A 0.0887374234804233 G94A-G307A 0.088700685246871 W124A-I330A 0.0882983841559923 D127A-F297A 0.0878570485978396 T121A-S329A 0.0850923323401194 R293A-G338A 0.085050474952145 S299A-Q327A 0.0849531148893035 S93A-T121A 0.0846572648284902 T303A-S323A 0.0833810098885405 G130A-P298A 0.0823658761272599 R131A-L340A 0.0816009455989807 F335A-L340A 0.0813438743778936 L128A-P328A 0.0809744998689137 I88A-A304A 0.0807222849842582 G89A-A123A 0.0802777220455195 G307A-L325A 0.0788864132180906 S93A-A306A 0.0787966676111373 G94A-S323A 0.0782521984865963 D127A-P328A 0.0777417900548913 P86A-D127A 0.0774147322972825 V90A-V117A 0.0770270473248207 N331A-T336A 0.074315944308164 M309A-L325A 0.0741669809780028 A304A-I330A 0.0740637760232684 L119A-L302A 0.073174527275782 L132A-R293A 0.0720974917807149 L126A-F296A 0.0706711386199004 F85A-T303A 0.0704860004063406 G116A-T122A 0.0696876099128323 V90A-T308A 0.0691015508373985 A123A-N331A 0.0687666180351023 L119A-W324A 0.0687564419475231 L126A-A295A 0.0663380042529402 F85A-I300A 0.0660607310526998 A123A-I300A 0.0652246212260765 P333A-G338A 0.0649639760175389 A123A-R131A 0.0645616371644368 F85A-A304A 0.0637538834023945 P86A-A306A 0.0637393643528945 N305A-G322A 0.0635871877188219 A294A-N331A 0.0629896091560846 L119A-Q327A 0.0625287266651684 R293A-P333A 0.0613278436883875 I88A-G307A 0.0611844166024236 T308A-F326A 0.0606958657394923 G130A-A294A 0.0599234096060028 F85A-R131A 0.0593499742479837 G92A-S113A 0.058477357568878 P86A-P328A 0.0582319386312404 E125A-A304A 0.0569595204212554 G92A-S323A 0.0562206059542631 S93A-T118A 0.0536031287581751 D83A-S301A 0.0526423536820565 S93A-G120A 0.0524240007982941 A123A-N305A 0.0523288772563633 L302A-W324A 0.0492942962143577 W124A-P328A 0.0477772970469114 P86A-F326A 0.0477272057719551 A82A-A123A 0.0475226453127608 R293A-L332A 0.0472988432370038 L128A-F297A 0.0469501740533396 R293A-P298A 0.0461272730410336 T122A-I330A 0.045651877888722 V90A-T121A 0.0452904156123096 T118A-S323A 0.0451406092515536 G92A-A304A 0.0449648252715265 D91A-S323A 0.0442218989884912 D127A-S329A 0.0441819286200472 G92A-G322A 0.0439991815105376 R87A-T118A 0.0437877910280315 G116A-N305A 0.0423346974593959 W124A-F129A 0.0415825439070688 T118A-Q327A 0.0405005623585759 V90A-G322A 0.0398984307299586 A295A-I300A 0.0378838509533157 T121A-T303A 0.0373155299363361 V90A-A123A 0.0366740109563564 L84A-S301A 0.0365985056408678 F297A-T336A 0.0362963795686027 G130A-S301A 0.0361431022495671 N305A-F326A 0.0346236867417602 A295A-I330A 0.034086564111413 G120A-G322A 0.0338342325740815 L84A-T122A 0.033597632614746 A294A-I300A 0.0329119438523398 A123A-L325A 0.0323948703982131 D83A-T122A 0.0315507866796763 R131A-P298A 0.0298717710523395 P298A-P328A 0.0291053088866491 R87A-W124A 0.0280594581642739 A123A-F326A 0.0268352852381177 D91A-A123A 0.0256711064009418 A295A-A337A 0.0255968066822163 I300A-L332A 0.0254339066282601 D91A-L325A 0.0254025953248165 V117A-T308A 0.0247993125479464 L84A-T121A 0.0244053627451217 T118A-A123A 0.023407825737372 A294A-I334A 0.0232884042643269 T122A-I300A 0.0231359930181334 N305A-S323A 0.0224970187869138 T121A-A304A 0.022200436335404 V90A-T118A 0.0221225287790308 G120A-E125A 0.021349908022942 T303A-I330A 0.0187210597848058 D127A-I330A 0.0186284401857364 S93A-N305A 0.0184133298904565 A295A-S301A 0.017947483122577 A123A-P298A 0.0173394258219064 I88A-V117A 0.0163168292392328 L126A-F297A 0.0159174841051399 A304A-G322A 0.0158521878677327 Y115A-A306A 0.01562534534024 L119A-T308A 0.0153547224770048 P86A-R133A 0.0148096881143229 V117A-L325A 0.0144908727846627 G94A-L119A 0.0143447430037207 G89A-W124A 0.0141953876863754 I300A-P333A 0.0124418432864857 T118A-F326A 0.012074978203392 F85A-S301A 0.0106618475954821 A82A-G130A 0.00990287797270062 A295A-F335A 0.00949190749149276 T95A-M309A 0.00921553953951282 D127A-T303A 0.00852863835728579 R131A-N331A 0.0081484849330371 L84A-L302A 0.00795552357179297 G94A-M309A 0.00785323797239912 V117A-A304A 0.00474608357074757 E125A-F297A 0.0046876932213919 D91A-L119A 0.00465553308968047 I300A-N331A 0.00434161354439988 G130A-N331A 0.00326482140714024 G92A-T122A 0.00239290959222238 V90A-A304A 0.00210351781662643 G116A-T121A 0.00203753875668733 P86A-T303A 0.00121302058213657 S93A-S323A 0.000976170669857002 A304A-M309A 0.000806073037875166 L332A-G338A 0.000428998447270401 M309A-F326A 3.33262166787307e-05 L132A-A294A -0.00034864366095233 D83A-G89A -0.000448619488543467 D83A-G130A -0.000549502413441649 T308A-G322A -0.000820465043258167 A306A-F326A -0.000831266142688136 T118A-T308A -0.00140303686800181 G120A-L126A -0.00210561919190178 F129A-P333A -0.00308852688397554 L84A-T303A -0.00334176546137055 R131A-R293A -0.00357975979416114 G89A-G120A -0.0042734455244724 G89A-T308A -0.00434135543955172 V90A-T303A -0.00624873936627379 P86A-I300A -0.00650804961594709 D91A-G322A -0.00684370291491398 L132A-F297A -0.00847870902510728 L126A-T303A -0.00852175188029847 A82A-T121A -0.00941238386960652 F129A-S301A -0.0100814555265418 G307A-W324A -0.0102474340826397 T122A-P328A -0.0112425805468588 L119A-W124A -0.0121387625152556 R96A-M309A -0.012211035260453 S299A-F335A -0.0123013305504245 G120A-S301A -0.013068864000241 G89A-N305A -0.0131607533972913 E125A-R133A -0.0149334163856894 A294A-I330A -0.0150674907134394 L128A-A294A -0.0152259664272232 W124A-R131A -0.0159859018344686 D127A-N331A -0.0167461554182111 Y115A-T308A -0.0177817765375323 W124A-P298A -0.0195975008883056 F129A-S329A -0.0204082038568484 S299A-I334A -0.0205636622535628 T122A-Q327A -0.0206789110641306 R96A-G116A -0.0207594464766576 Y115A-N305A -0.0210215236615032 I88A-L126A -0.0218276477993973 T303A-N331A -0.0227821941074522 A82A-I88A -0.0228103103056236 A295A-G338A -0.0236245523607099 A123A-L128A -0.0239945922337448 G307A-F326A -0.0245700369742696 V90A-S323A -0.0256982654979234 G94A-G116A -0.0258299747154866 F85A-E125A -0.025877921290829 T122A-G307A -0.0267615151792593 L119A-M309A -0.0269011180684533 D91A-A306A -0.0273276316129571 S93A-T303A -0.0273443463972214 E125A-F296A -0.0287115733373797 G92A-Q114A -0.0299019598292972 R293A-T336A -0.0303296278334095 P86A-Q327A -0.0307780064481644 L302A-N331A -0.0316124269139316 W124A-L325A -0.0320387817680627 S299A-P333A -0.0331414964400079 T121A-S323A -0.0331803991032737 L126A-N331A -0.0339683100251387 R98A-S113A -0.0340866565243476 F85A-R133A -0.0343427087610255 R131A-L332A -0.0344341662961378 I88A-F326A -0.0348692289786552 P86A-L128A -0.035022583176211 F85A-T122A -0.0357428192727678 A82A-R87A -0.0361418021444162 E125A-S329A -0.0372576785110703 I300A-F326A -0.0384652896682343 Q97A-Y115A -0.0392699067558411 G92A-M309A -0.039609281848568 I88A-A123A -0.0396684348199248 Y115A-G322A -0.0403072654006564 A294A-T336A -0.0408430164633754 I88A-S93A -0.0410170416095639 F296A-I330A -0.0413114692399494 A123A-L132A -0.0415133491386195 S113A-T308A -0.0415976447410461 S93A-G322A -0.0417572997748039 Q114A-G322A -0.0418352471694279 T121A-I300A -0.0425874371150511 F297A-G338A -0.0427136248140152 F297A-S329A -0.0428100858677993 G116A-A304A -0.043992826761249 D127A-L302A -0.0440935361578911 R131A-S301A -0.0463693002423256 F85A-G120A -0.0465733468211149 D127A-L132A -0.0470544298157565 R133A-S299A -0.0474087926807227 L128A-N331A -0.0494918889441938 T118A-A306A -0.0500940652070894 R87A-L302A -0.0512286227553922 A123A-Q327A -0.0518376426336409 Q97A-S113A -0.0531647253762104 A295A-N331A -0.0547425537813788 D127A-F296A -0.0548875741932555 T95A-S113A 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