[Mon Aug 29 16:50:48 2016] >Input file: TMQ8N394S4G.pdb >TM segments: A591-632_A731-771 MAIDEN score = -7.4976 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 ----------- ---------------- L609A-V628A 1.20189346466278 K614A-A625A 1.09323625038818 K596A-L612A 1.06453177163302 F749A-Y767A 0.997365216880947 L609A-E631A 0.958560638802606 L755A-L760A 0.927074537358624 A752A-E765A 0.924078046126005 K735A-A751A 0.922043740650623 L595A-C608A 0.906796453785681 H599A-L609A 0.828439641140564 E744A-A771A 0.76390139171945 L595A-L612A 0.729359467789076 D746A-H753A 0.635555590206844 A738A-V748A 0.613146847724407 V605A-A632A 0.612485130700893 A731A-M754A 0.597406833537976 K596A-C608A 0.594034830272221 V747A-A771A 0.592817132695703 H599A-C608A 0.560318525799868 V748A-Y768A 0.554240968377343 R756A-A763A 0.540403140545306 F745A-L770A 0.533336031844805 D592A-H599A 0.527475644124266 L595A-N611A 0.520734039205508 A738A-V747A 0.519992911745475 A738A-T743A 0.476376206257705 Q757A-Y768A 0.474106725929741 Q757A-Y767A 0.471765854775226 F749A-D769A 0.467075383503201 L612A-V628A 0.465134775520542 E732A-M754A 0.442047737368284 Y610A-A632A 0.438793444177797 A737A-V747A 0.436970150962946 V748A-Y767A 0.431352982943002 A751A-Y767A 0.423841016087158 C608A-E624A 0.410554873474987 A752A-K766A 0.40883742060764 L612A-A625A 0.400863839870261 L755A-A763A 0.400220855517453 V748A-A771A 0.39140055095373 E624A-K630A 0.391351150351132 P598A-C608A 0.374639217253379 K596A-H601A 0.366831904683251 A731A-A752A 0.346289988035367 K596A-A632A 0.344041171923258 A731A-A758A 0.343954966359698 K596A-L609A 0.342267706409529 Q757A-E765A 0.335454422813214 S603A-K630A 0.333549246649798 A764A-D769A 0.326110391396722 H617A-S627A 0.325698545506911 A738A-E744A 0.32325283639806 A738A-A771A 0.322967640383593 H599A-N611A 0.322249247523509 V748A-L770A 0.316020232045375 S607A-K630A 0.31429064294322 E732A-A751A 0.304188752186839 P591A-Y616A 0.303874675092558 E623A-K630A 0.301203971605537 L755A-E765A 0.301155973200151 L595A-L609A 0.298574414331046 G613A-L626A 0.294562313497665 M733A-D741A 0.294434517731152 H753A-A764A 0.291929691488812 E744A-H753A 0.291636797140218 L615A-A625A 0.288936657212564 Q757A-E762A 0.286388763923936 P598A-V605A 0.284668233160154 N750A-E762A 0.276082707444033 E732A-N761A 0.275563636172542 G620A-L626A 0.27538733465983 N611A-E623A 0.274016817761228 L609A-Y629A 0.273850564932593 D597A-C608A 0.272746248105557 E739A-N750A 0.270858633804579 H599A-Y629A 0.270352563424533 P591A-P598A 0.269934177135251 E732A-F749A 0.266262368506786 H599A-K614A 0.259994292801441 A752A-A763A 0.254377207924949 H599A-G613A 0.242958299661059 M754A-D769A 0.235595845665708 A751A-A764A 0.234981173079949 E732A-Q757A 0.234406844218595 H621A-Y629A 0.233333765750862 D592A-Y616A 0.228007167966428 E593A-Q619A 0.227881720454428 A738A-F749A 0.227503258386468 M733A-N750A 0.223504404538684 Y622A-K630A 0.222602533781792 E739A-F745A 0.218450746188593 D746A-A771A 0.218162429600908 N594A-L612A 0.217073003027646 F749A-A763A 0.210780109763795 E623A-V628A 0.209852033180019 S604A-V628A 0.204829858808594 A737A-D746A 0.204702869066448 S604A-K630A 0.203787658333651 E732A-L755A 0.202792846173727 N594A-G613A 0.201745122923885 D597A-V628A 0.201538374329033 K614A-A632A 0.201326565462699 H601A-T606A 0.197948738920611 N594A-Y616A 0.197817246820974 K735A-N750A 0.196149952424865 E732A-A764A 0.192468088848465 M733A-V748A 0.19118183475041 S604A-S627A 0.19028181717536 K735A-D746A 0.188228359961682 S604A-Y629A 0.18730004891017 S742A-Y767A 0.18709013719983 K602A-E631A 0.186344652310377 T743A-A751A 0.185561950289441 P591A-K596A 0.184680992274425 F749A-Y768A 0.184125735619435 E762A-Y767A 0.183299177736748 K735A-H753A 0.183149548055717 Y610A-Y622A 0.182353977896522 K596A-E631A 0.182308103250873 E732A-Y767A 0.180636123929303 A737A-F745A 0.179357396636846 S742A-A751A 0.179206157641288 K735A-Y767A 0.17842992398139 E593A-H617A 0.178317842004088 K735A-F749A 0.177370719768429 E624A-Y629A 0.176301891127274 S603A-Y629A 0.176211677618058 E624A-A632A 0.175468211639168 L615A-S627A 0.174862189709946 D597A-V605A 0.170649225300675 Y610A-E618A 0.170413138533396 P598A-G613A 0.167195428315522 E744A-Y768A 0.164274811605977 S607A-S627A 0.163998830963503 K596A-S627A 0.163015900912638 H599A-Y610A 0.162214207718149 C608A-L626A 0.162149805171993 S603A-Y610A 0.160317789435633 H617A-Y629A 0.160308667074665 D592A-K602A 0.160189221042575 T743A-L770A 0.158282006836393 P591A-Q619A 0.157690215272659 F749A-Q757A 0.152391551374672 A731A-R756A 0.149504051457566 N750A-N761A 0.148318456251621 H599A-S604A 0.146469571255877 E739A-V748A 0.14602091509235 E732A-A763A 0.143395623178435 E744A-F749A 0.14312546707992 T606A-A625A 0.14287105038914 A734A-E739A 0.142750479913751 N750A-S759A 0.142282611851694 L755A-N761A 0.139309376744067 F749A-N761A 0.137698140565235 K614A-Q619A 0.137055370889298 H599A-V605A 0.136975235817248 Y610A-H617A 0.136839597968741 E732A-S759A 0.134682247607916 T606A-K614A 0.1322366141126 H621A-V628A 0.132093657374035 D592A-H617A 0.131691696779454 E618A-E623A 0.130797442861807 A734A-D741A 0.130182787800589 N750A-A763A 0.129857461624148 E744A-A752A 0.128980790764325 L595A-Y629A 0.128007826079019 L609A-K630A 0.127688821168677 E593A-G613A 0.127248698346789 D592A-D597A 0.126294189582329 K596A-K614A 0.126004999190364 E623A-E631A 0.125686158147597 V605A-K630A 0.125528892720661 V748A-E765A 0.124094518503272 K735A-L740A 0.12402287463679 A600A-V628A 0.123712763135 L755A-L770A 0.123517599906557 E618A-A625A 0.12171279348319 L609A-K614A 0.121599729604197 A734A-S742A 0.120658318237131 L609A-Y622A 0.120043525606903 T743A-F749A 0.119060535734954 Y610A-Y616A 0.118818263645263 E732A-E744A 0.117083141328817 K735A-V748A 0.114678208781691 P598A-V628A 0.113394867066031 Y616A-Y622A 0.112744118497421 D741A-N750A 0.112725195559545 S604A-Y610A 0.110953570127375 A751A-S759A 0.110918902461298 A751A-L760A 0.110714489930984 M733A-S742A 0.11036763463829 K602A-C608A 0.110123314854586 S759A-K766A 0.108634953420356 E593A-E618A 0.108428192704373 A738A-A752A 0.10823008873083 E593A-L612A 0.107496144231709 A734A-A752A 0.107277116627443 A751A-D769A 0.107213349189584 Y616A-E623A 0.10688201657184 S742A-A752A 0.10642372771394 K596A-S604A 0.104533832944828 K736A-T743A 0.104108171919069 A731A-S759A 0.103863961900177 D592A-E624A 0.103277107061753 A738A-H753A 0.102559943123174 Q619A-L626A 0.101671423558042 D592A-L615A 0.101521192855693 S742A-F749A 0.101237395437085 A737A-N750A 0.100767523623264 D746A-A751A 0.100654633198023 V747A-A763A 0.100283875554422 D746A-K766A 0.0994932520092002 T606A-A632A 0.0987673609615509 S604A-A632A 0.0976011467779188 L755A-A764A 0.0967467217501707 V747A-D769A 0.0964950994776022 F749A-A758A 0.0952276105860039 L612A-E618A 0.0948795965791834 S607A-A625A 0.0944739327890809 A731A-A738A 0.0944236367186209 A734A-L755A 0.0939276470024033 A600A-S627A 0.0938034451854082 S603A-L612A 0.0932972091243158 A731A-V747A 0.0927982249822443 A738A-L755A 0.0917358820795497 N594A-H601A 0.0910924254893608 L740A-V747A 0.0908212892172688 K736A-D746A 0.089808660297757 H753A-E762A 0.0891718492024187 K614A-K630A 0.0885823572193476 N750A-Q757A 0.0882418675863463 V747A-A764A 0.0882011861728293 L612A-Y629A 0.0869123105770546 A751A-N761A 0.0842910020535128 E744A-L770A 0.0834412080218516 H599A-S627A 0.0831002248909716 A731A-L760A 0.0825729638226669 E739A-A751A 0.0819863482208403 L595A-A632A 0.081521945680664 T743A-D769A 0.0808209526429247 R756A-K766A 0.0807931103344339 E744A-Y767A 0.0790030308284309 D592A-N611A 0.0785060058216915 E732A-E739A 0.0782280500594186 K736A-F749A 0.0769224569992462 H601A-S607A 0.0767612041148273 K614A-E624A 0.0765774106538393 A600A-A632A 0.0747975400209961 A752A-Q757A 0.0744310246297184 N594A-K602A 0.0739725120918227 H753A-A771A 0.0739337637649511 L612A-Y622A 0.0732280320608076 C608A-H617A 0.0699377607088598 K735A-Y768A 0.0696548056757891 L740A-V748A 0.0694145315826322 Y610A-E624A 0.0693309560336284 L609A-A632A 0.0691432494885658 A734A-F749A 0.0674314660254307 D741A-F749A 0.0672109022194387 L615A-L626A 0.0661516741500954 L755A-A771A 0.0659527076416977 E593A-E624A 0.0649778019897574 A737A-E744A 0.0641634915984177 K596A-G613A 0.0639372729691607 P598A-S603A 0.0637974944163284 L595A-S604A 0.0632550108419565 L595A-L626A 0.0630241168360728 E593A-K614A 0.0610798018900627 S607A-E631A 0.0587157897641597 K596A-N611A 0.0583650391774846 S759A-E765A 0.0582527111948998 A600A-L612A 0.0579548729436432 G613A-E624A 0.0579169279643539 D597A-K602A 0.0576768498191678 D592A-S603A 0.0574359585257187 Y622A-Y629A 0.0558075587463396 N594A-Y610A 0.0557239067843183 H599A-E624A 0.0548846154881868 N750A-A758A 0.0543015864571395 K614A-S627A 0.054277264289484 N594A-H599A 0.0537149423729346 D597A-S604A 0.0531727318332681 V748A-R756A 0.0529260801047345 D597A-S607A 0.0526058592910748 H599A-A632A 0.0525281598622414 F745A-M754A 0.0524810203774464 N611A-G620A 0.0519497345135407 N594A-N611A 0.0516208800707704 F745A-A764A 0.0511629563120533 N750A-L755A 0.050533078624392 F745A-H753A 0.0504025323606315 D592A-V628A 0.0501741053158211 T606A-G613A 0.0498862448887554 M754A-A764A 0.0487435728684567 Q757A-A763A 0.0485708280464883 S742A-D769A 0.0484318543719238 T606A-S627A 0.0481333515091675 A751A-E762A 0.0481182056275404 S607A-L612A 0.0474353133924907 E593A-Y616A 0.0461473575003528 K596A-H617A 0.0459917960396394 E593A-H621A 0.0454753690538832 F749A-A771A 0.0450485661013813 L612A-G620A 0.0420142583294529 L609A-H617A 0.0415330363298472 F749A-M754A 0.0415037665106279 T743A-N750A 0.0407269360667715 M733A-L740A 0.040024822339817 S742A-L770A 0.0399493640050332 T743A-K766A 0.0394950176053389 T606A-V628A 0.0391353959284855 A738A-N750A 0.0390923094132329 K596A-S607A 0.0385340079094045 N611A-S627A 0.037364627338627 L612A-E624A 0.0369992404883863 M733A-A752A 0.0368383114436477 A731A-F749A 0.0358310744939061 M754A-L770A 0.0354482582332301 Q619A-S627A 0.0350560589683564 G620A-V628A 0.0348883387754286 N611A-Y616A 0.0348521747998831 L609A-E623A 0.0343258458520461 A734A-T743A 0.0330005327577878 A763A-A771A 0.0311983198924621 H599A-E631A 0.0308087491905829 H621A-K630A 0.029158161502755 N750A-D769A 0.0286313587319037 L612A-E631A 0.0286006884887331 A734A-V748A 0.0277694774314097 A734A-F745A 0.0277467496277151 M733A-V747A 0.0276190684627582 K735A-F745A 0.0275062294441986 S607A-L615A 0.0270759799548231 D746A-Y767A 0.0263366777306793 N750A-Y768A 0.0254080343288665 M754A-A771A 0.0252438280074515 K602A-S607A 0.0250724079125166 V605A-Y629A 0.0249865932094 M733A-E739A 0.0249182214978499 A600A-C608A 0.0244473437962442 T606A-Y629A 0.0243996176801192 V605A-G613A 0.0243454026929033 E732A-N750A 0.024288057945042 L615A-E624A 0.0239465367600245 K736A-V748A 0.0236770735021465 A734A-D746A 0.0235514256703584 Y616A-Y629A 0.0230435116504675 S604A-N611A 0.0219142569315882 M733A-A758A 0.0214421470251172 P598A-L615A 0.020150748856496 A737A-A752A 0.0199709245395239 F745A-K766A 0.019780234726779 D746A-A764A 0.0178878907573963 N594A-S607A 0.0178126393956296 N594A-S603A 0.0158891108532071 D741A-A751A 0.0158656065041232 A738A-Y767A 0.0154610387370422 K602A-Y610A 0.0144808099801735 N594A-T606A 0.0144540352117524 A751A-A758A 0.0139579190046248 H753A-L770A 0.0131933883334656 L595A-E624A 0.0128067504359803 M733A-M754A 0.0120377086748999 H601A-L609A 0.0118651893468172 D592A-A625A 0.0113754043740606 E732A-R756A 0.00969085527385039 E732A-Y768A 0.00939418136075965 C608A-S627A 0.00535468610221179 Y616A-K630A 0.00436803812801223 A738A-L770A 0.00423702539889703 Y622A-S627A 0.00412352854580256 S607A-K614A 0.00374134594434095 A731A-V748A 0.00342267756372028 P591A-A600A 0.00295269074224969 S603A-S627A 0.00124075915103988 N761A-D769A 0.000800822969199366 A734A-M754A 0.000539151767186219 A752A-L760A -0.00199653861449467 V748A-A763A -0.00269471730131254 L595A-A625A -0.00347296146003107 N594A-A625A -0.00363277300775078 E593A-L609A -0.00403769604083815 N611A-Q619A -0.004554881627159 K735A-L755A -0.00461000554060398 P598A-T606A -0.00538199048705845 V748A-A764A -0.00566281597388829 V748A-H753A -0.00643800662955329 Q619A-E624A -0.0066449782485356 P598A-A632A -0.0067684787343163 E762A-L770A -0.00687095916805935 L626A-E631A -0.00712855756727926 E732A-L760A -0.0073698385823221 E593A-K602A -0.00780137312243934 T743A-Y768A -0.00804344374743948 A734A-E744A -0.00912957375388412 L615A-E623A -0.0098172684249761 G613A-E631A -0.00997838764054571 G620A-S627A -0.0100820698634341 K614A-V628A -0.0106379432440802 K596A-Y629A -0.0111191984003733 S607A-A632A -0.0116659330049957 E618A-L626A -0.0123348831771014 E744A-K766A -0.0127018453709358 K736A-D741A -0.0128699397424055 E739A-Y767A -0.013419557814685 S742A-N750A -0.0140509995165565 K735A-T743A -0.0141973753527345 E618A-S627A -0.0150685183740863 A600A-L609A -0.0150713298270109 L595A-T606A -0.0172194299972599 H617A-E623A -0.0175301860754877 D592A-G620A -0.0176318462703615 R756A-E762A -0.0179903349930437 S742A-Y768A -0.0183044963645438 C608A-A625A -0.0183428024509495 K602A-A632A -0.0185202436791925 G613A-Y622A -0.0194783783741657 K614A-E631A 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