[Wed Aug 24 17:36:24 2016] >Input file: TM4R1IATD.pdb >TM segments: A23-43_A82-108_A183-205_A212-229_A277-292_A310-328_A354-372_A391-410_A412-432_A436-451_A492-511_B23-43_B81-109_B182-204_B212-229_B276-292_B311-329_B354-372_B391-410_B412-432_B436-452_B492-511 MAIDEN score = -134.0373 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 ----------- ---------------- C406B-D449B 10 C406A-D449A 10 C406B-Y445B 2.21876844372002 C406A-Y445A 2.21399237897062 P95A-L195A 1.89051198741194 P194A-P215A 1.42041500562641 P95B-L195B 1.41759946739556 P194B-P215B 1.41022948996676 S102B-F320B 1.39138666671464 A437B-V511B 1.37028274912574 A197B-V213B 1.36439985538183 P95B-G198B 1.36069856739488 E216B-I315B 1.27494806218518 I108B-I328B 1.21292346360143 I34B-F367B 1.16949162837365 F90B-F362B 1.1122911276853 F90A-F362A 1.1122798787065 E216A-I315A 1.10288899035291 A185B-M222B 1.05422712083111 I108A-I328A 1.01929793039983 I199A-W420A 1.01194773399606 F188B-W219B 1.00556431006636 A203A-P429A 0.999727050175584 L393B-L398B 0.992891576386556 S396A-C501A 0.992415692557967 A437B-P510B 0.984525654437282 F30B-V422B 0.97569807130819 A109B-P326B 0.968784957661084 I34A-F367A 0.939271112654744 I108A-A324A 0.938686388503763 A437A-V511A 0.936043525901884 I400A-I497A 0.933920840045515 F30B-F363B 0.925459881476897 V27A-I360A 0.904575681248151 I199B-W420B 0.890725921082045 F30A-V422A 0.874144693841711 I34B-Q366B 0.865691245928661 S102A-F320A 0.864194763786999 L196B-W420B 0.844275952213899 I502B-L507B 0.832671279467422 Y436A-I441A 0.82812680478274 V99B-L195B 0.80350569135892 L83A-K313B 0.797334753008943 N186B-M222B 0.79359259597321 V106A-F320A 0.79017673024972 I403A-I447A 0.788258587316468 I34B-F370B 0.788227815051437 P438B-P510B 0.785655521971797 I447B-W496B 0.77934626219456 F402B-Y445B 0.766149174012266 P24B-L29B 0.763282624767479 V101A-F320A 0.759304403482587 A204A-P438A 0.757170258183666 V101B-F320B 0.756408855025154 I229B-W496B 0.755619511842743 I447A-W496A 0.755547218639113 S184B-I192B 0.753697965560977 F402A-Y445A 0.752018359070265 L196A-W420A 0.747977008427144 L283A-L322A 0.744257931717115 P24A-L29A 0.739047922294263 V428A-I441A 0.738339576854617 Q201B-V213B 0.737840979279015 E216A-L312A 0.73610298694581 S184A-I192A 0.729954791263028 E216B-L312B 0.728843117887526 M432A-A437A 0.728268873479523 L96A-I361A 0.727283781485257 V106B-F320B 0.723858994992131 V451A-L493A 0.723378399973098 V451A-F492A 0.718840545880951 A437A-P510A 0.717203808434697 L103B-T191B 0.716857700851204 V451B-L493B 0.71326018141985 V27A-F363A 0.710612278431496 V451B-F492B 0.709347390981069 A203B-P429B 0.709116783737364 V27B-F363B 0.707700807688838 L83A-V317B 0.707566643905176 Q202B-V368B 0.69721576454274 V27B-I360B 0.691893286280123 F188A-W219A 0.690280709173585 A204B-P438B 0.688460177631118 L189A-W219A 0.687501309612876 L189B-I319B 0.686871744321258 Q202A-V368A 0.679905721112212 Q201A-V213A 0.679802047546055 F30B-F367B 0.675439262845832 L283B-L322B 0.673133554209997 T200A-V213A 0.668828801093061 F30A-F363A 0.667568275961065 F90B-Q366B 0.661461604270952 D193B-E216B 0.657204434051488 T200B-V213B 0.65682157766101 V106B-F323B 0.648200951265869 G105A-I319A 0.647421764539013 L187A-M222A 0.645570607711075 I403B-I447B 0.642429693712819 P95A-Q202A 0.641051257189006 I108A-F323A 0.640156964616307 F30A-F367A 0.639588289601274 L23B-M412B 0.638032618646245 D193A-E216A 0.637169397355708 V106A-F323A 0.631362392576246 F93A-Q202A 0.630986819011548 L431B-P438B 0.62874343979377 L23A-M412A 0.627798603085295 P95B-Q202B 0.625381888817746 I31B-F363B 0.625299960618473 F30B-A364B 0.622636469079711 M432B-A437B 0.618580491716539 N186A-M222A 0.617249909666202 P310A-L83B 0.616234652253373 G97A-F90B 0.615890426953717 I413A-A418A 0.615829689980874 E439B-V511B 0.6147533980316 L196A-R446A 0.612436764786851 A94A-I199A 0.609576097434401 V228B-W496B 0.608845349377369 F280A-L322A 0.608684967960883 P429A-P438A 0.608184582488322 Q201A-P438A 0.606606749348284 Q202A-P425A 0.605779010015148 I108B-F323B 0.604891155921295 I229B-F492B 0.603626073995073 F188B-A223B 0.603097573956049 I360B-A418B 0.602301704062595 F188A-A223A 0.600318811602867 I403A-Y445A 0.59828850092957 S396A-F505A 0.596441527915072 L195A-P215A 0.593787799444012 A109B-I328B 0.593137620622082 G277A-P326A 0.592258875632888 F30A-A364A 0.591493429586362 G277B-P326B 0.591430143640451 I229A-F492A 0.591255409636394 I413B-A418B 0.589435600842917 P194B-G214B 0.587136088401376 L196B-S417B 0.586809332636188 L104A-A324A 0.58561342537404 F33B-F367B 0.583265427385163 S284A-L322A 0.582741437410742 L196B-Q442B 0.581464816640473 F90B-I361B 0.580592477379454 P95A-A197A 0.579454945322412 P95B-I199B 0.577055855697192 L189A-P215A 0.575453708505313 G105A-F323A 0.572375966017628 V99A-L195A 0.572197776335527 F221A-A443A 0.572095577014621 I400B-I497B 0.569830056337041 V440A-G508A 0.56835116113094 V440A-V511A 0.566914988998473 S284B-L322B 0.564123552824478 F399A-C501A 0.563654743040195 P95B-L196B 0.563307884401315 F280B-P326B 0.560835418104411 L104B-F320B 0.560202155048788 I108B-A324B 0.55876295381516 P95A-L196A 0.558212344691167 V428B-I441B 0.557265238193985 P95A-I199A 0.556564864049668 L189B-P215B 0.556213229115374 F399A-A444A 0.55547541485568 A204A-P429A 0.555236046612553 F280A-P326A 0.553955376260893 P95B-Q201B 0.55341320311894 L196B-Q201B 0.553200418330643 I360A-A418A 0.544168913848487 Y183B-V451B 0.543941136056219 N410A-Q419A 0.543080402854188 L104A-F320A 0.542099731166589 V99B-T191B 0.541870323198425 I34A-Q366A 0.539835892781303 F221B-A443B 0.534724860212142 L189B-P194B 0.533892663880999 I192B-R446B 0.533610448968381 F33A-F367A 0.533565377187566 S225B-L499B 0.533099523050958 L196A-Q201A 0.531838540868174 I405B-N410B 0.530431301543623 A416A-D449A 0.526549311754593 K313A-L83B 0.525964935729211 F402B-A444B 0.525951636668242 F90A-Q366A 0.524766099169123 A407B-V451B 0.524339711363303 F408B-T452B 0.522875378882837 L38A-F370A 0.522399102204548 D193B-A217B 0.522251288352326 I403B-Y445B 0.521193615594301 I405A-N410A 0.520395650792469 P95B-A197B 0.520292223006368 A444B-F500B 0.520053729078181 A444A-F500A 0.518551946632467 F402A-A444A 0.517057410403069 V228A-W496A 0.515728489061599 F90A-L96A 0.510045156661298 L96B-I361B 0.508157759138908 L38B-F370B 0.507890000670748 L187A-W219A 0.507729027545881 F399B-A444B 0.504740418736518 L195B-P215B 0.503819405610012 F280B-L325B 0.502817290727902 L189A-E216A 0.501757981254606 F280A-L325A 0.501003021639358 F90B-L96B 0.500460393769123 E216B-P510B 0.498751389651548 P429A-E439A 0.498016792061285 F221B-W503B 0.495739319930134 E216A-P510A 0.495453708158812 I229A-W496A 0.494796171625588 S225A-L499A 0.493811266409551 L37B-F371B 0.492373423436774 G214B-K313B 0.491276980101215 P194A-G214A 0.488780411996588 K81B-K88B 0.487024409438556 F188B-D193B 0.485529968395222 P194B-E439B 0.483641370818675 K88A-G97B 0.481956752365963 G182B-S450B 0.479329698183981 M432A-I441A 0.477870238513458 L189A-I319A 0.477623328453135 H25B-I413B 0.47434422587345 P95A-Q201A 0.474045643998708 V106A-G190A 0.472674499637895 I229B-A495B 0.472108244863838 F408A-D449A 0.472084817597025 F408B-D449B 0.470507582000685 V228A-A495A 0.465356742114244 T200B-V428B 0.463758476051647 L431B-Y436B 0.46311547772067 P429B-E439B 0.461618704297372 P26B-I360B 0.461475130368411 L23A-I413A 0.45857179692779 G97A-K88B 0.456562527507065 I502A-L507A 0.455681835754605 L23B-I413B 0.454562688174493 T200A-V428A 0.446871531468372 P215A-I315A 0.446078750581961 T98B-G198B 0.445251878709137 T191B-E216B 0.444413636395887 I31B-F367B 0.443362751070127 L37A-F371A 0.442698411695223 P194A-E439A 0.442170246065025 T86B-Q366B 0.442046612767935 I31A-F363A 0.440722066398039 P95A-G198A 0.439847099292635 I291A-F311A 0.438768551178119 T98B-V316B 0.436535328980789 C501A-V506A 0.434146148348793 F93A-I361A 0.43377913416322 Q201B-P438B 0.432783433304004 T86A-Q366A 0.432122601311687 L103B-F320B 0.430884342624352 A204A-V428A 0.430777894128179 S184B-M222B 0.430529015699183 L195A-S417A 0.428805970130082 T98A-L195A 0.428421902002066 T91B-L96B 0.427197158011115 L196A-Q442A 0.427049367398171 T98B-L195B 0.426924305568807 N218A-V440A 0.425595194280494 I199A-A424A 0.425388430866795 S396B-F505B 0.423461202511255 F280B-L322B 0.42214752888607 A204B-P425B 0.421005109688913 L37B-F370B 0.420867817066334 L103A-F320A 0.418992031618663 G182B-T226B 0.418655336003409 K88B-F93B 0.418086591900785 P438A-P510A 0.417186324943847 A203A-V368A 0.414134711628253 G214A-V316A 0.411762422309032 A197B-V212B 0.410379435795171 L29B-V422B 0.408809454827638 L287B-F318B 0.40708986403358 L37A-F370A 0.404366062800524 P215B-L312B 0.40160576237059 T191A-E216A 0.401219990991351 Y357B-S417B 0.400826189516833 V228B-L499B 0.399820251872357 F399B-C501B 0.399613900067703 M222A-I447A 0.398345186429244 V106B-T191B 0.398017353539741 V228B-A495B 0.397406559372473 F93B-I361B 0.39654180531667 I403A-A444A 0.396199358950131 I199A-A421A 0.395238349484469 I199B-A421B 0.394922228825226 P26B-Q419B 0.394449920128238 K81B-Q366B 0.394274282555542 I82B-F370B 0.394206553559383 F402B-I441B 0.39400749388995 F90A-I361A 0.392490470513662 T98A-G198A 0.389653008580067 A364A-V422A 0.389598675492722 I403A-I497A 0.389242829210116 F30B-I360B 0.388903165691092 A364B-V422B 0.387532326794605 I403B-A444B 0.387257831474476 N186A-W219A 0.387074002517753 S184A-M222A 0.387004072157967 V368A-P425A 0.385698118126858 K88A-K313B 0.385092668913821 E439A-C501A 0.385051413024085 Q202B-P425B 0.384970980957388 P194B-V316B 0.381113427619426 T91A-T98B 0.381044898849218 T98A-T191A 0.380668565979466 V440A-V504A 0.378992510243658 T86A-V317B 0.378540148128456 A444A-A498A 0.378507892656454 A217B-A223B 0.377452817794436 I34A-F370A 0.377297618506939 A217A-A223A 0.376930049357211 A437B-A444B 0.376898083253771 A185B-A444B 0.376098024166663 A185A-A444A 0.375901306951004 P194A-K313A 0.374616044316878 I403B-I497B 0.372110619009298 G182B-V451B 0.371793300866127 A424A-P429A 0.371751559752589 H85A-Q366A 0.370108387902063 G190A-I319A 0.369844439149331 T452B-L493B 0.369658860792345 L431A-Y436A 0.36942184563898 I413B-Q419B 0.369385494899733 P215A-V316A 0.36728890994223 A203A-A437A 0.36696431422638 G214B-L312B 0.366323725676004 G182B-I229B 0.365217247420492 V359A-L104B 0.364299170701172 A444B-A498B 0.364253734894255 P194B-K313B 0.363199665590125 F93A-A365A 0.361796800084671 Q201A-Y445A 0.361301898184934 W503A-P510A 0.360758391069786 S184A-P194A 0.360193735323127 Y436B-I441B 0.360184526822904 N186B-W219B 0.358124284317318 T91A-L96B 0.357301310452389 P194B-W219B 0.35628088692755 H25A-I413A 0.354886300399059 S225B-W496B 0.3546443895812 I192A-R446A 0.354484463134087 Y183A-V228A 0.353793579497691 S184B-P194B 0.353245241234542 P26A-I413A 0.353178222344684 K88A-A364A 0.35284062400834 V228A-L499A 0.35230099348194 L83A-F311B 0.351921739360028 L104B-A324B 0.351183666815523 A424A-A444A 0.35065229860939 H85B-Q366B 0.348837475288383 K88B-A364B 0.348515452841434 L29A-V422A 0.348220415833655 L431B-A437B 0.348131342814474 V27B-V359B 0.346682933709972 E439B-C501B 0.346188252041539 E216A-K313A 0.345260624305303 N372B-P425B 0.34500380497736 G198B-E216B 0.344615136003393 F90A-G97B 0.344398351826196 T98A-T91B 0.342962095897692 L196B-R446B 0.340876701243887 S417A-P425A 0.340804091454951 L187B-M222B 0.340502328024233 P194A-P438A 0.340091516006111 T200B-Q442B 0.33785710161025 T91A-L96A 0.337791740226294 I34B-F371B 0.337361632940788 G198A-E439A 0.33724550588263 V391A-M430A 0.336433635386711 W503B-V511B 0.335227056757708 T86A-T98B 0.334737293591408 P26A-I360A 0.334394206114948 F399B-I441B 0.333682541735718 S102B-K313B 0.333512958822479 A203B-V428B 0.332922746670135 L189B-W219B 0.331014435195533 L431A-P438A 0.330204006627099 T84A-T91A 0.32955925105437 F427B-E439B 0.32920420225391 T91B-G97B 0.329195630531079 G182B-A495B 0.328266490556014 V27A-V359A 0.327506105018361 P194A-V316A 0.326922747667197 Q202A-E439A 0.326838808000363 E216B-K313B 0.325989636163457 I199B-A424B 0.325861196547265 D193A-A217A 0.325090014712738 A217A-E439A 0.324120142306597 A185A-R446A 0.323619418352349 E216B-Q442B 0.323367634965574 L187B-A223B 0.323170526312277 S102A-K313A 0.323126767130704 G190B-A223B 0.322149438364225 G182B-A223B 0.32175366043875 C406B-I494B 0.321623351282673 Y357A-V422A 0.320847954149773 Q202B-A365B 0.320318637925394 L404B-G448B 0.32027172411322 G198B-E439B 0.320258526095283 A109B-L325B 0.320160135986595 L187B-W219B 0.319707901926608 G190A-A223A 0.318740881001816 N372A-P425A 0.318509473618818 I34A-F371A 0.318390319586283 G395A-F505A 0.318136584137686 A217B-G508B 0.318122814227705 A197A-Q442A 0.317752713350092 E439A-F500A 0.317678551428896 G105B-I319B 0.316948793386564 L187A-T226A 0.316084838101883 A424B-P429B 0.316006980949569 N410B-Q419B 0.315447821806175 T91A-G97A 0.315402180291454 L187B-T226B 0.315294242408481 G190A-A197A 0.314324121416945 G198A-E216A 0.313670036547146 G97A-G214A 0.313442545642782 A94A-A204A 0.313324312307627 T98B-T200B 0.311920814303591 S102B-A109B 0.311757048781783 E216A-Q442A 0.311471966890306 A185A-F221A 0.311418715646239 Q202B-E439B 0.310833431653045 I291B-F311B 0.310714034521341 V397B-M432B 0.310670969543228 F30A-I360A 0.307661242354177 A197B-A421B 0.307412051728297 Q419A-A424A 0.306494714628669 C406A-R446A 0.305012135959962 F93A-I199A 0.304933185357095 L196A-P215A 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