[Wed Aug 24 17:31:31 2016] >Input file: TM2M3GATD.pdb >TM segments: A5-24_A37-60_A68-87_A102-122_A127-147_A168-191_A197-217_C5-25_C37-60_C68-87_C102-122_C127-147_C167-189_C197-217_B5-25_B37-60_B68-87_B103-122_B127-147_B168-190_B197-217 MAIDEN score = -194.5681 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 ----------- ---------------- H8C-M52C 10 H8A-M52A 10 H8B-M54B 10 H8A-M54A 4.64181713108769 H8C-M54C 3.56568312655963 I118B-W131B 1.26270956430199 I118A-W131A 1.12153714209858 W9B-M52B 1.08730721654264 W9C-M52C 1.06080768994663 W46B-V111C 1.0271424612118 K60C-A71C 1.02221004160347 A19C-P44C 1.02165150661313 H8B-M52B 1.02085551763082 W9A-M52A 1.01054589736654 I185B-F190B 1.00797010025987 A19B-P44B 1.00572226970832 F22B-Y37B 1.00141557247449 V112B-F139B 0.9827644285124 K60A-A71A 0.980210271066076 W9C-I56C 0.974115461815323 I110B-W46A 0.966323651975035 V112C-F139C 0.957214949213657 L84A-Q109A 0.950316665739422 A19A-P44A 0.934192847480114 W76A-I113A 0.923429817086178 W76B-I113B 0.910994835265575 K60B-A71B 0.910392462536954 I118C-W131C 0.877492657404271 V112A-F139A 0.856770463854381 L87B-D217B 0.848831326505299 W46C-V111A 0.845318682300721 V111B-W46A 0.812699250123209 T108B-F42A 0.802414888865313 I185A-F190A 0.787957160507844 L87A-D217A 0.781913071429402 L87C-D217C 0.766144054675296 L49C-C134A 0.759877250632751 A53A-Q58A 0.75699420115375 T108A-I142A 0.744462827697416 Q58C-V127A 0.743112016565727 T108C-I142C 0.742934376042274 W76C-I113C 0.74051963561676 Q58B-V127C 0.736058246825351 W183A-F190A 0.70549467404494 W9B-I56B 0.70545327809646 V182A-G189A 0.702630146125738 V111A-G135A 0.67418616199341 A119B-W131B 0.664750989671714 L7C-A55C 0.664029475044222 V182A-F190A 0.663808833610033 Y179C-L205C 0.659055134734118 A119A-W131A 0.656188689327095 A119C-W131C 0.655891733814206 I184B-F190B 0.652894319853562 L49B-C134C 0.640759350488563 V12B-A50B 0.63627372959193 Y70C-L121C 0.628274140463277 V127B-Q58A 0.626337658909846 D57C-H69C 0.624485375325475 Y70A-L117A 0.623001906166471 H69C-D75C 0.620356341538047 A19A-I45A 0.614282475720206 H69C-L121C 0.612977994174596 M54B-A71B 0.611813286705013 L7A-A55A 0.609277027540843 V12A-L49A 0.607014864784069 V12C-L49C 0.602943807941037 V12C-A50C 0.597251290018371 V12A-A50A 0.594386521879209 Y179B-L205B 0.592936370688997 Y70B-L121B 0.587489857284995 Y11C-G48C 0.582079374887312 I56B-V127C 0.576680117084257 M15A-I45A 0.574661699613829 H69C-D198C 0.568536777022778 W9A-Y51A 0.564661811852226 I43B-L82B 0.562521351039799 W9C-Y51C 0.55867229041137 T108B-I142B 0.557400593594189 A53C-W131A 0.555616961193322 I184A-F190A 0.555543961826937 W9B-Y51B 0.554953641256299 V127B-I56A 0.553871605770812 I56C-V127A 0.553658409896991 D75C-T80C 0.553110832922384 L7B-A55B 0.549662720323866 V12B-L49B 0.547411954065779 W9A-I56A 0.544907209452195 F42C-S107A 0.543278217286352 H69B-D75B 0.532715266951172 A19C-I45C 0.532656510858807 D57B-H69B 0.530020372586192 G18B-P44B 0.528444918130541 A53B-Q58B 0.526617870958519 L168A-D217A 0.525497726819472 A19B-F42B 0.519206080310587 H69A-D75A 0.518051593634476 V111C-A138C 0.517752428375977 L38B-F104C 0.514796495844675 G59A-R72A 0.513970386144743 W9A-A53A 0.512068613561586 C134B-L49A 0.511658619248179 L7B-F200B 0.509233033268617 V112B-A138B 0.507015312776473 T108A-A138A 0.506295588501318 D57A-H69A 0.505002104511277 L83C-K210C 0.50402377989561 Y73C-D120C 0.500508541173916 V112A-A138A 0.497734478345508 I43C-L82C 0.49311838955394 Y70B-D120B 0.489864964571574 D198B-C203B 0.489317583483477 I10C-M52C 0.487980457410809 Y73A-D120A 0.487885712662981 Y11B-G48B 0.487858621335207 W9C-A53C 0.486246663456538 M77C-I113C 0.485452216031735 S115A-W131A 0.484059009626171 H69B-L121B 0.483278627409776 A19A-M41A 0.478824204852332 I43B-L83B 0.478726355784996 V112C-A138C 0.478067971214349 F190A-D198A 0.477911131741211 W46B-I110C 0.474975680220361 S107B-F42A 0.474064060475973 M54C-K60C 0.472566949004162 Y171C-F213C 0.472084301598645 V111C-G135C 0.469683512893303 L85A-M106A 0.468397881558401 I43C-L83C 0.468200192828223 A53C-Q58C 0.467055860077431 R128C-G189C 0.466694991177362 M54B-K60B 0.463826711781636 I43A-L82A 0.456955234373132 H8C-C134A 0.453098526474672 V12C-M52C 0.453085458004789 I181A-G189A 0.452149815412503 T108B-A138B 0.452113586018301 I10A-M52A 0.449386820053237 I184A-G189A 0.448612174646746 Y70C-L117C 0.4457044599558 S115B-W131B 0.445511021201439 V12B-Y51B 0.444755438316306 M15C-I45C 0.441996834280316 V111A-A138A 0.435065316130519 L168C-D217C 0.434540906456254 L7C-F200C 0.433549204829303 V12C-Y51C 0.43310477100626 D198C-C203C 0.432769392906298 A40C-S86C 0.431109405305033 F42C-T108A 0.430048088774299 T108C-A138C 0.428734774047964 L38C-F104A 0.426939628247602 S5B-A55B 0.426931885972364 F104B-L38A 0.423168526199542 Y11A-G48A 0.420536991675763 M54A-K60A 0.41867124016736 V112A-V136A 0.418373946648299 R72B-L117B 0.416438704369039 R72A-L117A 0.414784519947889 W46B-V78B 0.414714605892175 M77B-I110B 0.412601696191559 V12A-Y51A 0.411729104311533 V39A-L82A 0.410823963502724 W9B-A53B 0.409603627876669 D198A-C203A 0.403922099968303 S47C-T79C 0.400527332838351 L84A-M106A 0.398098655423742 V111B-A138B 0.394842138665673 W183C-S188C 0.394769352826156 H8B-S47B 0.391927748602632 H69A-S188A 0.390268826326229 W183B-S188B 0.389826131441149 W131C-V136C 0.389118928053016 V39B-L82B 0.38901769461539 W131B-V136B 0.388428325853152 H8A-S47A 0.387229684795201 W131A-V136A 0.386171155984652 R72C-C203C 0.385038909559889 M77A-I110A 0.380412139151534 A13C-A55C 0.378034306240414 F42B-S107C 0.376175393150588 Y70C-D120C 0.375707842707548 Y51C-D75C 0.373027334839789 I118C-R128C 0.372355508634469 Y70B-D75B 0.37211261595833 Y70A-D75A 0.371418285608566 H8C-A53C 0.370003297373408 Y132B-Q58A 0.36940083157644 H8A-A53A 0.368361082423085 S47A-T79A 0.365837849077907 I181A-F190A 0.365208423495201 A53B-W131C 0.364614340219692 T108B-C134B 0.361950367920516 S115C-W131C 0.359556801780887 L6B-A55B 0.358184035292255 I43C-T79C 0.358000566650768 Y129B-V182B 0.357078595367732 Y37B-V211B 0.357018274110666 Y51B-V111C 0.356216080259747 T114A-C137A 0.355256434268695 A68B-S122B 0.355142601644618 A13A-A50A 0.353958179573135 G59A-H69A 0.353843502798993 P206A-S214A 0.352454859510797 Y51A-V78A 0.351466439724097 M15C-W23C 0.351381444104547 H69A-L121A 0.350444190815827 Y11C-M52C 0.350395673258947 T108C-C134C 0.349538707881402 V12B-M52B 0.349509728316542 W46C-M106A 0.348340229398953 P206B-S214B 0.347982005734204 G48B-C134C 0.347535088881177 A53A-G59A 0.346295923009433 A13C-A50C 0.345568496950306 M15B-G48B 0.344185354072575 L85B-M106B 0.343947077000854 G48C-C134A 0.341615743055272 R128B-G189B 0.341404455832411 A19C-M41C 0.340128827297137 A40A-S214A 0.34003366685375 A53C-G59C 0.339503058696077 A40B-S86B 0.339388369035938 L121B-R128B 0.338847853326261 Y11A-V211A 0.338677262433121 A40A-S86A 0.338291957126169 Y11A-M52A 0.337666081211037 M77A-L117A 0.336900468670902 M77B-V78A 0.336433635386711 V78C-M77A 0.336433635386711 A55C-A71C 0.336026902963333 P81A-I110A 0.335421400806975 Y51B-V78B 0.3353952339963 Y70C-D75C 0.335387038331253 Y70A-L121A 0.335292718571329 L168B-D217B 0.334953165517238 T108A-C134A 0.334169579076703 M77B-L117B 0.333841675639796 K60B-S122B 0.333515103054574 Y70B-V78B 0.33276717995586 P206C-S214C 0.332405951207818 D120A-V127A 0.332164473224787 H8B-A53B 0.331693308689349 V39C-L82C 0.331015368943281 S47B-P81B 0.330743789717565 L121A-R128A 0.330164505019781 V112B-M52A 0.329025187170432 G48A-A55A 0.328223524573423 D120C-V127C 0.32755219468919 A40C-G103A 0.327514842672108 Y129C-V182C 0.326757252691855 A55A-A71A 0.326427253251348 M54A-G59A 0.325744734079271 M15C-V111A 0.325022424268919 D120B-V127B 0.324781080887456 S122B-V127B 0.324703690776423 I43C-K210C 0.324701655983833 M54C-G59C 0.323739446801398 G48B-A55B 0.323402702914628 Y70C-V78C 0.323147753652606 A40C-S47C 0.322194299885073 S115A-C134A 0.322043474249584 G48C-A138A 0.322040997134385 S115B-C134B 0.321807203382625 S115C-C134C 0.321676402232933 M106A-V169A 0.321464613978253 Y129B-G186B 0.320954637205672 Y179A-L205A 0.320751453754541 V12C-S47C 0.320423080455525 A40B-S47B 0.32038755367948 C137C-I146C 0.32028806512934 A13B-S47B 0.319899593185115 G103B-A40A 0.319429753313381 Y129C-G186C 0.31921320566128 A68A-S122A 0.318847027610831 A19B-I45B 0.318470255897736 A40A-S47A 0.316767927262731 L85C-M106C 0.316571530779385 H8C-S47C 0.316002884093713 A13A-S47A 0.315791978566327 P180B-S188B 0.31496835870385 V111B-Y51A 0.314923126818555 A19A-S47A 0.314457963328672 A50C-A71C 0.314251938482181 Q58B-S122C 0.313918092888379 Q58B-A71B 0.31247311752646 K60A-S122A 0.311751729202967 Y11B-M52B 0.308694534396551 C134B-T16A 0.30858384137608 A138B-G48A 0.307575598169273 M54B-G59B 0.304871354334418 G48C-A55C 0.304285231001123 M15C-D75C 0.303714444461033 Y11C-V211C 0.302119151344317 S122A-V127A 0.301381038745281 M54B-D120B 0.300991184310794 Q58A-A71A 0.298567642126625 G18A-S214A 0.297980949283818 L168C-L216C 0.296998895339787 S5C-A53C 0.29623068804536 A55B-A71B 0.295487372091154 G18B-S47B 0.293917824825205 H69C-C203C 0.292340641944435 L168B-L216B 0.292177111977852 A13C-S47C 0.292044772473029 A53C-S115A 0.291419107864459 L168C-G212C 0.290741310366323 Y179A-P187A 0.290505079432173 A50B-A71B 0.290322777813202 L83A-G212A 0.290045994939121 A40B-S214B 0.289902717929515 M54C-A71C 0.288276617107512 L168A-L216A 0.287971409515351 R72C-L117C 0.287437623879736 Y73C-I113C 0.287199499633486 L121C-R128C 0.285956920257571 S47B-V78B 0.285761557017774 T108C-W144C 0.284543745816555 V12A-M52A 0.28400734476951 W183A-T199A 0.282734578671349 G59B-A119C 0.281894851694132 I181B-C203B 0.281371648837786 M52B-R128C 0.281365437268785 W46A-V78A 0.280993531420044 I74C-L117C 0.280676819517356 A53B-G59B 0.280573388127223 L7A-G14A 0.280134576302843 W147C-V169C 0.27944048920752 A50C-D75C 0.278691641988071 V12B-G48B 0.278211894603201 G59C-A119A 0.277675762064217 Y37A-V211A 0.276984916916199 L83C-G212C 0.276820644455023 L83A-K210A 0.276707229136989 M15B-I45B 0.275758663710025 V111B-G135B 0.275234449969847 V12C-C137A 0.275220993838069 C137A-I146A 0.274666377462074 V112B-W46A 0.273961105112515 R128B-M52A 0.273254380946396 V39B-S86B 0.272150936616624 G14C-S47C 0.27138914429016 L130C-G189C 0.270582050823692 M77B-I113B 0.270358788734548 G18C-L25C 0.270091340245142 A19C-S47C 0.268775036929751 K60C-S122C 0.267684154424594 T16B-C134C 0.267629568096436 D57C-Y70C 0.267516682505628 I181C-C203C 0.267236777315293 T16B-C137C 0.267108172787057 Y129C-C134C 0.267106504668489 V12B-D75B 0.265988147095054 P180C-S188C 0.265084776908321 M54A-A71A 0.264576022433092 A50A-A71A 0.264512695143061 V12A-G48A 0.264152335397323 L117A-S122A 0.263857744305024 T16C-C134A 0.262297174583031 V112A-D120A 0.261810634097857 W131B-P180B 0.261205296356 G59B-W131C 0.261091170795601 G135A-W176A 0.260649459582018 V112B-D120B 0.259925767356243 Y11B-V211B 0.259901027334336 G14C-L49C 0.259467341520121 V111B-D75A 0.259353615446719 L130B-G189B 0.258638684564406 I43A-K210A 0.258588916494793 G116B-G189B 0.258354595055403 H21B-S214B 0.258049004314373 M52C-C134A 0.255938991234716 A19B-S214B 0.255754439085139 T80A-I113A 0.255255039428988 G135C-W176C 0.254305454852637 D120A-Y129A 0.253953877368523 S47A-Y73A 0.252644520162424 G59C-R72C 0.252544259859274 G18B-S24B 0.252530095504453 T108B-F139B 0.252166025773189 W9B-T199B 0.252058317239309 G59C-H69C 0.251226769323128 W147B-V169B 0.251100050576473 W76A-K210A 0.250751519967547 D57A-D75A 0.250482733567917 L38B-P44B 0.250426306419889 L38A-P44A 0.250392864513971 S115C-Y129C 0.250026319418553 A13A-A55A 0.250010615154846 D57B-D75B 0.249866488859063 Y73A-I113A 0.249745338674786 P44A-L83A 0.249214405481271 M52C-R72C 0.2491740513263 M52A-R72A 0.248956763524398 Q58C-A71C 0.248701403282424 Y129A-V182A 0.248525917953696 S5A-Y11A 0.248095522490092 G135C-W183C 0.247889912543048 W46B-G135C 0.24787519853716 D120C-Y129C 0.247524410251439 T79A-T114A 0.246840147665132 W46C-G135A 0.246682444078901 H69B-C203B 0.246625598366346 M77A-I113A 0.246468132058843 T79B-T114C 0.246022531373591 T108B-T16A 0.245681389228365 W147C-K167C 0.245666850660033 Y73A-V111A 0.245377610025358 Y51B-D75B 0.244521615172482 C137B-T16A 0.244165457836642 G59C-W131A 0.243853520752715 A13B-A50B 0.243735726006157 D120B-Y129B 0.243643045207732 T114B-Q58A 0.243483490151647 T114B-T79A 0.243249550890421 A119B-G59A 0.242814193129704 L83C-P206C 0.242801054433289 T108A-W144A 0.242718336566411 P44C-L82C 0.242699713947727 H8B-G59B 0.242376124665278 G178A-F190A 0.242227531658919 T80C-L87C 0.242094774808736 T80B-L175B 0.241982308716284 L84C-T108C 0.241698275507414 T80B-L87B 0.241680343558668 L143C-T170C 0.241611238919256 G135B-W183B 0.241604447511111 S115B-L49A 0.241483819730483 G135B-W46A 0.240978071206965 Y129B-C134B 0.240645059416655 P187A-L201A 0.240549649919926 G178C-L201C 0.240330011230841 C134B-G48A 0.239593786746594 Y51A-D75A 0.238767986452345 L84A-T173A 0.238705955390445 Y129B-P187B 0.238595125350265 C134A-I181A 0.238376510327804 G14A-L49A 0.238233803004783 P44C-T79C 0.238126252105459 T108B-T79A 0.237796841181603 C137C-P180C 0.237668089353715 L38C-P44C 0.236855854784716 L38B-T108C 0.236322732803325 P44A-L82A 0.235356671736109 Y171C-P206C 0.234763118534303 W46B-M106C 0.234200579237292 G18C-A40C 0.234019054832044 C134B-P180B 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