[Wed Aug 24 18:24:00 2016] >Input file: TM4J72CGD.pdb >TM segments: A14-32_A38-57_A69-86_A93-110_A205-222_A226-245_A251-274_A301-318_B337-355_B361-380_B392-409_B412-429_B524-541_B546-562_B570-593_B598-615 MAIDEN score = -83.3864 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 ----------- ---------------- P363B-M548B 1.93527041612053 P40A-M229A 1.91713550039158 I253A-A318A 1.21407424411957 V340B-A528B 1.16800839374669 F73A-S236A 1.03348278758517 Y38A-F220A 1.01395744493941 Y361B-F547B 1.00180570503434 Y38A-F228A 0.985887112496881 F76A-V232A 0.98375789734695 V26A-F31A 0.983493688536738 V374B-F525B 0.935583859736614 F81A-V232A 0.909717772035519 F399B-V551B 0.899265835927846 V51A-F206A 0.898188967936635 F396B-S555B 0.853657027981123 F404B-V551B 0.850122568412211 I45A-V232A 0.832615696037667 I600B-W605B 0.815374234662848 I402B-D550B 0.809076719277911 P363B-F547B 0.786682049670802 W219A-K599B 0.786055640798516 T364B-F547B 0.781761284718325 V17A-A209A 0.730883943334995 Y361B-F539B 0.730042581499271 I303A-W308A 0.72844850106841 V575B-L611B 0.717727539051301 I94A-K99A 0.715442625041917 T364B-V551B 0.714115604263075 V392B-T562B 0.713730340254112 K302A-W538B 0.709518531865741 V256A-L314A 0.706394920977833 T78A-V232A 0.694288092000036 L23A-V50A 0.685996700712923 V51A-L210A 0.684123045641671 F73A-I237A 0.672295334398131 F396B-I556B 0.671850819034387 I79A-K99A 0.665431282429675 W82A-I94A 0.663309033291089 L346B-V373B 0.661453884299847 I316A-F337B 0.659931936953253 V340B-F527B 0.658706091611523 T378B-V524B 0.658052578303042 F14A-I613B 0.653984886755026 V17A-F208A 0.649344132967172 F73A-A239A 0.648325341656474 F399B-L554B 0.647090550117337 I413B-K418B 0.643705971795384 F396B-A558B 0.641616256714309 V392B-A558B 0.631747152485326 P40A-F228A 0.629478741943305 A16A-V211A 0.628634310217048 A255A-V262A 0.62636480612667 G366B-F547B 0.624600646470857 V17A-V211A 0.623111853895935 G43A-F228A 0.621821007457406 T15A-F208A 0.619518679622082 T39A-F228A 0.616472284359388 G366B-F536B 0.61508844179517 F14A-F208A 0.614856022869642 V69A-T243A 0.611398075346449 T41A-V232A 0.611088684700392 T347B-F536B 0.604463893028495 R306A-L537B 0.603803451913349 T401B-V551B 0.600303871322512 F252A-A257A 0.599459366867172 F571B-A615B 0.599185224334468 A20A-L210A 0.594944251136312 T41A-M229A 0.593888148193782 S395B-S555B 0.592816184929491 I402B-D407B 0.590723765849022 I402B-K418B 0.589340833448885 V340B-V530B 0.588211098888779 W219A-V602B 0.586955168746032 S267A-I272A 0.584412635491003 I45A-G233A 0.581314509470859 T41A-F228A 0.580509109901961 F337B-F527B 0.579511170857836 T338B-F527B 0.577187272704698 V69A-A239A 0.577150497349284 V305A-W538B 0.573746772236708 E583B-I588B 0.572520857141335 F527B-A532B 0.568890512473359 V46A-A213A 0.566387541669439 I79A-V232A 0.560661925150971 T347B-V369B 0.559410879981887 A16A-F206A 0.558455156028992 W308A-L313A 0.556350861935151 I402B-V551B 0.555529729446446 V86A-I94A 0.555333749180812 T364B-M548B 0.551915754146108 I47A-G233A 0.551877069768764 E251A-V256A 0.551663424237712 I368B-V551B 0.550248271437474 F399B-D550B 0.548771121133534 F76A-L235A 0.548620719460314 R306A-I312A 0.543875487860718 A576B-L611B 0.542506736285748 F76A-A239A 0.540243353422754 L397B-S555B 0.532891679718849 A245A-F254A 0.532465054134095 F399B-A558B 0.531343177641202 T24A-F217A 0.530724296713306 F220A-Q226A 0.529794816900906 F396B-L554B 0.529754758327905 F345B-L350B 0.527427796985785 I572B-A615B 0.525936541338149 A339B-V530B 0.524865016294596 S395B-S425B 0.520759697768199 S72A-S106A 0.519756429740783 I79A-D231A 0.518726970150164 P301A-R306A 0.516211704605454 R603B-I609B 0.515697571832668 A339B-F525B 0.514707486568768 F254A-A318A 0.507658950447124 T338B-A343B 0.504199546239258 F252A-A318A 0.504112226971608 S398B-S425B 0.502039741355608 A16A-T55A 0.501173976127155 F573B-A615B 0.497996006841218 K97A-L102A 0.4966395872536 A339B-T378B 0.494473419668907 P363B-D550B 0.493057618007656 S75A-S106A 0.485488676957236 T55A-A209A 0.484953329080406 M42A-M229A 0.484606176909371 Y38A-N221A 0.480248872047338 V373B-A532B 0.47969521825806 L215A-I606B 0.478554293741658 K599B-M604B 0.478154565234773 K302A-M307A 0.476848557848479 V369B-A532B 0.472163885294578 S541B-M546B 0.47116812108443 L27A-I32A 0.469627709489994 P40A-Q226A 0.469103879511995 I309A-L534B 0.468868027442978 I79A-D84A 0.467970879661479 L70A-S240A 0.467580026089582 S54A-V205A 0.465359307934947 M42A-I47A 0.465240277806533 V575B-A612B 0.462454099766846 A20A-S54A 0.459963658188547 M365B-I370B 0.45773797287772 T362B-F547B 0.45772001179868 I49A-S54A 0.457075876207473 A20A-V211A 0.454446041750848 A343B-S377B 0.454355161472324 P598B-R603B 0.449808270808179 E264A-I269A 0.448261062616341 T378B-F525B 0.446644305837558 V50A-A213A 0.44474630321524 T55A-F206A 0.444517725398249 G400B-S555B 0.444374989179879 L74A-S236A 0.443071163601515 L371B-F396B 0.442572161041463 T362B-M548B 0.442277454548813 F73A-L235A 0.442226041857394 L218A-R603B 0.441944299224245 L48A-F73A 0.440485715870929 S72A-I237A 0.438608339615462 A343B-F527B 0.43556740569813 S395B-I429B 0.433731497358391 F76A-S236A 0.433584754198561 F76A-D231A 0.432985739341452 S398B-S555B 0.432814902685609 F399B-S555B 0.431041206994267 V579B-S608B 0.430948409020488 T401B-D406B 0.429292044215464 V51A-A213A 0.429067452714721 S54A-F206A 0.426392917313099 P40A-D231A 0.424081025258257 F21A-L215A 0.423888182690783 F22A-L27A 0.423320137278925 F344B-L534B 0.42325347074296 V374B-A532B 0.423006085396522 S377B-A528B 0.419903017275334 M365B-M548B 0.418185719023946 L393B-S559B 0.417280157751944 F344B-A532B 0.417065755375472 S586B-I591B 0.415611826208787 V69A-V244A 0.415346183784785 S75A-S236A 0.413714540466394 S72A-S236A 0.413427996069357 V369B-V374B 0.413153351104589 I47A-M229A 0.412506302883527 F14A-V205A 0.41214868520167 V50A-A209A 0.411459562029015 V46A-V51A 0.41050761068049 V256A-A315A 0.408341753830838 V374B-L529B 0.404160481194742 I370B-M548B 0.404154312124785 A561B-E570B 0.40054467078517 A343B-L529B 0.400500915423599 T39A-M229A 0.400201168348345 F21A-A213A 0.39758602653052 A343B-V530B 0.397112227801111 V349B-F354B 0.396117685075929 V340B-A532B 0.394652355695451 V373B-A528B 0.392834199918807 V374B-L379B 0.392763487297943 I32A-M42A 0.392513659305162 V104A-L109A 0.391117032867531 I19A-G212A 0.389586705180974 V17A-A213A 0.388183383476574 A574B-V581B 0.387372842819375 F261A-I266A 0.387001885025974 I370B-A532B 0.386782242671843 L350B-V369B 0.386225524695598 T347B-A532B 0.382744676064789 T24A-V46A 0.380696251380537 S377B-F525B 0.380508331860552 I47A-A213A 0.379700287995086 I368B-G552B 0.378453218199598 F580B-I585B 0.377279681555335 G77A-S236A 0.373662830189191 A245A-A258A 0.373349844395515 T24A-A213A 0.372818132789814 F404B-D550B 0.370119770813492 V423B-L428B 0.368874862183592 G400B-V551B 0.364675063672701 S311A-I316A 0.363538575854841 F220A-K599B 0.363392699144199 V340B-G531B 0.359846963859664 T52A-L70A 0.358290328577959 P363B-M546B 0.355178036942683 A343B-V374B 0.353696179384773 K416B-L421B 0.352967394348508 A242A-A257A 0.352289164114205 T378B-A528B 0.351960310604891 V17A-L210A 0.34719454665006 T15A-A20A 0.34546176186759 A16A-C207A 0.343360847783573 A20A-F208A 0.341585431865377 L341B-A528B 0.340366579192419 S395B-I556B 0.340318121145623 A577B-S608B 0.339789872818132 V26A-Y38A 0.339060522364484 K302A-F539B 0.337373424789345 M307A-I312A 0.335176259421235 E570B-V575B 0.33430596959892 A339B-G533B 0.330119983086766 V340B-L529B 0.32924872814184 L350B-I355B 0.328460530897576 L48A-V232A 0.328285818460311 A16A-G214A 0.327834105235475 F396B-S559B 0.326340692401626 C526B-F573B 0.32533863187775 I370B-G552B 0.324115105598485 V17A-G212A 0.324093379241205 A426B-G557B 0.322958731375011 I317A-F337B 0.320180883158649 L18A-A209A 0.316847910123714 S108A-A239A 0.31665425311045 A255A-S311A 0.31522583783887 I342B-G531B 0.31507066489731 G44A-G212A 0.315037804878149 G43A-G212A 0.312289545989175 G367B-G531B 0.30772393613327 V256A-I317A 0.307170562734144 I372B-S377B 0.305374778700738 V530B-M546B 0.304862474369582 S608B-I613B 0.304089302462208 V86A-G93A 0.30140822741045 S236A-L241A 0.300088072479364 L27A-V46A 0.300058346787992 S222A-K302A 0.299918789651684 A576B-I613B 0.298381358480558 A339B-C526B 0.298219234255185 A339B-L529B 0.298137163237432 I19A-V50A 0.298135929789518 A245A-I253A 0.297798519838059 V51A-L56A 0.296916738090562 G80A-S95A 0.296491410798121 A257A-L314A 0.296475366473238 L71A-F76A 0.295585799077037 I607B-A612B 0.295210504757297 L313A-A318A 0.295181914386668 A258A-L314A 0.29465392566334 F73A-S240A 0.293580872255207 A576B-L610B 0.293079790084155 N540B-F547B 0.292850871052038 C207A-I613B 0.292517849900226 V205A-L210A 0.292175740716518 V575B-I614B 0.29197237669601 G533B-G549B 0.291430359233035 I556B-A561B 0.291048479584889 L348B-G533B 0.290470347542593 L48A-G230A 0.290358426889585 I269A-Y274A 0.289952272843114 M604B-I609B 0.28919316467551 L102A-A107A 0.288919245747134 G77A-S106A 0.288790383059878 F399B-G552B 0.28856784067202 S222A-V602B 0.28829255859791 T78A-D83A 0.288073431509041 P352B-Y361B 0.287957385711757 V392B-L397B 0.287807051292763 L71A-G238A 0.286786171767542 V305A-L537B 0.285763140725189 S377B-V524B 0.285760307054888 W538B-M548B 0.285672584207067 A257A-L313A 0.284671996820328 T41A-D231A 0.284346865785855 V46A-V232A 0.283632474129805 P29A-W219A 0.281660738186702 T39A-W219A 0.281580147325319 L215A-R603B 0.281145374364531 V46A-D231A 0.280495740619587 L25A-G216A 0.280489883665351 L421B-A426B 0.280397502240046 A16A-L210A 0.280267876806078 V86A-D231A 0.280210240316963 V409B-D550B 0.280080182364076 A577B-L611B 0.280001724956434 L394B-G557B 0.279978408850156 L25A-G214A 0.27974657994009 F337B-I342B 0.279044420636129 T347B-V373B 0.278760635708027 G400B-S559B 0.278638789957208 F208A-A213A 0.278543162671768 G77A-S240A 0.278488228603242 L610B-A615B 0.278344594356801 L27A-G44A 0.278052464448133 V51A-V211A 0.277828630072624 G367B-L529B 0.277579921011985 L70A-G238A 0.277419024790054 G367B-L397B 0.276934755263521 M365B-W538B 0.275341877646348 L218A-V602B 0.275287514072554 G43A-L215A 0.274917160853981 L393B-G557B 0.274873215538582 P363B-S541B 0.273355355733624 V374B-V524B 0.272348225845547 P29A-Y38A 0.272294800770767 D231A-G238A 0.271974619173768 G214A-S222A 0.271043070641879 I316A-C526B 0.270569808348849 G44A-L210A 0.270307303031074 V374B-M548B 0.269947646335286 Y361B-N540B 0.269469161412371 P301A-S541B 0.269179550447871 F344B-G533B 0.267993976189604 Y38A-Q226A 0.266945806181701 L393B-S398B 0.26559311412982 G400B-D407B 0.265415983588628 F337B-V524B 0.265225545688622 L350B-G367B 0.26432619158333 T15A-A209A 0.26412891749802 G535B-N540B 0.263963020077562 L394B-F399B 0.262610862579516 I253A-I317A 0.26206739569874 L341B-S377B 0.261247418240729 D84A-G230A 0.261173848033152 R306A-L534B 0.25996301052032 W605B-L610B 0.258997795422513 G44A-M229A 0.258649517119019 G216A-W605B 0.257398478209993 L348B-G535B 0.257045658937677 A245A-A257A 0.256092557884444 P352B-W538B 0.255701364240742 A257A-S311A 0.255469044760593 S427B-A558B 0.253957994857741 L25A-S30A 0.253506568084354 G533B-S541B 0.253090137185245 I19A-A209A 0.251632600615567 G400B-S425B 0.250818583073817 L48A-G233A 0.250685815327396 Y85A-D231A 0.250497182168735 I47A-L210A 0.249732084429684 I310A-A315A 0.249313401769723 D550B-G557B 0.249283268731537 G44A-L74A 0.249225568595286 G44A-Q226A 0.249142643106809 W308A-G535B 0.249107902948823 M548B-S553B 0.246241621219071 V232A-I237A 0.246069307359516 N221A-P301A 0.245478763670881 S395B-L560B 0.245235122900667 T55A-V205A 0.245154370350174 M229A-S234A 0.245097718810291 I47A-T52A 0.245023104891118 T338B-A528B 0.244132949756622 R603B-S608B 0.243726225376649 F217A-S222A 0.243659282205992 G80A-G238A 0.243352115552174 G238A-G259A 0.242743210754738 G77A-D84A 0.242225847327706 T347B-L376B 0.242220695541857 L18A-T55A 0.241606758726822 T338B-L379B 0.241584705973295 T15A-T24A 0.241546447783494 A257A-I316A 0.241022176070984 S95A-L101A 0.240626582993432 V17A-V51A 0.240106310256197 C207A-T243A 0.239469259279567 Y38A-F217A 0.238433965185832 T364B-D550B 0.238429682930415 Y85A-G93A 0.238415889473773 A257A-I312A 0.237536482910907 T15A-L56A 0.23717962844766 L218A-Q226A 0.236292486028683 L371B-G549B 0.236072950804678 F571B-A576B 0.235338383761825 F81A-D231A 0.235303879553584 A20A-V51A 0.235261375010063 N540B-M546B 0.235106701061281 L393B-S555B 0.234100026754573 S54A-A209A 0.233815914968456 T338B-L376B 0.233041104124133 A16A-A209A 0.23294326412598 L529B-G557B 0.232633533682667 G366B-G531B 0.232060303936438 V244A-E251A 0.231422886448067 V530B-I556B 0.231419094758545 T15A-L53A 0.230932909589488 G366B-W538B 0.230418444691233 C526B-T562B 0.230400468944885 G44A-F73A 0.230023880308205 T347B-T364B 0.229571151456852 L70A-S75A 0.229568754042011 G214A-F228A 0.228936078568886 A107A-G238A 0.228138687346601 I110A-V244A 0.227740494176634 G43A-M229A 0.226325192973771 Y38A-G233A 0.226283457580715 T401B-T417B 0.225741925232221 P352B-P363B 0.225584281259473 Y361B-F536B 0.222649917186336 F399B-F404B 0.222230789423332 G44A-N221A 0.222146253233408 L218A-P598B 0.221967557534918 P29A-T39A 0.221519254770451 F76A-F81A 0.221338233938249 G366B-M548B 0.220441715511735 F76A-Q103A 0.218667271895352 G367B-M548B 0.218608791717889 Q226A-P598B 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