[Thu Aug 25 00:40:52 2016] >Input file: TM2X27ATG.pdb >TM segments: X5-30_X32-57_X60-87_X92-100_X116-123_X144-152_X159-178 MAIDEN score = -5.0371 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 ----------- ---------------- E152X-W170X 4.27274654207918 T18X-T46X 2.4834553215004 P69X-L93X 1.96335868915176 I11X-T53X 1.68421814633792 V65X-T96X 1.41727128682807 K6X-M55X 1.36561122119348 P94X-T122X 1.26305845932602 D75X-L87X 1.23239411523172 I11X-F52X 1.18159269629233 L159X-L164X 1.13115528977094 K77X-L83X 1.12794357802489 M55X-W60X 1.10777566024781 A7X-M55X 1.10232964094635 T96X-N120X 1.09730694699091 L99X-L117X 1.05196213930887 T51X-V65X 1.0180495375975 V42X-V74X 1.0149639375086 I12X-F52X 0.977069181792594 F56X-V62X 0.970079942005847 K39X-K77X 0.914823363319584 L98X-L117X 0.86420361894045 A66X-P94X 0.849440581553793 V62X-L99X 0.795253613296666 H72X-Q92X 0.792748160787221 T122X-I174X 0.743926564906006 T46X-F70X 0.713630994627728 F52X-V65X 0.70854975399908 V119X-L149X 0.696608829924509 A40X-K77X 0.688702840255587 G49X-V65X 0.677206415062072 A150X-W170X 0.676961250709011 F70X-L93X 0.670517430404942 R13X-N166X 0.658897019051492 A67X-P95X 0.657270960601675 L64X-L98X 0.654636415119992 V119X-W147X 0.653360033308696 L50X-V65X 0.652240810853783 W147X-I174X 0.649778870433955 L149X-M172X 0.643914068090811 K6X-A57X 0.62916334373997 F10X-M55X 0.613056908200238 Y121X-D145X 0.597113958976025 V62X-L98X 0.594358889614897 A7X-W60X 0.591840553677991 E63X-L98X 0.589763149685949 Q73X-L87X 0.580013239222232 V74X-L87X 0.562018043126469 K39X-G78X 0.55922654214 L97X-V119X 0.557512363446551 T38X-V76X 0.552898567489644 L30X-Q35X 0.550512998897585 V76X-L87X 0.548729620176396 I11X-Y54X 0.543416763166376 R13X-L164X 0.536986212058896 A67X-P94X 0.536426519447243 E152X-A168X 0.530455834199995 I12X-L50X 0.523899721178286 D9X-F56X 0.519434839823702 F10X-F52X 0.518747819320018 A67X-L93X 0.516369784632989 R13X-G49X 0.515870585980494 D27X-A40X 0.512957626908807 T38X-L79X 0.505495082250544 T96X-A150X 0.50510913904439 R36X-G78X 0.491490911397905 V65X-L97X 0.491298428582862 K77X-G85X 0.480011925836928 K34X-K39X 0.470934680232439 N120X-I174X 0.463692722239947 L98X-V119X 0.458567735335658 W60X-L99X 0.448575379473936 F16X-T46X 0.44470379112251 M55X-G61X 0.43337175910901 L159X-F165X 0.432293335209761 T123X-Q144X 0.425599196353433 L64X-P95X 0.422524535656348 D43X-Q73X 0.41392180848994 F16X-L48X 0.413893598274421 F52X-L64X 0.411312329881945 T68X-L93X 0.406048295742528 S25X-T41X 0.401290272559086 T18X-S44X 0.397814275707755 V19X-W170X 0.391237814017403 D27X-Q35X 0.388479740102634 Y121X-G148X 0.387665775383711 T96X-G118X 0.376401667707202 K6X-W60X 0.37327924191821 P21X-V42X 0.372332820665211 L93X-Y121X 0.367151479749151 Q92X-T122X 0.361271291702894 D23X-T41X 0.359711568252776 Q35X-L79X 0.357493318961865 S24X-T41X 0.352796893653455 S24X-A40X 0.34605900552103 R13X-F52X 0.340710528466007 P94X-W170X 0.34049164260442 L98X-G118X 0.338979910099223 P21X-W170X 0.334362189928297 D145X-T176X 0.334056889294432 V74X-D84X 0.332681568180937 Y54X-G116X 0.328106465603522 V65X-L98X 0.32146596945247 G14X-L48X 0.320313526189826 L98X-A150X 0.319809566938657 K34X-A40X 0.319329353922511 G148X-M172X 0.316415907583144 G151X-M172X 0.313394511329288 A17X-D45X 0.312930152912463 L117X-L149X 0.311815898927529 G14X-A168X 0.311495030998701 D20X-H72X 0.307352053707597 K6X-F56X 0.30575996929595 Q73X-K86X 0.303238281218241 P69X-Y121X 0.30108978262002 I12X-T51X 0.300982724832012 S44X-P69X 0.299634250777895 T46X-P94X 0.293865357371133 A66X-L93X 0.292860545453313 P21X-N71X 0.290454283421155 D9X-T53X 0.286725648989121 V42X-V76X 0.28116950926853 T68X-T96X 0.279263305837832 V119X-D175X 0.277766257760669 V62X-L97X 0.274917310163812 T122X-T176X 0.274794571451601 A66X-T96X 0.274553399991809 T123X-T176X 0.273058800987236 P95X-Y171X 0.268988590544583 V119X-D145X 0.268652441989111 I28X-A40X 0.267829271960284 T18X-Q47X 0.267125198007514 W60X-Q100X 0.266871658178015 F70X-Q92X 0.261573550447714 Q47X-Q73X 0.26140630305319 G8X-M55X 0.260635411212678 M55X-V65X 0.258926896894558 V19X-F70X 0.258611415567314 S146X-A178X 0.252748604315377 D45X-D75X 0.250870661347017 G61X-L99X 0.249979492484146 D27X-D175X 0.249335123826889 T53X-L64X 0.249167536634372 E161X-N166X 0.24833210318531 G148X-I174X 0.247942131743434 D22X-D75X 0.247895849385012 T51X-E152X 0.247710345263977 I28X-A33X 0.246834935675965 T18X-Q92X 0.246821495633036 D43X-D175X 0.246157322217272 K29X-K39X 0.245233076005363 S25X-Q35X 0.24476818407602 G14X-A163X 0.241670116439765 T46X-Q73X 0.241510414008776 P21X-Q73X 0.24000914008904 T122X-L149X 0.239659598753311 D45X-M172X 0.238606693867943 P95X-T123X 0.238356658405799 P21X-T176X 0.235233354502755 D9X-V62X 0.234602971201451 D20X-V74X 0.234416780919301 N71X-Q92X 0.234069130701843 T122X-W147X 0.231265219436737 F10X-A57X 0.230852021668597 G8X-A57X 0.230450655090641 Y121X-I174X 0.230183484342838 L50X-A66X 0.229602835996037 T38X-L83X 0.227947382849331 D23X-K177X 0.226157411005709 T122X-S146X 0.224685583833026 K6X-Q100X 0.223269406272686 G148X-D175X 0.219324268546324 K6X-H162X 0.217332317692151 W147X-K177X 0.216898032579723 L64X-L97X 0.216645711030935 L97X-T122X 0.216104201214225 D27X-G32X 0.215894942844433 V42X-G85X 0.215785323380361 G49X-T68X 0.213198598975388 R13X-A67X 0.212607187799183 V76X-K86X 0.212518619867928 P21X-T41X 0.212024769602614 S25X-V74X 0.211742279219623 G49X-A66X 0.211722301507987 S26X-V76X 0.21163124558065 V65X-M167X 0.210057803847915 G118X-D173X 0.209926318612689 R36X-L79X 0.20948568413195 I11X-T51X 0.207933961729461 G8X-Y54X 0.207887168483392 T51X-G116X 0.207353632374166 L99X-V119X 0.206431967637257 T41X-I174X 0.205623219191455 V19X-T46X 0.204495993459203 S26X-T38X 0.204459405348083 H72X-L93X 0.204066966129028 S25X-S146X 0.203354483879867 P69X-P94X 0.202952439039006 T41X-V76X 0.202361847836405 L48X-M167X 0.201471455037818 A17X-A67X 0.198365917711022 T18X-T51X 0.198203433186278 V65X-G116X 0.197547905371899 P21X-T122X 0.197478356145343 L149X-D173X 0.197308640549002 D22X-Y171X 0.197275882533745 D20X-D175X 0.193905924995827 I28X-G78X 0.193236122467636 Q100X-L117X 0.192141534254253 Q47X-P94X 0.19196012845448 T123X-S146X 0.190266128594259 L99X-E152X 0.189639458826614 T51X-W170X 0.188150289258299 G15X-L50X 0.184437626855054 A17X-Q47X 0.18358558959884 D27X-D84X 0.182987653977376 A7X-Y54X 0.182888172179759 M55X-V62X 0.182509003765784 D9X-H162X 0.18241944699605 F16X-T51X 0.182159623288058 V19X-Q47X 0.181917732976626 F16X-A66X 0.180078955360432 Y121X-Y171X 0.179810903891699 S26X-A33X 0.17976132321829 G78X-L87X 0.178900617409125 D20X-P94X 0.17742226476489 I12X-A66X 0.177184026387728 W147X-D173X 0.176197913662898 L30X-K39X 0.175955233255151 V42X-D175X 0.174763351126812 L50X-P69X 0.174587941082613 W147X-D175X 0.174365585023381 P95X-D173X 0.17270774508535 D45X-P94X 0.172448016961854 T46X-A66X 0.172301186083251 A17X-T96X 0.172057371009903 P95X-W170X 0.171833974373417 F10X-F56X 0.171783913506582 L159X-M167X 0.171479365498157 D20X-T41X 0.171272582846276 I28X-R36X 0.170611317795467 K39X-L79X 0.169655432444422 H5X-L164X 0.168295894679559 Y121X-G151X 0.168059043321066 G61X-A168X 0.167603290387271 K29X-D75X 0.167252431876954 L64X-G151X 0.166703569657691 F52X-V62X 0.16648347011492 S25X-R36X 0.165430880961135 P94X-L149X 0.16433040322507 D22X-V74X 0.163434251653509 V65X-P94X 0.163385149298046 A66X-G151X 0.163137685809484 S24X-V76X 0.162701567263789 I28X-T176X 0.161854318394968 L64X-G116X 0.161645773102752 R36X-D84X 0.161092497874093 K29X-R36X 0.160712467015297 T41X-D175X 0.160691005767262 E63X-A168X 0.160683953379954 G14X-T46X 0.160098121829262 I28X-K77X 0.159907198652402 K39X-L83X 0.159721257123909 D22X-W170X 0.156006928224123 E63X-G151X 0.154943578279496 D9X-N160X 0.154932148681057 D20X-V169X 0.153531484723695 T53X-L98X 0.153220916639227 G15X-P69X 0.152288055362481 T96X-L149X 0.151696330322946 T51X-Q100X 0.151375254610081 T53X-A168X 0.151353055720578 Q100X-G116X 0.15120163481091 K34X-G78X 0.150346539984801 I11X-M167X 0.150111481289506 Q47X-P69X 0.149528927982763 H5X-V62X 0.147849283900761 L117X-W170X 0.147551262500996 R36X-K77X 0.147030442169917 L99X-G116X 0.146608728190894 V19X-I174X 0.146262046885321 L99X-W170X 0.14552986220144 L99X-G118X 0.145245058937567 R13X-E161X 0.144676370002444 L149X-Y171X 0.143753219732603 T18X-H72X 0.143398211082833 M55X-L97X 0.141892927298323 D45X-A67X 0.1413078328562 D75X-K177X 0.141002534429583 I12X-T53X 0.140875901759669 K39X-T176X 0.139742141754037 S26X-A40X 0.139601793817357 N120X-D175X 0.139486086665722 G15X-A66X 0.138761992919124 D20X-Y171X 0.138679184107511 H72X-T123X 0.137954863772654 G49X-N166X 0.137387157799161 G14X-T51X 0.13559211009748 L50X-L164X 0.134539128356565 T96X-S146X 0.134117737704068 D23X-K77X 0.133454811843281 P95X-G118X 0.13309769190208 T18X-T96X 0.132981285388581 L50X-L98X 0.132949864128368 G8X-V62X 0.132404094478751 A7X-Q100X 0.13235671250247 S24X-K77X 0.131274228198155 L48X-A67X 0.130970240510671 K29X-G37X 0.130868283063927 R13X-Q47X 0.130782639093646 N71X-L93X 0.130360803172034 L64X-M172X 0.129880939252004 A66X-A150X 0.129563654157627 D22X-K39X 0.129364948684027 L50X-P94X 0.129305645250141 D20X-D43X 0.128717522860147 G15X-V65X 0.128623024683581 V42X-K177X 0.128526288733997 L97X-Y171X 0.12839437203436 N120X-D145X 0.128006693963485 D27X-A178X 0.127933359388432 V65X-L99X 0.127681254403941 T38X-K86X 0.127607529492622 D43X-K77X 0.127479943992101 G116X-M167X 0.127203663639086 T96X-A168X 0.127170334412894 K39X-K177X 0.127039046396548 D75X-D84X 0.12662533818271 T122X-G151X 0.12621630946017 N160X-N166X 0.125765730074437 D43X-V76X 0.125551965217912 A7X-H162X 0.125476962668414 E63X-N166X 0.125041610119181 S24X-D173X 0.124934673568412 A17X-N71X 0.124748916813878 K29X-K77X 0.124510537726183 F52X-A67X 0.124181281497311 V74X-K177X 0.124156745224801 S24X-D75X 0.123845497621128 P95X-G148X 0.123321877805552 D20X-D45X 0.122865879938035 N71X-P94X 0.122447785622614 G49X-E63X 0.122081129716935 T41X-K177X 0.122036200201054 S25X-Q144X 0.120808256961614 A66X-V119X 0.119646724203284 G15X-L164X 0.118739733161681 F52X-Q100X 0.118544820213436 A17X-Y171X 0.118007305226214 P21X-V169X 0.117724995953209 V42X-M172X 0.117586988844971 Q47X-N71X 0.116471362051678 N120X-L149X 0.115752411659081 D145X-I174X 0.115525521609426 S26X-V42X 0.11543967301747 S24X-V74X 0.11531603193371 V19X-D45X 0.114997299657167 G8X-E63X 0.114973844512428 G61X-E152X 0.114427683444853 M55X-G116X 0.114405791238048 S26X-G78X 0.112742759148234 E63X-P95X 0.111908995767761 L50X-A168X 0.111697884906489 G118X-A168X 0.111384896744371 V119X-V169X 0.110423187289394 T51X-G61X 0.109936211874066 S24X-Q73X 0.108947115280066 L99X-L149X 0.108397978434511 Y121X-D173X 0.106926774532968 D23X-I174X 0.106161859270093 G14X-F52X 0.105130163352719 L98X-V169X 0.103050498436435 V42X-H72X 0.102817668634577 G118X-I174X 0.102709630555388 D43X-L87X 0.102056741706742 S24X-K177X 0.101577003984862 T53X-G116X 0.101151042959819 F10X-G61X 0.101117303932251 I11X-L159X 0.100951952351344 V65X-L149X 0.100751057590692 L98X-G151X 0.100721533301648 T123X-G148X 0.100591767750286 L64X-Y121X 0.100017255620291 P94X-G151X 0.0999659542976694 T46X-T68X 0.0999291899453976 F52X-G116X 0.0996939518047837 P21X-D75X 0.0996667103474076 T41X-G78X 0.0993831416539389 L98X-G148X 0.0989881265066481 A150X-A168X 0.0987964056186463 F16X-S44X 0.0985943139798646 A67X-T122X 0.098423375884359 G14X-T53X 0.0983755817278749 K39X-D175X 0.0981939791673532 L79X-K86X 0.0974114266102211 L98X-A168X 0.0972672843486874 L98X-W147X 0.0970198784114293 D23X-V74X 0.0948155640804504 G78X-K86X 0.094514353985395 V19X-L50X 0.0944334063662178 L117X-A168X 0.0942006050115072 G37X-G85X 0.0933737059418371 K6X-T53X 0.093158788862421 G49X-T96X 0.0927478927206744 L30X-L83X 0.0925726415088648 L79X-L87X 0.0920659072511107 G32X-A178X 0.0913992168410109 V42X-T123X 0.0913991202538531 T41X-N71X 0.0913312611848385 L149X-I174X 0.0913151152159388 G61X-L117X 0.0911479896247105 G14X-T68X 0.090672566648285 T18X-M172X 0.0902305028111983 S44X-D75X 0.0900388305709059 S24X-A178X 0.0897132339354405 G15X-T68X 0.089465420921661 V19X-T68X 0.0891281992829849 F16X-L93X 0.0890837480191591 S24X-T38X 0.0890221961352191 L30X-T38X 0.088414956912608 V19X-T51X 0.0882882926462623 F10X-E161X 0.0881115561577825 A17X-N166X 0.0880694857372752 T38X-G85X 0.0876389301013826 T18X-N166X 0.0874570117902702 K29X-G78X 0.0868507024799013 F52X-L117X 0.0867554430442272 G118X-W147X 0.0863541274587183 E63X-L117X 0.0863033029943132 L64X-L117X 0.0862444398781603 S24X-S146X 0.086134603269798 V76X-D84X 0.0856349775866256 A7X-V62X 0.0854807380733877 A67X-A168X 0.084791525310302 A40X-T176X 0.0843504696588897 K6X-V62X 0.0839479408656567 G118X-V169X 0.0838624776220686 V62X-G151X 0.0837493808240684 P95X-I174X 0.0834429422460577 V62X-P95X 0.083389731743174 G118X-W170X 0.083172808245358 G8X-H162X 0.0831307688651566 D23X-D45X 0.0829308151222938 Q100X-L149X 0.0828828616860977 G49X-M167X 0.0820755649181866 V65X-T122X 0.0818601553404705 G8X-Q100X 0.0815041647883838 D145X-M172X 0.0806931907740642 L97X-Y121X 0.0799303500926216 R13X-L159X 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