[Wed Aug 24 18:10:50 2016] >Input file: TM1IJDATD.pdb >TM segments: A13-30_C14-32_B16-33_E14-32_D23-38_F20-38 MAIDEN score = -54.7137 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 ----------- ---------------- D18B-F23B 0.562076290918651 H31D-H31C 0.331402601622141 H31E-H31F 0.33139568989502 G19B-L16A 0.290351098364541 A32E-A32C 0.243498276134497 L20E-G15C 0.234561669080517 L20C-G15A 0.234512071936064 A24E-F23F 0.227452159431556 F23D-A24C 0.227286143484279 F23B-A24A 0.227153251474365 D18B-M19A 0.21450883710295 A22C-A22A 0.213709235772757 A22E-A22C 0.213062753720266 V23C-M19A 0.210951085384251 V23E-M19C 0.210886634967124 L28C-V30A 0.210833669850417 L28E-V30C 0.210832736829337 V16B-G15A 0.20078765407999 H31C-T26A 0.19189992101313 H31E-T26C 0.191838537120406 V23E-H31E 0.189977831013835 V23C-H31C 0.189949072653441 M19E-G15C 0.181408542907919 M19C-G15A 0.181380144869346 P17C-L20A 0.176411839348661 P17E-L20C 0.176271408884614 A22E-T20F 0.175858112726714 T20B-A22A 0.175708816652277 F35D-H31C 0.171239278282337 H31E-F35F 0.171239278282337 G21E-L16C 0.168183468484958 G21C-L16A 0.168152076053826 H31D-V30C 0.164562614772026 V30E-H31F 0.164505929828147 H31B-V30A 0.164475826300562 V16B-A13A 0.157646965280562 V30E-A27F 0.155233178447972 A27B-V30A 0.155218656203974 A27D-V30C 0.155188252084432 A24C-I25A 0.150884458792655 A24E-I25C 0.150648167679731 T26C-A22A 0.149326995853248 T26E-A22C 0.149283302434431 G19B-M19A 0.147779877414393 A27E-F23F 0.147753120535533 F23D-A27C 0.147649898612792 F23B-A27A 0.147568379628728 H31D-A27C 0.145786619820603 A27E-H31F 0.145781257723253 H31B-A27A 0.145766982808886 I29F-A34F 0.143668446704671 I29D-A34D 0.143660301055238 A22E-G21C 0.143428989801769 A22C-G21A 0.14334588276958 H31E-A32C 0.142968157780693 G19B-G15A 0.141396770282193 M19E-L18C 0.135132170581477 M19C-L18A 0.135097511619185 L24B-L20A 0.129849534035423 L24D-L20C 0.129823226961325 L20E-L24F 0.129780565530293 T20B-A24A 0.128719607367852 A24E-T20F 0.12859092407143 T20B-T26A 0.128070973609684 T26E-T20F 0.128066882566957 A24C-H31C 0.124764490925412 A24E-H31E 0.124744919317177 A27E-I26F 0.124105054066588 I26D-A27C 0.123891102143544 I26B-A27A 0.123812043907272 G21C-T26A 0.122794684452184 G21E-T26C 0.122783835229187 H31D-T36D 0.121515583872048 H31F-T36F 0.121424617576142 G21E-G15C 0.118455582046209 G21C-G15A 0.118406508037951 V16B-R21B 0.118334793631543 A27F-F35F 0.118218364433304 A27D-F35D 0.118216888185542 L28E-A30F 0.116499869790381 A30D-L28C 0.116414271970313 A30B-L28A 0.116368105450226 A24C-A32C 0.114219799403716 A24E-A32E 0.114206570911615 I25C-G21A 0.11330543336643 I25E-G21C 0.113297599670048 A27D-T26C 0.112996467355631 A27B-T26A 0.112988340853649 T26E-A27F 0.112978578092003 A27E-A30F 0.112433372531923 A30D-A27C 0.112376790023569 A30B-A27A 0.11237650124306 A30D-H31C 0.111453014883367 H31E-A30F 0.111399910891337 L29E-I25C 0.110770930122463 L29C-I25A 0.110678487176511 A32E-H31C 0.110206362520566 P17C-G15A 0.109647179160692 P17E-G15C 0.109230012975639 G21E-G21C 0.10920906968355 G21C-G21A 0.10915328514926 V30E-V30C 0.108723401565936 V30C-V30A 0.108600087048157 A22C-V23A 0.107699959611508 A22E-V23C 0.107665806713007 A13A-G21A 0.106159587297467 A22E-G15C 0.104649716909194 L28E-A27C 0.104551671117113 L28C-A27A 0.104518993281277 A22C-G15A 0.104492232058345 G15C-F14A 0.103296620037197 G15E-F14C 0.103290950052437 L28C-A22A 0.10185826108787 L28E-A22C 0.101827869199418 L16E-L16C 0.101282416014421 L16C-L16A 0.101251172552824 A34D-H31C 0.100196456792698 H31E-A34F 0.10012154776964 L20E-L16C 0.0981064735643682 L20C-L16A 0.0980598539251867 V16B-G21A 0.0967631838224761 L29C-L28A 0.0942768563436349 L29E-L28C 0.0942143533848299 L20C-V23A 0.0939685756117399 L20E-V23C 0.0938945596042227 L20E-A22C 0.0920250403063925 L20C-A22A 0.0920030074288389 I25E-L20C 0.0916535640769153 I25C-L20A 0.0916458128152645 L24B-A27A 0.0915858274453001 L24D-A27C 0.091578836576709 A27E-L24F 0.0915380408566389 T26E-V23C 0.0908531544792335 T26C-V23A 0.0908531544792335 V16B-V25B 0.0903822057250974 L20A-L28A 0.0868161882851082 L20C-L28C 0.0867987929134402 L20E-L28E 0.0867894385603192 T26E-V30C 0.0858629239868982 T26C-V30A 0.0858435158273556 V30C-L29A 0.0856728543154412 V30E-L29C 0.0855963347378441 L18C-A22A 0.0826534821370213 L18E-A22C 0.0826348045493124 M19E-A27E 0.0822821540926654 M19C-A27C 0.0822795972567877 M19A-A27A 0.0822795559658359 A22C-L18A 0.0816319143981881 A22E-L18C 0.0816016959128507 V22B-L20A 0.0809534084784871 L20E-V22F 0.0809277119373513 H31C-L29A 0.0808731124739612 I25E-I25C 0.0804456583915227 H31E-L29C 0.0802998180985011 I25C-I25A 0.0799783917970913 G21E-F14C 0.0783676170049752 G21C-F14A 0.0782947767254716 P17C-A13A 0.0781740627753935 M19C-M19A 0.0776016097121048 M19E-M19C 0.0775698203488326 F14C-L16A 0.0775325359627703 F14E-L16C 0.0774031965009079 A27E-A22C 0.077354275139057 A27C-A22A 0.0773495527335286 P17E-L16C 0.0749491297307152 P17C-L16A 0.0749080936593352 G15E-G15C 0.0745410517967182 G15C-G15A 0.074436931633596 T26E-F23F 0.0695715028050103 F23D-T26C 0.0695292746625222 F23B-T26A 0.0693919088545312 A24E-G15C 0.0688744162208312 A24C-G15A 0.0688697104735581 V22B-V23A 0.0675404275351372 V23E-V22F 0.0674153957629056 G15E-A24E 0.0672777916837433 G15A-A24A 0.0672274533712245 G15C-A24C 0.0671993533398609 I25E-L18C 0.0667452150398031 I25C-L18A 0.066737621123274 A22E-A32E 0.0650664176807454 A22C-A32C 0.0650664176807454 A13A-A22A 0.064460382377441 L20E-R21F 0.0634710928093094 R21B-L20A 0.0634630540412524 A32C-L28A 0.0634255782331288 A32E-L28C 0.063400930175656 G19B-A28B 0.0626584131320405 A27D-A24C 0.0606183951602395 A27B-A24A 0.0605936297260241 A24E-A27F 0.0605927527760453 A34D-A27C 0.0604795423239455 A27E-A34F 0.0604296856363693 L16C-A13A 0.0578763394098019 R21B-I29B 0.0561953753889746 R21F-I29F 0.0561943829451648 L18C-P17A 0.0549618836714201 L18E-P17C 0.0548895117421804 A24E-L24F 0.0543524451782185 L24D-A24C 0.054252619370212 L24B-A24A 0.0542009213103518 A24C-A24A 0.0524943691945661 A24E-A24C 0.0524588318128587 L16E-M19C 0.0520728385088502 L16C-M19A 0.0519639179151885 R21B-V23A 0.0512231157567555 V23E-R21F 0.0511999703697719 L29C-A27A 0.0510439407175998 L29E-A27C 0.0506272195985602 V16B-P17A 0.0498371935268032 G19B-G21A 0.0472731654298162 A24E-A27C 0.0472050849445373 A24C-A27A 0.0471922751111693 G15C-L18A 0.0456522157149539 G15E-L18C 0.0456015474059555 G19B-A22A 0.0453180683320911 F23B-M19A 0.0451504797727688 M19E-F23F 0.045109220631903 F23D-M19C 0.0450979895281364 A13A-L20A 0.0412652920211847 H31C-I25A 0.0410925721824218 H31E-I25C 0.0410888795100254 A24E-L20C 0.0408712259083952 A24C-L20A 0.0408301168911942 V22B-A30B 0.0399741722839533 V22F-A30F 0.0399677843138964 I29F-T38F 0.0377005596306557 I29D-T38D 0.0376748001749974 T26E-I25C 0.0371533581081298 T26C-I25A 0.0370190668515522 A22C-M19A 0.0369177919931358 A22E-M19C 0.0368046375147091 A27D-T36D 0.035580791255313 A27F-T36F 0.0355677026877481 T20B-I29B 0.0345945438004622 T20F-I29F 0.0345833039712518 L20C-P17A 0.0332727604435803 L20E-G21C 0.033250759126167 L20E-P17C 0.0332259496741631 L20C-G21A 0.0331807260827652 V23E-V25F 0.0325898490001215 V25D-V23C 0.0325898490001215 V25B-V23A 0.0325898490001215 A27C-V30A 0.0324692067713857 A27E-V30C 0.0323894473850741 L20A-L29A 0.0317282417655527 L20C-L29C 0.031648705147699 L20E-L29E 0.0316459106063949 L28E-A24C 0.0313882205259297 L28C-A24A 0.0313260681766838 L20E-L20C 0.0305846564513406 L20C-L20A 0.0305223646700412 V23C-I25A 0.030391632642699 G21E-L20C 0.0299497629705892 A28F-T38F 0.0299118319258755 A28D-T38D 0.0299018916990375 G21C-L20A 0.0298955934584955 V23E-I25C 0.0298072938459448 F14E-M19C 0.0293998205722343 F14C-M19A 0.0293631699198018 A27D-H31C 0.0291438649829416 H31E-A27F 0.0290152500410583 P17E-I25E 0.0288626718976617 P17C-I25C 0.028859554598647 P17A-I25A 0.028846647940838 L24B-M19A 0.0284196596979802 M19E-L24F 0.0282899881270606 L24D-M19C 0.0282756556980757 A22C-T26A 0.0279887819712752 A22E-T26C 0.0279673033582082 P17C-A22A 0.0259876095245994 P17E-A22C 0.0258829261805786 T20F-A30F 0.0254187229791754 T20B-A30B 0.0254004067729423 R21B-H31B 0.0250379716877054 R21F-H31F 0.0250372172490729 L16E-F14C 0.0243466297729664 L16C-F14A 0.0243244188744043 A24C-G21A 0.0218465102053615 A24E-G21C 0.021756983082688 L18E-G21C 0.0214513515902641 L18C-G21A 0.0214288707268318 G21E-V23C 0.021383955910073 G21C-V23A 0.0211427553411774 G19B-A24A 0.0200368731884734 A24C-L29A 0.0185660713117679 A24E-L29C 0.0184119947868924 A24E-V22F 0.0179049244790184 V22B-A24A 0.0177898771995109 G21C-A24A 0.017696197386639 G21E-A24C 0.0176547644498148 L28E-H31C 0.0167153349079859 V23E-A27F 0.0157670784375306 A27D-V23C 0.0157596231975177 A27B-V23A 0.0155931146838313 F14E-M19E 0.0146552191849683 F14C-M19C 0.014643008475332 F14A-M19A 0.0144977296505857 L16E-A24E 0.0136793779274198 L16C-A24C 0.0135777891647306 L16A-A24A 0.0135756834592335 L29E-T26C 0.0114073800143082 L29C-T26A 0.0108110654839635 L20E-F23F 0.00857236638346581 G21E-M19C 0.00846256461063333 G21C-M19A 0.00843375903621524 F23D-L20C 0.00842547362593127 F23B-L20A 0.00823118595700567 G21E-I25C 0.00518663751889159 G21C-I25A 0.00512796244282399 I25C-V30A 0.00469608755746398 I25E-V30C 0.0046164144005143 T26C-T26A 0.000797331403347812 T26E-T26C 0.000458463856286784 I25C-A27A -0.000169861327858012 T26C-H31C -0.00018464041347821 I25E-A27C -0.000208281625976969 T26E-H31E -0.000213740480270452 A24E-V30C -0.000413158558539628 A24C-V30A -0.000468146451993334 G15A-V23A -0.00106105473636831 G15E-V23E -0.00110315764123037 G15C-V23C -0.00110760806227761 I26D-A34D -0.00296151551244872 F14E-P17C -0.00296487447660032 I26F-A34F -0.00296518714611205 F14C-P17A -0.00300343300859118 L24F-A34F -0.00420131394987777 L24D-A34D -0.00431527200577442 A27D-A27C -0.00532232092055729 A27E-A27F -0.00545621096074989 A27B-A27A -0.0056340285698866 R21F-I26F -0.00629743004674177 R21B-I26B -0.00630365864125393 P17C-G21A -0.00747114237594015 P17E-G21C -0.00747713647669235 V23C-T26A -0.00809249340482598 V23E-T26C -0.00809513111907584 V30E-A34F -0.00847192772220684 A34D-V30C -0.00847926296739965 G21A-L29A -0.010375715271659 G21C-L29C -0.0103768944552822 G21E-L29E -0.0103925174575541 G15E-A22E -0.0111988124242277 G15A-A22A -0.0112059311503412 G15C-A22C -0.0112144188718117 T20B-A27A -0.0128015164427664 A27E-T20F -0.0128023965683539 G21C-P17A -0.0137450314277223 G21E-P17C -0.0137851887773706 A27C-I25A -0.013827900422227 A27E-I25C -0.0139010746873796 D18B-A27B -0.0167978028013076 A27E-A27C -0.0169273588857815 A27C-A27A -0.0170139340437654 L18C-F14A -0.0197395896525112 L18E-F14C -0.0198756449317212 G19B-A27B -0.0206879180694663 G19B-V23A -0.0213774263515143 V30E-A30F -0.0218538179798862 A30D-V30C -0.0218753939465275 A30D-T38D -0.0219542924389469 A30F-T38F -0.0219699157493212 A30B-V30A -0.0219891807981702 L28E-A32C -0.0230738277825822 V25F-A34F -0.024312786953852 V25D-A34D -0.0243205309505323 A32E-A27C -0.0252464026094272 A32C-A27A -0.0253251831467303 A22E-V30E -0.0261605159982883 A22C-V30C -0.0261682816809208 A22A-V30A -0.0261685094948061 V23C-A22A -0.0266714969305686 V23E-A22C -0.0267233787654262 A27C-V23A -0.0272567132909025 A27E-V23C -0.0273309650410856 I25C-A24A -0.0292307754864263 I25E-A24C -0.0292672739903201 G21E-L18C -0.0296891765527354 G21C-L18A -0.0298441675894301 V16B-V23A -0.029870023486521 A24C-L28A -0.031382424562409 A24E-L28C -0.0314577375756961 I17B-M19A -0.0317896669542082 M19E-L28E -0.0322941873289428 M19C-L28C -0.0323433793576218 M19A-L28A -0.0323749530364656 G21E-L28E -0.0331308192403199 H31C-L28A -0.0331475437754167 H31E-L28C -0.0332048726295429 G21C-L28C -0.0332217800423766 G21A-L28A -0.0332558058153367 I25C-M19A -0.035082360973867 I25E-M19C -0.0351125706375141 A13A-M19A -0.0360265202794565 L20C-T26A -0.0407639208269206 L20E-T26C -0.0408248630359238 A27C-T26A -0.0413000138462021 A27E-T26C -0.0416693454869872 V23E-V23C -0.0423341516772013 V23C-V23A -0.0423384599470615 V23E-A32E -0.043023875632763 V23C-A32C -0.0430690318613172 V16B-A22A -0.0459491636380935 L18E-L16C -0.0484464861399143 T20B-G21A -0.0485668086708024 G21E-T20F -0.0487296732363283 L18C-L16A 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