[Thu Aug 25 00:27:08 2016] >Input file: TM3QRCCGG.pdb >TM segments: A8-14_A27-33_A46-55_A62-79_A81-99_A102-122_A127-137_A142-149 MAIDEN score = 340.1263 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 ----------- ---------------- A95A-R107A 10 S14A-P27A 10 Y11A-L147A 10 E133A-T144A 10 Y68A-H92A 10 R53A-F65A 10 S131A-M146A 10 D64A-K96A 10 F76A-L84A 10 K66A-K94A 10 S83A-Q119A 10 F97A-E105A 10 Y81A-N121A 10 L87A-G115A 10 S8A-K33A 10 A12A-G29A 10 Q13A-W145A 10 G93A-K109A 10 Y114A-Y134A 10 D129A-G148A 10 P27A-R52A 10 L32A-F48A 10 D62A-S98A 10 S135A-V142A 10 F120A-I128A 10 S47A-T71A 10 T51A-Y67A 10 R28A-R52A 10 F30A-Q50A 10 Y85A-G117A 7.77998482873966 G89A-A113A 6.69659381777075 A72A-L88A 5.90311847296687 G10A-N31A 2.35307531571954 V127A-A149A 1.83037146457474 I9A-A149A 1.5494607909876 A116A-Y132A 1.31033170181518 I9A-L32A 1.24831000906575 T71A-L88A 1.24724148192533 K33A-F48A 1.17075572316087 K94A-K109A 1.1351913844123 F55A-G63A 1.11517095854998 F65A-K96A 1.04824814210931 L118A-A130A 1.01976541662297 V82A-F120A 0.995862946197036 A113A-E133A 0.960097622173199 F76A-V82A 0.947593437198761 V75A-L84A 0.944463160745105 A113A-K136A 0.888971667842065 F48A-V70A 0.834509000484195 I9A-L147A 0.815415748986115 L118A-I128A 0.812510720618578 D129A-L147A 0.809177932182553 F76A-Y85A 0.806564594187924 K66A-A95A 0.764681374913748 A12A-P27A 0.732474700871304 I9A-D129A 0.725470788903179 L84A-L118A 0.724630335585051 F30A-F48A 0.718273871794723 F120A-V127A 0.700310812756581 A130A-M146A 0.68726133842096 V70A-A90A 0.669524212556251 I9A-N31A 0.657085679167941 S135A-G143A 0.656836318697478 S8A-G148A 0.65101429357376 Q119A-V127A 0.637649998402721 L112A-Y134A 0.635279271613177 S14A-R28A 0.623048506927851 G89A-S111A 0.612523363151121 S83A-L118A 0.596476702794016 F65A-A95A 0.594200797604392 G63A-S98A 0.587162953211427 P74A-L87A 0.579359790412917 Y85A-G115A 0.577697621376528 A95A-E105A 0.5776056497726 G91A-K109A 0.563122043279758 S111A-L137A 0.555428260297149 F76A-S83A 0.548944843108534 A116A-E133A 0.543041252280711 F48A-T71A 0.532749433040915 F48A-S69A 0.531904852447183 F30A-T51A 0.52996746791793 Y68A-A90A 0.528862806993294 V75A-G86A 0.520319245245848 V70A-L88A 0.519980274290118 A49A-V70A 0.517090641236445 F97A-S104A 0.516752270087855 L88A-Y114A 0.515720562115146 P74A-L84A 0.514728381950622 S8A-L32A 0.51034902418167 L87A-A113A 0.508595334323239 S83A-G117A 0.506301265010174 T71A-A113A 0.505167597731429 G73A-Y85A 0.4980324896926 A90A-T110A 0.491527740274702 G91A-K136A 0.491002500275673 P27A-Q50A 0.489913058308818 S14A-W145A 0.488989245921951 A12A-M146A 0.480037759060352 N31A-M146A 0.476476300388303 T51A-F65A 0.474303358996297 F48A-Y68A 0.465612377739728 S8A-V127A 0.450812586067581 Q13A-K66A 0.445230476119665 Q13A-F30A 0.442179047388327 Y11A-W145A 0.440103431871767 A12A-L147A 0.439982923275108 V70A-A113A 0.436580719157296 I9A-F30A 0.435594759415211 T110A-L137A 0.426823022324806 Q50A-K94A 0.423090542380215 Q119A-D129A 0.421906452313138 A12A-T144A 0.421108514104815 L32A-S47A 0.420515100714471 G115A-E133A 0.419026730316738 K33A-Q119A 0.408243371672217 F55A-D62A 0.407323692888562 V75A-S83A 0.404214609485498 P27A-E133A 0.401283282360649 L137A-V142A 0.393935174944576 S47A-S69A 0.391491734594391 Q13A-Y114A 0.388830272737023 S14A-V142A 0.385718497151051 S111A-S135A 0.383227583642852 V82A-L118A 0.37636331531333 A12A-W145A 0.376194262242127 Q50A-H92A 0.369730819163696 S131A-L147A 0.36869180033349 S99A-S104A 0.368545423698505 I9A-M146A 0.366235096505402 N31A-L147A 0.361523001412168 Y81A-G117A 0.359467605601983 G73A-Y132A 0.359390073914124 F97A-S106A 0.35804297885927 Y85A-L118A 0.356843975823448 S69A-G91A 0.355821352988225 L32A-A49A 0.355450724846999 G117A-Y134A 0.354833909000495 A12A-T51A 0.351319533127556 A12A-K33A 0.350850690414959 K66A-A90A 0.350650171452485 S14A-T51A 0.34855779214992 G10A-A149A 0.347998184578652 S83A-P122A 0.343501831773684 N31A-R52A 0.342876831090029 G91A-S135A 0.339984760724175 S47A-V70A 0.338247192441649 K94A-E105A 0.328662404629955 A72A-G89A 0.328335396580325 Y132A-M146A 0.327530510109231 V75A-Y85A 0.32563791234386 Y11A-Q50A 0.324365108624792 G54A-F65A 0.318122032896039 G46A-A116A 0.316815779740932 A12A-S69A 0.315407681823858 V82A-Q119A 0.314085555778481 A130A-W145A 0.313792506363351 S47A-A116A 0.313580207317657 S98A-S104A 0.312232873868819 K66A-S111A 0.311294863623728 G93A-G143A 0.310637053141284 G10A-M146A 0.309539727220912 G10A-Y132A 0.309244461372211 T71A-T144A 0.307019185321832 K33A-Q50A 0.305821683235041 Q119A-I128A 0.301157308378695 G10A-S47A 0.298654598161903 A72A-G117A 0.298507349788853 R52A-F65A 0.297770956856356 P74A-Y132A 0.297408806231648 S14A-K94A 0.296168724744673 Y81A-P122A 0.295448359618127 R53A-Y68A 0.295279743965442 Y68A-G93A 0.293167061309473 A95A-S108A 0.293110623269532 S47A-G91A 0.291859203542923 V82A-D129A 0.290330404606961 G117A-L147A 0.28935531692868 Q50A-Y134A 0.289158600470834 Y85A-Q119A 0.288956695406315 Y11A-V127A 0.28813102850634 G10A-F30A 0.28805798675622 P122A-V127A 0.287584063801041 S69A-G115A 0.286478094332998 A49A-K94A 0.285472202639292 G29A-G54A 0.28399638208081 Q13A-T51A 0.279822651345627 N31A-Q50A 0.278829213410567 A49A-S69A 0.277364126380682 Q119A-Y132A 0.274874160602202 H92A-K136A 0.272744206372857 K94A-S104A 0.271715834509534 G117A-S131A 0.266255298846281 L118A-D129A 0.263324136627139 A130A-G148A 0.262164512868869 G91A-G115A 0.260067452302568 Y11A-D129A 0.258772934312027 R53A-Y67A 0.258433086390193 Y81A-D129A 0.258378984064673 N121A-G148A 0.258115984505667 G10A-G46A 0.258060378829941 S8A-A49A 0.25728302212346 L137A-G143A 0.255051995048627 F65A-K94A 0.254508624845043 T110A-K136A 0.254024413090298 Q50A-E133A 0.254000427560539 G117A-W145A 0.252346067230691 D62A-G102A 0.249893784580476 Q13A-G148A 0.248492903601362 F30A-E133A 0.248455339371307 G29A-R52A 0.248347590197749 Q13A-S69A 0.245435170082935 R52A-A95A 0.245112411443839 G54A-F97A 0.243510658439554 Y67A-S108A 0.243173476719345 T51A-E133A 0.242535164870916 G117A-Y132A 0.241832853467155 V82A-N121A 0.241484234439211 Q13A-S135A 0.239710997928162 G73A-L87A 0.238591776353122 Q50A-K66A 0.234101523094732 D64A-G93A 0.233377129544581 G115A-Y134A 0.232106976061065 Q13A-F65A 0.231851641422912 Y11A-G143A 0.230688569966137 A72A-L87A 0.230280317695154 L87A-A116A 0.229747895253979 A12A-Y68A 0.229464184815971 S8A-S83A 0.22914971917236 D62A-K94A 0.226504908587271 A90A-L112A 0.226468026461419 F48A-A113A 0.2262028880032 Y67A-S111A 0.225492943012512 S14A-Y68A 0.223815492185262 Y67A-K96A 0.222369892401418 S14A-R52A 0.222230403611247 S83A-F120A 0.221684346385731 A12A-A130A 0.22095621912613 Q50A-S69A 0.219455770419533 R53A-G63A 0.21934240293823 G54A-S98A 0.218836648578013 H92A-T144A 0.217563572794745 Q13A-F48A 0.217203388369218 T71A-E133A 0.217078846325258 S8A-S69A 0.216722528305724 R28A-M146A 0.216032383600286 A12A-A49A 0.215726410857236 P74A-Q119A 0.215427561716527 A49A-G93A 0.215382692428173 R28A-K94A 0.215369224806613 T71A-H92A 0.215150628949581 L87A-Y132A 0.214902678515915 A12A-S47A 0.214823297607236 Y67A-K136A 0.214650519306856 T71A-A90A 0.214539952051537 G93A-L137A 0.214316635338001 R53A-D62A 0.213688403153359 S14A-Y132A 0.213264325195565 G93A-R107A 0.212723853307251 S69A-K136A 0.212377203106324 K33A-W145A 0.211609253349761 G86A-A130A 0.211481387293336 A49A-Y134A 0.210801382880241 P27A-S131A 0.210379496848122 I9A-G148A 0.208796011198907 K33A-A116A 0.207874778300731 Q50A-Y132A 0.206531204489266 G10A-V127A 0.203724476766913 G91A-A113A 0.20364214284977 S69A-S108A 0.203263782334429 S47A-S111A 0.203253338165351 R52A-K94A 0.20296434433794 L118A-S131A 0.202818740921284 P74A-L118A 0.201409784453721 A49A-G89A 0.201229221806191 A116A-A130A 0.200198311185908 K136A-V142A 0.1998470095971 A49A-Y114A 0.199735958606133 T71A-L87A 0.198468817656506 N79A-Q119A 0.197206643746934 Y132A-W145A 0.196729603696151 Y68A-K94A 0.19646388814305 A49A-G143A 0.196360748467606 L112A-S135A 0.196092276887466 S69A-V142A 0.196032755951133 A72A-E133A 0.195907421307901 L87A-M146A 0.195270135986298 G86A-E133A 0.191939774436561 G73A-A113A 0.191791541670259 G115A-W145A 0.190443276963823 A113A-S131A 0.18953722775861 Q13A-N31A 0.189083682031419 P27A-F65A 0.188934415299704 K66A-E105A 0.187050163867941 A90A-T144A 0.187017637592599 D64A-K109A 0.186981645373991 Y11A-Y67A 0.186701860951335 S47A-Y134A 0.186130557787038 Y11A-S47A 0.185351552698867 S47A-Y67A 0.184760968207117 F48A-G91A 0.183286973723026 G46A-M146A 0.182065298316723 K94A-S135A 0.181478078231835 Y68A-R107A 0.180434585171368 K66A-H92A 0.180355106601844 Y68A-Y132A 0.179825665238837 F55A-F97A 0.178951458962982 G10A-L32A 0.178762456600799 G29A-S69A 0.177993246740114 R77A-N121A 0.177869402140789 K66A-F97A 0.177685040938482 S83A-M146A 0.177452276171642 L88A-A113A 0.177235127304771 S47A-L147A 0.176751784141121 G91A-Y132A 0.176538736400765 N31A-D129A 0.176337148671957 S47A-L118A 0.17628311363544 Y11A-S69A 0.176001974803164 A116A-G143A 0.175023643110737 G63A-S106A 0.174142374217404 F55A-K66A 0.173690267620131 G46A-L118A 0.173557551976669 G10A-D129A 0.173162279834825 Q13A-R52A 0.17246217746907 Y85A-D129A 0.17205253522823 Q50A-T71A 0.171719446090064 V75A-Y81A 0.171572891170494 G73A-L88A 0.171241493309175 G10A-L118A 0.171222211773148 Y67A-G89A 0.16807613913762 T51A-K109A 0.167583642350422 A90A-A113A 0.167399373423372 A49A-G73A 0.165931225558774 Y11A-E133A 0.16590665506308 S69A-K94A 0.165296652410302 I9A-A49A 0.164680603979075 V70A-A116A 0.164019055968668 L87A-S111A 0.163588101962268 A12A-G54A 0.16358414971599 S47A-S135A 0.163355196721803 F30A-A149A 0.163338501035017 G29A-G143A 0.162658270951767 G115A-G143A 0.162014065804905 A12A-G117A 0.161742258592511 S131A-T144A 0.161690955578586 G10A-A116A 0.161636831452177 R52A-W145A 0.161217482861161 G46A-G117A 0.16109047298809 A49A-G86A 0.160547305281718 V70A-S135A 0.159616351366056 G29A-F65A 0.157995606720537 A49A-G117A 0.157962514660359 K33A-S83A 0.157688029823126 F65A-K109A 0.156065060596463 G63A-S104A 0.156006934240381 V127A-M146A 0.155456236083521 S14A-K136A 0.154560781368345 L32A-G46A 0.153851197355688 G54A-D62A 0.152721163738161 G89A-G117A 0.15221116029016 S47A-L87A 0.151695670696206 L88A-G115A 0.1516708336313 G46A-G89A 0.15150669649155 A12A-G115A 0.150747975977031 N121A-D129A 0.150484220525887 R52A-E133A 0.150000493615753 G117A-D129A 0.149757485571834 N31A-L118A 0.14922202376864 A95A-T110A 0.149038451218457 G46A-Y114A 0.148570010312827 G86A-Q119A 0.146778012952702 Y11A-L118A 0.145852882159658 K66A-T144A 0.145449391100012 I128A-A149A 0.144749224933029 G46A-G73A 0.144723467566932 A12A-D129A 0.144640150584547 T51A-K96A 0.144530016392995 A72A-G86A 0.143744936695663 G89A-L112A 0.143742143166425 K66A-G143A 0.143651142201237 L32A-Y67A 0.143377911332262 F48A-G89A 0.143224936337786 A12A-R53A 0.143196985213313 L32A-G73A 0.14227608341042 Q50A-S131A 0.141920208007837 S69A-A113A 0.141213774077176 A116A-S135A 0.140685622794658 N31A-W145A 0.13983290560739 D129A-M146A 0.139660676978298 Y67A-Y114A 0.138486016508569 A116A-D129A 0.138279768073038 G10A-G29A 0.137881172759656 R28A-D64A 0.136871389886558 Y11A-R28A 0.136869291770793 F48A-T144A 0.13632412772992 S131A-V142A 0.134252391349002 K33A-G73A 0.133980641068155 Y67A-Y132A 0.133216773664496 T71A-T110A 0.132577141350327 T51A-G63A 0.132468069678562 G46A-Q119A 0.132119088931139 G117A-G143A 0.132090132920029 P122A-D129A 0.131827598427563 A95A-Q103A 0.130843967359479 S14A-H92A 0.130704276965883 S69A-W145A 0.130412577304024 K33A-V75A 0.129599791749472 N121A-A130A 0.129576331301065 V70A-K109A 0.129395259548877 G54A-K94A 0.129157726364931 G46A-G115A 0.12876365159874 Y68A-S108A 0.127885968147158 Y85A-Y134A 0.12787949813561 Y11A-Y68A 0.127548352503556 T71A-G117A 0.127322166413909 G46A-Y68A 0.126925449826983 Y68A-G115A 0.126892607906015 A49A-Y67A 0.126584603239664 G46A-T144A 0.12621630946017 G93A-T110A 0.126084979382791 I128A-L147A 0.125966633388671 G91A-R107A 0.125727008147256 P27A-A49A 0.125358506137877 D62A-S106A 0.125329904521359 G46A-Y134A 0.125009158969402 K66A-K136A 0.124835238296467 G46A-G148A 0.124625605179136 D64A-S108A 0.124585201249328 Y81A-A130A 0.124527243834823 R28A-F55A 0.123098594022633 P74A-V82A 0.121250293440592 I78A-G117A 0.121220137337071 S135A-W145A 0.121119595876159 N121A-I128A 0.120440472775472 F48A-W145A 0.120032033808788 A72A-S135A 0.119477456342216 G93A-E105A 0.119166754843909 G46A-G91A 0.118790064595974 G115A-M146A 0.118676458342852 A49A-L147A 0.118193046757288 D64A-S104A 0.117872412105683 G91A-T144A 0.11761591056137 Y68A-K109A 0.117403675174283 S14A-A95A 0.117366603563386 K94A-R107A 0.117340956989259 Y85A-E133A 0.116945740559926 S8A-A72A 0.116885282815681 S14A-A49A 0.116842728721982 A12A-S135A 0.116748801047096 K94A-S111A 0.116201268637503 F76A-N121A 0.116067267664953 F76A-F120A 0.115974341176389 N31A-Y68A 0.115657507256709 A90A-Y132A 0.115488425243009 S14A-A113A 0.11531795605707 Y68A-Y134A 0.11517683468243 T51A-S135A 0.114747842987713 G117A-V127A 0.113455683201602 L87A-L118A 0.112763855705491 T71A-V142A 0.112011330432542 P27A-Y134A 0.111939615549354 F30A-R53A 0.111520045213326 A12A-A149A 0.111513832744635 N31A-T71A 0.110073704381549 L84A-S131A 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