[Wed Aug 24 18:11:54 2016] >Input file: TM1IW6CGD.pdb >TM segments: A11-31_A35-53_A77-92_A104-122_A127-145_A173-196_A199-220 MAIDEN score = -26.2071 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 ----------- ---------------- I187A-I194A 2.07716894048871 I187A-A192A 1.49695194902019 I187A-V195A 1.415593834459 I41A-L88A 1.16537392640678 A122A-R130A 1.05702958162449 F23A-Y39A 1.00430363492371 D208A-V213A 0.979464494179148 V120A-R130A 0.873194445085743 L203A-D208A 0.868550386246937 K212A-L217A 0.855604061167979 W185A-A192A 0.823960084672951 M114A-S137A 0.780759952928692 L83A-D111A 0.770567765972532 W82A-I115A 0.755130903557192 T117A-I136A 0.741115355612969 L83A-I115A 0.735157029207509 L177A-L207A 0.72251124403017 A110A-M141A 0.683916691900434 Y79A-L119A 0.680720412575403 M114A-I136A 0.675938873881137 P46A-K212A 0.668179042979579 V45A-K212A 0.660723813036542 S189A-I194A 0.660104127730113 G121A-F131A 0.626153431431465 I113A-A140A 0.623479685672682 L107A-I144A 0.618536303066484 L145A-V175A 0.618024920404439 G12A-F50A 0.615943030212406 R78A-L83A 0.615873181161458 G118A-W134A 0.615437566573317 L207A-K212A 0.604740086720529 V206A-A211A 0.595162843013843 V120A-W133A 0.589549412223902 M16A-F50A 0.588219578509228 P87A-D111A 0.587174024092944 G17A-P46A 0.575289534565912 I41A-D92A 0.575106463598566 K36A-I41A 0.573269222971454 M16A-A47A 0.568732045940073 G27A-Y39A 0.560928862858866 G17A-F50A 0.556752317544102 M114A-T138A 0.552372462380798 P87A-L107A 0.547593683891514 Y79A-I115A 0.536581802216831 G121A-Y129A 0.536176322843793 M16A-P46A 0.535545166040915 V30A-A35A 0.526701770457554 L186A-A192A 0.524006603944578 F84A-D111A 0.521041641816665 S210A-F215A 0.520625093794869 V30A-K36A 0.514224179210535 I115A-S137A 0.512483796130711 F23A-T43A 0.509588066382972 G19A-P46A 0.504612707898571 G27A-K36A 0.49795988128562 T86A-D111A 0.493908081486724 W185A-E190A 0.489752144966044 W134A-A139A 0.487924471436689 K26A-K36A 0.48468474621763 T20A-T43A 0.469739879528839 A110A-Y143A 0.46606157836321 Y53A-A77A 0.460580867187853 F50A-D81A 0.459471036790676 V183A-G188A 0.457338100350588 I113A-G118A 0.45128515748928 I48A-R78A 0.436273556446022 L177A-A211A 0.43616643385714 G188A-P196A 0.431637056273295 G19A-T43A 0.431471520704249 L119A-R130A 0.429597062038448 R130A-I136A 0.428897618807028 V45A-F84A 0.428272793723863 V173A-W178A 0.425130201646627 Y39A-L44A 0.419566928046375 P182A-E200A 0.416110097476688 R78A-L119A 0.408019725058411 M52A-D81A 0.400597713421308 V45A-L88A 0.400386684031364 T13A-A49A 0.398978468362565 T117A-W133A 0.393233119317248 P87A-D92A 0.391074494395671 W178A-V183A 0.390129792599203 V45A-W82A 0.38961138412013 V120A-W134A 0.389565891663936 V173A-A211A 0.386167749378509 T174A-A211A 0.380660767632033 P87A-V108A 0.377938042386981 T13A-T51A 0.376909982374059 V184A-E190A 0.376297828526108 L24A-Y39A 0.374637410110476 I113A-M141A 0.372977805890121 L24A-T43A 0.370819560492623 M16A-I48A 0.364549691002832 A180A-A211A 0.36380193840719 M114A-A140A 0.363225560832428 L44A-T85A 0.360799006138628 P182A-P196A 0.358309686632646 Y181A-L186A 0.357255414901188 Y53A-V206A 0.356214135514321 R78A-D208A 0.353945955997125 L15A-V209A 0.348997712602581 G118A-S137A 0.345888141432694 T42A-L88A 0.344413261848959 L21A-K26A 0.343491701003166 M52A-R78A 0.338063025192516 M141A-V184A 0.336433635386711 L11A-M16A 0.334846422935597 A14A-K212A 0.333325663178914 T85A-T174A 0.332355640918661 M16A-A49A 0.330881878637237 G112A-A139A 0.330289189991326 V45A-D81A 0.326012332453931 A40A-K212A 0.326010428219536 D111A-M141A 0.32440715959238 G188A-V195A 0.322990191307569 G19A-V213A 0.322425039149322 V173A-D208A 0.317766965589769 A140A-S179A 0.317732146490255 Y22A-G29A 0.316869665406133 R130A-G191A 0.313845702882765 A77A-G118A 0.313826607816392 V184A-E200A 0.313766200434486 A14A-F50A 0.311161850676603 G112A-T117A 0.310729545876633 A139A-S179A 0.310164931415879 T43A-T51A 0.309644899776815 T20A-L44A 0.30960481721619 G19A-G27A 0.306494075133187 I41A-L89A 0.30426553552039 F131A-I136A 0.303663741558999 G12A-M205A 0.299798434133815 V173A-Y181A 0.297671249896975 G12A-S210A 0.297269048017648 A106A-D111A 0.293332852030535 G19A-S210A 0.293083752985009 G109A-S137A 0.286956534053663 T20A-A47A 0.286632965131199 L90A-G109A 0.286325682458104 G27A-G216A 0.285500497389386 G188A-L203A 0.28507380711001 T117A-W185A 0.285071404007296 T85A-W178A 0.283631621908932 L44A-A49A 0.283380864191935 G109A-A139A 0.282822132635142 L105A-A110A 0.281082228892307 G12A-Y53A 0.280815742679659 G121A-W134A 0.280239152525667 F23A-T42A 0.275061139893946 F38A-T43A 0.274277513581577 S128A-A135A 0.274089916418913 D111A-G118A 0.272715422314995 D92A-G216A 0.27124591495398 M52A-A80A 0.269145077706128 F204A-V209A 0.268664740651383 Y53A-D208A 0.268634190523099 A77A-A122A 0.266294995378075 D81A-V209A 0.264755891547777 S189A-P196A 0.262759932754834 P46A-Y79A 0.260092894215016 I187A-P196A 0.257753016394728 G118A-W133A 0.255759140544623 I113A-I136A 0.255338121631471 D92A-V173A 0.252737116192735 T42A-T85A 0.25152952696612 F38A-D92A 0.250679718503388 P87A-T174A 0.250462969036904 D92A-D111A 0.24895074888692 T42A-K212A 0.246919815711437 T13A-T43A 0.246729006932833 M114A-V184A 0.245239150276163 M114A-R130A 0.245056673716286 R78A-M114A 0.244555077293476 L142A-T174A 0.241674231474199 R78A-M205A 0.241632057547263 Y53A-R78A 0.239123553368338 P46A-T85A 0.238420594000018 W82A-M141A 0.238243290808346 M16A-K212A 0.236990826551733 P46A-L88A 0.236339413441652 T20A-V25A 0.236119406746931 L83A-T117A 0.235746500744428 P46A-W82A 0.235694556389017 Y181A-V209A 0.235590920553701 G118A-Y127A 0.235454843243684 L15A-T51A 0.234808971683601 M114A-W185A 0.23431520451041 A49A-D81A 0.234032109815327 T20A-L217A 0.233281523145197 I104A-G109A 0.232006331557951 L186A-P196A 0.230701560915355 Y39A-P87A 0.230132550075289 D111A-A140A 0.229945424144778 I48A-Y53A 0.229742688991677 T138A-Y143A 0.228445329125696 L177A-D208A 0.225409195384614 Y22A-K212A 0.223744468929217 Y143A-V176A 0.22177709364667 D111A-G116A 0.220886831008635 V45A-G214A 0.220505312239327 A49A-F204A 0.219171985852143 M114A-L119A 0.219128933321702 W133A-G191A 0.218794191405086 T42A-L89A 0.218006946452965 S179A-A211A 0.216815183746387 S137A-A180A 0.216569103180165 A122A-E190A 0.216527225164834 G116A-A135A 0.215878313808227 L107A-Y143A 0.21524326317786 V195A-E200A 0.215010759595572 S31A-A40A 0.212522976607457 T86A-G116A 0.211651005412651 K26A-L220A 0.211412417009797 T13A-P46A 0.211325085811686 V183A-G193A 0.211285666674627 G109A-T138A 0.211233172431538 Y181A-V195A 0.211170440060678 T43A-L217A 0.209848629351702 Y39A-L220A 0.209468432252247 L15A-G214A 0.20919942542014 L177A-V206A 0.208379405060837 W134A-W185A 0.20789802060648 V213A-L219A 0.207434335059073 V175A-S210A 0.207283702352239 F84A-G109A 0.205456324020243 M141A-V183A 0.204525983789845 P87A-G116A 0.204243721629062 K26A-Y39A 0.203581312438164 A35A-D92A 0.203404701194107 L88A-G216A 0.201149877604028 M52A-V206A 0.201122221508303 V45A-T85A 0.200783064963538 G188A-I199A 0.199551272371029 D81A-T86A 0.1989287569527 F215A-L220A 0.198893682648515 S31A-Y39A 0.198724878678055 K212A-I218A 0.19766529273638 A122A-S128A 0.197593460431905 V184A-D208A 0.197459822855754 G118A-L186A 0.196577059313169 V173A-G216A 0.195484459285782 L18A-V213A 0.194923720491194 L88A-V108A 0.194859057050527 I41A-V213A 0.192741706305853 Y22A-F38A 0.192687647600984 P182A-T201A 0.192111293040675 P87A-Y143A 0.191104425018916 L207A-V213A 0.190966739618134 V120A-S128A 0.190759036830741 L186A-G193A 0.190384588428912 G116A-P182A 0.189689928911262 L89A-M141A 0.188818850216549 D81A-K212A 0.188670984281342 A49A-D208A 0.187103139949321 A122A-S137A 0.186823925476459 T51A-T85A 0.186639533829617 M114A-L145A 0.186261145374085 A47A-T86A 0.186234684855624 Y127A-S189A 0.184709672596896 P46A-L89A 0.184081455652179 G12A-V213A 0.183605041637348 Y39A-K212A 0.182911549918066 G193A-I199A 0.182155288853382 L18A-K26A 0.180402916900877 T117A-E190A 0.180254008903885 Y129A-S137A 0.18015238028925 G121A-T138A 0.179929914384612 G116A-Y129A 0.179552704156843 L91A-G109A 0.17951127901648 L15A-T20A 0.1782560919156 A180A-D208A 0.177605304861395 K36A-L91A 0.177533550991678 T85A-G109A 0.176850768331085 F50A-K212A 0.176473918137527 Y79A-S137A 0.175824000838155 L105A-M141A 0.174985255289696 T13A-A77A 0.174604686840286 T138A-T174A 0.174480606753102 W82A-T117A 0.174429023192749 G17A-I48A 0.173874309603185 G118A-A140A 0.173174494176223 P46A-T51A 0.173156275950685 W185A-E200A 0.172976162991708 Y181A-S210A 0.171729697217765 A40A-G216A 0.171461224563449 M52A-A77A 0.170561515152056 Y22A-A47A 0.170554454162639 F38A-K212A 0.169989446680132 T43A-L220A 0.169043110140475 T174A-P182A 0.168492335883093 G121A-A140A 0.167627704487942 G112A-A122A 0.166342349913329 Y39A-G214A 0.165726152908147 G17A-A40A 0.164764189872254 G121A-G188A 0.164690434628151 T174A-G216A 0.164658859563974 L90A-W178A 0.164397322938998 T42A-F84A 0.164332088652876 Y127A-G188A 0.164139606139784 G118A-A192A 0.163514797009324 R130A-P182A 0.162891676868882 G121A-Y181A 0.162887398381913 T43A-D92A 0.162528276179556 E190A-V195A 0.162395785816819 G121A-A139A 0.161129567147401 M16A-L21A 0.16085572428271 A77A-G112A 0.160438588442152 D92A-T174A 0.160206341774552 Y79A-P182A 0.15965760063005 Y127A-W133A 0.159625018808233 I48A-T85A 0.159148829079904 L83A-G112A 0.158943147471319 W82A-L88A 0.157967934453894 W134A-W178A 0.157497147421185 A77A-F84A 0.156185453459058 G12A-K212A 0.155732434340153 L15A-G216A 0.155272854880557 I48A-D81A 0.154811521508214 S137A-W185A 0.153943226151659 K26A-G216A 0.153867215099845 A140A-V175A 0.153750019041528 G121A-G193A 0.153538639605121 T42A-L220A 0.152435562278276 L15A-P46A 0.151819428894582 I104A-M141A 0.151679541784657 L177A-W185A 0.151508389856446 L90A-L107A 0.151340836615968 R78A-P182A 0.150593172852353 A35A-I218A 0.150168530020302 V183A-F204A 0.149887150771259 G12A-A49A 0.14978450912015 A47A-R78A 0.14956871139748 V175A-V183A 0.149543938153612 A192A-I199A 0.149541098009338 T86A-L107A 0.149195227933866 A180A-V209A 0.148960535571111 S128A-A192A 0.148737497982207 V45A-S210A 0.147373757835137 T43A-P87A 0.147209644588401 G12A-A47A 0.147208841847481 E190A-I199A 0.14705602086857 G112A-L142A 0.146528878894518 T51A-W82A 0.146364213976183 T138A-W185A 0.146294899035201 K36A-L44A 0.145597344825501 A14A-M52A 0.14514195705354 L83A-V108A 0.144849086322749 D92A-V213A 0.144611183605547 D111A-W178A 0.144101820739825 G191A-E200A 0.143261467635385 Y39A-L90A 0.143208749574548 G121A-V132A 0.143127924291679 M28A-A40A 0.142577019611634 F50A-V209A 0.14250790807935 M16A-A211A 0.142392951513312 I194A-L203A 0.141038382032116 A77A-V120A 0.141005988433449 F38A-V45A 0.140835190148776 M16A-V25A 0.14083313739241 M16A-I41A 0.140558876636267 S189A-F204A 0.139585776600552 Y127A-E190A 0.139138478911165 M141A-A180A 0.13897712082986 F23A-A35A 0.138795288846943 W82A-L107A 0.138536128169127 W134A-Y181A 0.138264794616951 V175A-D208A 0.13796109539242 P87A-G216A 0.137681648828211 L119A-Y181A 0.137670182507459 V184A-I199A 0.137433701494592 A180A-M205A 0.136551328092105 L83A-M141A 0.136489999345883 M114A-Y129A 0.136283293192111 G118A-R130A 0.136268343353756 P46A-L217A 0.135362103220693 A180A-I199A 0.135247119744605 K37A-L90A 0.134583769347377 V108A-S137A 0.134101013472211 T86A-T138A 0.13307548942034 L24A-K37A 0.132897088151435 G12A-R78A 0.132657691387043 G17A-A47A 0.131741738166297 T20A-T85A 0.131677077962361 A139A-Y181A 0.131554484036106 S128A-S137A 0.130675227996444 T43A-I218A 0.129962416755294 I41A-I218A 0.129894690478606 G17A-M205A 0.129720956353695 V176A-V184A 0.129682506180521 L107A-S137A 0.129670721097655 V175A-L207A 0.129308469454676 G17A-K212A 0.128813535135769 T86A-T117A 0.128607745591966 L91A-L145A 0.128320776716863 L11A-I199A 0.127512488149494 I194A-T201A 0.127479130222491 L90A-I104A 0.127013542751286 W133A-P182A 0.127013217487371 Y79A-Y181A 0.126948334256631 Y127A-I187A 0.126874829896014 F38A-L220A 0.126182694938153 Y181A-A192A 0.1261604109401 Y181A-P196A 0.125516087395987 A80A-V120A 0.125473261743163 A80A-G118A 0.125207142675746 P46A-V206A 0.125017961982941 A110A-S179A 0.124891682016846 E190A-P196A 0.12482647033855 T174A-S179A 0.123709275659944 G12A-E200A 0.123675181473843 T86A-D208A 0.123481590503521 I41A-G214A 0.123439895329033 L18A-V45A 0.123185093018282 T85A-I113A 0.123034484242807 T42A-G216A 0.122919089168431 G19A-I218A 0.1228080139399 A47A-A80A 0.122730250161911 S179A-V206A 0.1224991627318 L21A-K212A 0.122130211280859 L24A-L219A 0.121543843482335 V184A-I194A 0.121537965192577 L44A-L217A 0.121479553876097 M16A-Y39A 0.121355365711808 S137A-V183A 0.12120826675758 I113A-A135A 0.121126837222409 L89A-L220A 0.120925073717071 L105A-M114A 0.12067087237258 A180A-S189A 0.120344974081547 L119A-S189A 0.119897288888505 V25A-K36A 0.119839614280281 A47A-W82A 0.119719895943673 F23A-G214A 0.119649611489048 A40A-L220A 0.119479746925289 G27A-L217A 0.119108580144647 A135A-W185A 0.119024827718452 L18A-Y53A 0.118844039804867 M52A-V209A 0.11865420982503 G17A-T42A 0.118650994938546 W82A-K212A 0.118098404013847 L24A-A47A 0.117467967618178 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