[Wed Aug 24 17:26:01 2016] >Input file: TM3WBNATD.pdb >TM segments: A24-38_A61-76_A100-115_A143-158_A166-180_A202-219_A246-260_A283-298_A327-341_A366-380_A395-414_A424-440 MAIDEN score = -105.9956 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 ----------- ---------------- G108A-F148A 3.9649067369952 S24A-M296A 1.61152436854891 P248A-L396A 1.53467904933483 Q407A-I429A 1.29172767051608 A411A-V425A 1.21554875472171 L369A-W426A 1.169419965791 I400A-V405A 1.01170019237697 F372A-V430A 0.995231838003704 I290A-E331A 0.87457393126356 I338A-L366A 0.836476666150327 A411A-W426A 0.835306914076 I149A-V207A 0.815666620867116 L369A-I427A 0.811596783725607 L143A-L203A 0.800044061291348 T112A-F148A 0.796516947116792 I290A-L373A 0.784314187241986 M339A-L366A 0.768930340220007 P292A-A327A 0.748016870863773 N153A-I213A 0.740879003968568 L375A-M434A 0.722717022689999 L101A-V155A 0.715368259239816 F414A-V425A 0.706558089593876 L105A-F148A 0.700507480347926 Q34A-V174A 0.684298972421297 F401A-A436A 0.677117479407932 L332A-V374A 0.672979761940962 F378A-I438A 0.666882471655232 T403A-V408A 0.665606119393176 V33A-V174A 0.663371582438691 M296A-A327A 0.650472380289353 V109A-F148A 0.648916712988928 F410A-I431A 0.646914340589791 N157A-A172A 0.64619795600149 L251A-L396A 0.625658925881906 T112A-L144A 0.624992086510428 G108A-F152A 0.621048479534993 I25A-G295A 0.620024044674969 M28A-L294A 0.614238657011724 F328A-V374A 0.614171560433887 M406A-A436A 0.613290548891963 V335A-L373A 0.610073080096139 A70A-F152A 0.603641978780097 M28A-P292A 0.601255513140218 L340A-R367A 0.596286826110594 Q407A-V430A 0.594963623197017 F401A-M406A 0.59354083609716 L369A-V430A 0.589832066022598 L69A-S250A 0.589633476898577 Y412A-V425A 0.589209650522371 M28A-V291A 0.585392984057442 R402A-I429A 0.580527859184001 M27A-A169A 0.564856408886953 F328A-P377A 0.563880445436601 Y37A-G178A 0.560518591158153 F372A-M434A 0.558445808570966 M115A-L144A 0.556418962325948 V408A-I429A 0.550188257566409 G379A-V439A 0.536971049946073 N157A-I213A 0.529857944337359 F328A-L375A 0.529423825415833 A297A-M380A 0.524195479103612 L375A-N433A 0.521694998274756 Y37A-N180A 0.521034358951857 S249A-S395A 0.516663861255284 G176A-V208A 0.515934213952267 T368A-I427A 0.509116240496976 F152A-S210A 0.508426315623587 A172A-F212A 0.507516744583602 L369A-I429A 0.504263126739256 R402A-V435A 0.503345909377075 N153A-M206A 0.493647111401434 M27A-A298A 0.489101094864591 L107A-F148A 0.486877153692421 I338A-R367A 0.480819763685046 S252A-S395A 0.477719668645988 A68A-L251A 0.477707479516969 L73A-V155A 0.466291127647226 M256A-I400A 0.465387743338398 L73A-S250A 0.464944766317628 S104A-F152A 0.462856202076212 A71A-S250A 0.457172496727849 G289A-V335A 0.457033420889829 I111A-L144A 0.45660280045366 I29A-M170A 0.456537947227998 L73A-N154A 0.45530615824534 V33A-G178A 0.454477154676939 L73A-S100A 0.452156498824005 L105A-F152A 0.448055858059246 I338A-P370A 0.441774577927035 L101A-F152A 0.440650904943478 F414A-I427A 0.432720120824081 L73A-S104A 0.432711657973448 L73A-L247A 0.425772506949039 M28A-I293A 0.422456807108103 A214A-V219A 0.421685487407647 I25A-M170A 0.419175717180143 R402A-A437A 0.418690243649935 V75A-V155A 0.416169661868845 I66A-A147A 0.415406978037214 Q407A-I431A 0.4149894738527 G379A-I438A 0.412536798442847 F372A-I429A 0.409022926816088 M256A-L404A 0.408588791850129 T376A-M434A 0.408221305595325 A71A-V155A 0.405343445942039 A71A-V151A 0.403117993492277 P377A-A437A 0.401029865899321 S255A-I400A 0.400605286971006 L105A-V151A 0.395613730612731 A70A-V155A 0.395525130398414 P292A-I330A 0.394216910682271 M406A-I431A 0.387699039293803 L73A-S249A 0.386696940957084 A172A-I213A 0.386067713941631 M64A-L254A 0.383970246525446 V408A-G432A 0.380352563127197 F410A-I429A 0.378193516763866 L73A-V151A 0.375650945442541 F378A-G440A 0.370678375707124 A71A-A298A 0.370132730766116 S255A-T399A 0.36904461703601 I66A-I111A 0.368788304341405 M260A-W426A 0.368315601202799 F410A-G428A 0.36820391936911 M27A-A166A 0.366724520634929 I413A-G428A 0.365912725388903 P61A-S255A 0.364651778029577 S177A-S205A 0.363054046004802 I111A-F148A 0.362480532005926 T286A-L369A 0.361636031634967 S255A-L404A 0.360656509583784 T286A-L373A 0.359769165942208 P26A-M170A 0.358003152521819 T112A-G146A 0.356747271098464 L143A-T202A 0.35661844785607 S24A-A298A 0.356071086910713 A68A-L254A 0.354486831042341 L175A-S205A 0.351497593873106 I67A-I150A 0.348955464672389 I25A-M296A 0.348613541894034 F372A-I431A 0.347677143032288 N154A-R168A 0.345010873441421 I149A-M206A 0.344754999566343 V335A-V371A 0.343968145104887 G108A-I149A 0.343528761235641 A68A-S249A 0.343413384672988 M406A-I429A 0.343304831007623 M27A-G295A 0.341471871453336 A411A-G424A 0.339874948737726 L398A-A436A 0.339851980936099 G30A-M170A 0.338025330300549 A169A-A298A 0.337880414357312 L69A-V151A 0.337461965500717 T35A-L288A 0.337235413230292 T368A-W426A 0.336719221713477 M256A-V291A 0.336433635386711 M115A-V151A 0.336433635386711 V75A-S249A 0.335373159455503 M31A-G295A 0.334952952338704 V408A-G428A 0.334129501818458 G379A-A436A 0.330389222150525 A411A-I427A 0.329288520101564 A169A-G295A 0.328718481037049 V33A-M173A 0.327355344764383 S24A-A297A 0.324802894996588 G30A-L171A 0.322258200070989 P26A-N157A 0.321951934876355 G74A-A169A 0.321623765364551 M170A-V208A 0.317570205894648 A71A-G108A 0.316158531528953 S24A-A166A 0.313370902003223 G158A-A172A 0.312831081547792 S210A-Y215A 0.312082121498142 M256A-N433A 0.311854788255469 G72A-G156A 0.311133926505795 I293A-E331A 0.310688083814382 G108A-I150A 0.310535535913926 T399A-L404A 0.309988453007348 I258A-L404A 0.309630807813811 P248A-Q253A 0.307005049187903 M339A-T368A 0.305684388949778 M173A-T209A 0.305537710601139 R402A-V408A 0.305439830349652 I25A-P292A 0.303852491712814 G65A-L254A 0.303270953495032 M31A-N154A 0.302358109015838 S252A-L396A 0.302293898765088 P292A-P370A 0.300576781073184 G156A-A166A 0.300189475769149 V174A-L179A 0.29896829137302 M406A-V435A 0.29818695960666 P377A-T399A 0.296248661014594 M27A-L294A 0.292718354086777 G74A-V151A 0.287678958818679 Q253A-M260A 0.28626647029034 G72A-N157A 0.285704257856629 A70A-L107A 0.285337911279973 A327A-V374A 0.285272921213348 S104A-G158A 0.285173448585112 G108A-L143A 0.284990010775337 N154A-G246A 0.281523844227734 N154A-G176A 0.280841940750688 G72A-G108A 0.280735939223983 G76A-L103A 0.280419679702354 A70A-G146A 0.279276825606616 G65A-L144A 0.279014125398948 V109A-V151A 0.278544993584818 L69A-L247A 0.27818720609306 L105A-G146A 0.274825694591151 V335A-M434A 0.274303749087341 N38A-M173A 0.273218604120628 I293A-A327A 0.272455465302011 G72A-L396A 0.271487203004438 M27A-N167A 0.270867808863581 A327A-G379A 0.270553291637216 V33A-S177A 0.270259352447549 G72A-S100A 0.269452157398366 G76A-A298A 0.268302545062316 I111A-A147A 0.265829802963506 G65A-S252A 0.264583593082413 E331A-A336A 0.263036775295623 G176A-M206A 0.261196742456278 I293A-M380A 0.260461748499417 M28A-R168A 0.260326802196031 Q253A-Q407A 0.26022357028744 E331A-V371A 0.259930505220046 N157A-M206A 0.258601870027946 P248A-S395A 0.25791241109998 P370A-V430A 0.257788980544102 F372A-G379A 0.257567018882284 F414A-G428A 0.255799066725932 L107A-V151A 0.255020535379283 V371A-W426A 0.253800318640874 L369A-G432A 0.253314298167298 P26A-A169A 0.251049472081799 Q34A-G295A 0.248587960369955 Q34A-S205A 0.247854081082041 M296A-V334A 0.247147426335518 P370A-Q407A 0.246733795582654 G72A-L247A 0.246537165557292 Q34A-N180A 0.245733352062709 S32A-V291A 0.245110770654191 L396A-G440A 0.244773459444808 I293A-P377A 0.244436288377757 G30A-M173A 0.243319484215361 N157A-G176A 0.243288236320768 F328A-G379A 0.242690144750007 L340A-T368A 0.242165368646947 M256A-T399A 0.240677912448477 M380A-A437A 0.24014371574077 L69A-T110A 0.239391934851417 Q407A-Y412A 0.238409492915591 I150A-M206A 0.238204517627098 L175A-T209A 0.23776031536582 S257A-Q407A 0.237615068026537 M28A-G295A 0.236578492743185 F414A-G432A 0.236269225160116 V405A-F410A 0.235805116864473 R402A-G432A 0.235682231673509 L332A-T376A 0.235562297858794 G74A-G108A 0.235503459121294 A71A-S249A 0.234535521229684 F410A-V425A 0.234071344904893 G76A-N157A 0.232615168164132 S255A-T403A 0.232204223951165 L404A-G409A 0.231453438030757 G146A-L203A 0.23075105733509 I258A-V405A 0.230572912528507 Q34A-M287A 0.229985543810654 G30A-N154A 0.229588310868122 I397A-V439A 0.229322504349655 N180A-L204A 0.229227334285147 P61A-L144A 0.229008055670217 L103A-G246A 0.228443568915906 G289A-L373A 0.225337048103968 I66A-V109A 0.225183016417906 M31A-N167A 0.222902065391644 G72A-S104A 0.222463982110638 L144A-T202A 0.221956125609918 P248A-L398A 0.220971353820187 G74A-N157A 0.22054940021483 F63A-Q253A 0.218701617703283 G30A-N38A 0.217960585436555 S395A-A437A 0.217428656730896 P61A-L143A 0.216771528780036 Q34A-G178A 0.215530540575529 S104A-F148A 0.214415303290925 G156A-I213A 0.214232928405528 G156A-N167A 0.213468867078253 P61A-S252A 0.212956451277314 M329A-V371A 0.2125651904304 T35A-T202A 0.212426096276015 V155A-M206A 0.211887105015208 M380A-V435A 0.211643751507155 G146A-N154A 0.211636476674449 P377A-L398A 0.210754040160722 L288A-V334A 0.210719317892931 G158A-I213A 0.210599118337751 Q407A-G432A 0.210502706724809 G156A-F218A 0.209963875883165 M260A-R284A 0.20902051256903 V335A-V374A 0.208439516009144 M260A-R402A 0.20815501141614 F410A-A436A 0.208054893314125 F337A-V371A 0.206998916962787 V33A-L175A 0.206130182595828 R284A-I290A 0.205410349432672 G432A-G440A 0.204853332311137 V408A-M434A 0.204842575932947 V405A-G428A 0.203090885041994 A169A-S177A 0.202580543295876 M27A-N154A 0.202502023634825 N157A-S210A 0.202332304612051 T286A-W426A 0.202329911837719 I290A-V371A 0.202046451517207 G30A-A298A 0.201587067775829 N153A-R168A 0.201238408921354 L103A-G156A 0.199881235396658 A172A-A214A 0.199239633008252 M27A-L175A 0.199172405803777 G72A-L107A 0.198009784599838 I67A-T202A 0.197580428387425 S100A-G108A 0.197015073603989 I293A-T376A 0.196850978875228 L332A-P377A 0.19665244866365 T35A-G295A 0.196051838400365 P370A-G424A 0.195720731041818 P61A-Q253A 0.195554751986693 I113A-G146A 0.193421153930464 N153A-Y215A 0.19332322428178 R367A-V430A 0.192218649124789 V334A-F372A 0.19189159143618 P26A-G158A 0.191370776847594 Q253A-M380A 0.190302421035527 Y412A-W426A 0.190249493439909 N153A-L204A 0.190086066221268 S104A-S250A 0.188642115943709 S100A-N154A 0.188461932022672 S24A-M329A 0.188026686488993 S252A-M406A 0.187638779685424 M406A-W426A 0.187528353591132 G72A-N153A 0.186941472495655 Y412A-G428A 0.18688284839849 G146A-V207A 0.186567050586502 S104A-M206A 0.18637822345544 E331A-N433A 0.185955061851512 M31A-R168A 0.185705028912106 G74A-Q253A 0.184877596163766 A70A-S250A 0.184611915066988 V109A-A147A 0.183865474967163 M31A-V291A 0.183285722604011 S249A-L396A 0.183167577834177 N167A-G295A 0.183022882254598 G409A-M434A 0.182772857811745 A68A-S250A 0.182438203506178 F378A-M434A 0.182009742374754 L294A-M380A 0.181675352306501 L69A-M256A 0.181127301683397 G65A-T112A 0.18022473048155 S255A-M380A 0.179750825009381 G30A-L288A 0.179699486163812 T403A-G440A 0.179469009927803 M27A-M170A 0.179415140264787 L103A-G158A 0.179190325521398 G74A-L105A 0.178419398341164 N38A-G176A 0.177355238209817 G72A-M256A 0.17720969766052 G158A-N167A 0.176168280647245 M27A-Q34A 0.176002195918745 M296A-L373A 0.175548445760186 F152A-Y215A 0.174235157757375 Q407A-G424A 0.174146879200625 M64A-S257A 0.17401682144332 Q34A-M206A 0.173287256792253 L69A-M115A 0.172956708360346 E331A-V374A 0.172879591165605 G76A-L396A 0.172765856338989 T368A-T376A 0.172541395225071 L105A-S210A 0.171604699225969 G108A-I113A 0.170824110928081 V371A-V425A 0.170353127043702 S32A-L288A 0.170291559277061 P26A-S177A 0.170201892774056 A70A-S100A 0.169018212086831 N157A-L175A 0.168518712563767 I67A-G72A 0.166846966131554 V151A-A214A 0.166773020112951 S100A-L217A 0.166488168808525 F63A-G146A 0.165007020773595 G65A-A145A 0.164486797827198 A172A-G295A 0.163179145973826 G409A-V430A 0.163158096388703 T286A-I330A 0.163138683054073 G289A-G295A 0.162023663047744 V371A-V435A 0.16195551875442 A68A-G146A 0.161636831452177 A147A-G176A 0.161636831452177 A259A-V425A 0.160947129450838 I67A-V151A 0.159383251003696 I106A-F148A 0.159239923660239 V405A-I413A 0.158983607217836 M287A-V374A 0.158722536949391 W283A-L366A 0.15806314130715 G108A-M206A 0.15804592215318 N154A-F212A 0.157644313104242 G178A-V208A 0.157052655240667 A70A-S252A 0.156225040258984 G379A-L398A 0.156073454920947 G65A-G108A 0.155808734567657 G72A-Q253A 0.155720289116991 L375A-V430A 0.155590792229074 L69A-S100A 0.154431921453932 A70A-S104A 0.154014567672434 T286A-A333A 0.153096090883968 L175A-V208A 0.152794903259279 M256A-T403A 0.152577811103728 S257A-M406A 0.15252498868411 Q253A-L396A 0.152278503601084 M170A-L294A 0.151770650651343 T286A-T403A 0.151716145191609 A71A-G146A 0.151452099758122 N157A-L211A 0.151223235374172 A259A-Q407A 0.151029489286269 A166A-I213A 0.149915581283992 A70A-I102A 0.149798203086123 A70A-I150A 0.149745710464152 L101A-G156A 0.14952713010267 T35A-N180A 0.149454736308446 S32A-G178A 0.149291678226591 I66A-I113A 0.148783042428891 G65A-M115A 0.148540909514942 V371A-I427A 0.148361398911968 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