[Thu Aug 25 00:41:52 2016] >Input file: TM4N4RATG.pdb >TM segments: A243-249_A285-290_A312-318_A326-333_A355-362_A370-376_A390-397_A410-416_A429-435_A450-457_A482-490_A513-521_A554-564_A579-588_A606-615_A624-631_A637-646_A653-660_A686-696_A699-706_A717-723_A728-735_B82-88 MAIDEN score = 63.1225 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 ----------- ---------------- S692A-V702A 10 Q393A-V415A 10 L624A-L644A 10 S643A-N657A 10 P694A-S700A 10 K488A-L517A 10 I410A-P434A 10 Y585A-S607A 10 T561A-I584A 5.47223720384955 V579A-T614A 5.354679505376 V628A-S640A 2.65109886481798 Q486A-V519A 2.08156541704945 V519A-A557A 1.83018953762209 Y518A-N558A 1.54727447004913 D290A-L312A 1.54032720039336 Y314A-T332A 1.46655652571389 N397A-Y411A 1.38324811347798 V609A-D631A 1.27629280451038 H317A-V329A 1.27411560013658 I701A-L721A 1.26693443466892 F359A-K375A 1.21218478387046 L289A-F313A 1.09025738536879 T374A-P392A 1.06124348169838 Q393A-H416A 1.05532466374616 F327A-V361A 1.0271800360974 W693A-I701A 1.02449175863348 W693A-V702A 1.01206064884438 Y331A-F359A 1.00253683772631 V514A-T562A 0.987487746861026 Y630A-T639A 0.950202624902332 E288A-L312A 0.935835073942327 L721A-V732A 0.903863252230186 E645A-L653A 0.891187345985594 L644A-L656A 0.881821606814709 Y723A-I730A 0.874448896898526 F487A-L517A 0.87201061063989 K452A-F487A 0.871166563489023 L432A-T456A 0.839970760270325 H317A-F327A 0.830827441501729 I584A-L608A 0.819438571241563 P520A-A557A 0.807913115582815 F487A-V519A 0.775615899038846 K333A-A355A 0.75591177725228 V286A-W315A 0.733179989001869 I701A-Q722A 0.725097778865003 V489A-L517A 0.716778782645014 H431A-H457A 0.715257497820666 I584A-W610A 0.713381649063389 V372A-L394A 0.698440769393706 W315A-V329A 0.690170752246339 L653A-W693A 0.68599494495449 L289A-L312A 0.685880979136466 P434A-L453A 0.677977661122934 L394A-V415A 0.671311222283199 V702A-L719A 0.669679766569705 H416A-R429A 0.657267607477587 K375A-P392A 0.654281407230227 P392A-H416A 0.651435975300931 Q655A-V690A 0.650106112004393 Y586A-L608A 0.632306153116425 V361A-V372A 0.616431000492462 S626A-S643A 0.607840131572648 V654A-V690A 0.605579181777151 V329A-F359A 0.604712295539157 D395A-Y411A 0.603537670543926 S692A-G703A 0.603025995742351 H457A-R482A 0.602026536692189 V581A-W610A 0.594686789738811 Y585A-V609A 0.586817067962562 V628A-A638A 0.584945504764864 S88B-R659A 0.579448854820255 V519A-A555A 0.574462708022594 Y516A-N558A 0.570661898886043 Y521A-A555A 0.55573392057116 S642A-R659A 0.555504789830919 R482A-I554A 0.55481601267851 V579A-G612A 0.543369332131023 F327A-S360A 0.539910496940012 E645A-Q655A 0.539035317062118 S692A-S700A 0.526819804545097 I584A-V609A 0.518992999961874 V519A-S556A 0.513723587496454 V609A-Q629A 0.50894718793502 A451A-P485A 0.503643107092373 G627A-S642A 0.496450859248249 Y615A-L624A 0.495464464209399 G412A-V430A 0.493268894714477 L624A-S642A 0.492121490183658 P694A-I701A 0.489818073241422 K333A-K358A 0.487688634003071 G412A-E433A 0.487676269881671 V564A-V581A 0.487493162558594 L656A-V690A 0.483647431631453 S318A-F327A 0.480554419787057 I701A-L719A 0.480049707105656 L517A-V560A 0.460633690965199 V702A-L721A 0.459330156058358 S626A-S640A 0.45825133547147 G285A-W315A 0.456161766264 Q316A-K333A 0.453946356032709 I410A-L432A 0.452830072784391 V286A-Y314A 0.450701893143081 Q583A-L608A 0.449811547781879 Q486A-P520A 0.449048236860787 Y331A-Q357A 0.442767925660178 Y411A-L432A 0.438301024850994 T561A-G582A 0.436139898793861 D330A-Q357A 0.434310698319405 K452A-P485A 0.432531671303039 T435A-L453A 0.429508144024675 A557A-Y586A 0.428215922504281 F313A-Y331A 0.420966873116411 I584A-G606A 0.41641192500142 Y521A-Q559A 0.413184239881673 E450A-F487A 0.412410112399347 A557A-T588A 0.408906341498129 G285A-S318A 0.407881860829409 L656A-V687A 0.407803965479234 V654A-A689A 0.404175258179928 S360A-T371A 0.399324066205815 Q316A-N328A 0.394905739735372 V560A-I584A 0.394214024716284 H416A-H431A 0.392820089660485 Q393A-Y411A 0.392520609134362 W610A-V637A 0.385700245653569 A370A-L394A 0.384614972810403 A451A-K488A 0.382801320648143 Q486A-L517A 0.381443330320325 L653A-V690A 0.379300112877961 G703A-Q717A 0.37664627848373 A370A-A414A 0.374960771636867 E391A-V415A 0.37319821999662 Y521A-A557A 0.370172202916368 Y314A-D330A 0.369388632425845 V329A-Q357A 0.369168520140168 H416A-H457A 0.367020176215001 S640A-Y658A 0.366338520519791 A704A-L719A 0.356110557823062 K358A-P392A 0.355255709138697 I410A-T435A 0.355016429327159 D395A-A414A 0.353903681422224 Y518A-S556A 0.353484089109716 A611A-Q629A 0.352825744978842 P392A-Q413A 0.352387038145192 V690A-V702A 0.348635513008099 V702A-G720A 0.341758845381466 D490A-L517A 0.33803317845913 S643A-Q655A 0.337122714311952 L653A-S692A 0.33451119150272 Q717A-Y734A 0.329849356328366 P485A-N558A 0.32905629891265 W315A-T332A 0.327212478363744 V514A-Y586A 0.324173713058707 L312A-T332A 0.323889090464861 T332A-T356A 0.320702743417993 Y585A-L608A 0.320279406745167 W610A-Q629A 0.314375854399091 K488A-Q515A 0.311128543277198 E645A-V654A 0.310188513635045 W699A-Q722A 0.308376612927886 S88B-Q686A 0.305255030555181 K488A-S556A 0.305240747151473 Q559A-I584A 0.304742965012728 P520A-N558A 0.302010031776935 W699A-L721A 0.300347070307531 A704A-G733A 0.299873145646235 L656A-A689A 0.298285204885657 Q515A-T562A 0.297055873054803 G563A-S580A 0.29623814877987 S360A-A390A 0.293937952220415 P434A-E450A 0.293437666669162 G612A-S642A 0.292772412046773 S641A-G688A 0.291555355440735 Y615A-R625A 0.28580469075388 L394A-A414A 0.285494036875745 Y723A-Y728A 0.284449691632867 V329A-S360A 0.283564237779774 F327A-G362A 0.281956847085326 P520A-Y586A 0.281192354240793 F359A-S373A 0.27791056028333 L289A-Y314A 0.277788688203184 V628A-V637A 0.276825954218283 Y585A-D631A 0.267632445816861 E450A-N558A 0.266656960577985 N397A-G412A 0.265470191731476 T562A-Y585A 0.263542723341631 K333A-T356A 0.261304222457213 Q655A-Q717A 0.260724459945361 L608A-Y630A 0.260075561443167 T356A-K375A 0.25734559795423 S88B-N657A 0.254859792943603 L453A-V483A 0.254263453533609 R513A-T561A 0.253138330416851 K358A-Q393A 0.252371942696861 V361A-S373A 0.251748548244991 G720A-R731A 0.251656138017908 A87B-S642A 0.250656525206342 P485A-L517A 0.250543443778936 E450A-P485A 0.249636951675571 D613A-Y630A 0.248696585413682 T371A-V396A 0.248452876644849 Q722A-I730A 0.247889710384635 L517A-N558A 0.247728310355052 L394A-Q413A 0.244869627651497 W610A-V628A 0.244694606977411 T86B-Q686A 0.243202985690978 P694A-W699A 0.242423100506604 K375A-Q393A 0.242226938029002 G627A-N657A 0.24214926593689 G412A-L453A 0.242046194390351 T561A-T588A 0.241749406444832 T588A-L608A 0.241723287256521 V372A-P392A 0.240467334422708 Q357A-E391A 0.239287171072651 D330A-T356A 0.238791220501356 R326A-S360A 0.238131062680233 A87B-S643A 0.236127134925708 E450A-D490A 0.235463980999842 G612A-A638A 0.235422369424183 E450A-Q515A 0.235235101371436 A638A-R659A 0.235222893104235 V654A-W693A 0.235054845600722 V430A-H457A 0.232503759663501 D290A-Y314A 0.232307301788683 F487A-Y518A 0.232223523966803 Y646A-A689A 0.23007651669285 L432A-A455A 0.229983894909938 S373A-L394A 0.229479361417893 S580A-S640A 0.229317986221615 D490A-Y518A 0.226960805327693 S580A-S642A 0.225870383095079 L517A-T562A 0.224151913167554 V560A-Y586A 0.223269984414216 Y521A-F587A 0.22298536354044 K375A-D395A 0.222412290879271 Q84B-Q316A 0.222261641153083 F487A-Y521A 0.220000236137306 S318A-R326A 0.218463830939162 P520A-Q559A 0.217680956074629 V579A-Y615A 0.216326259831524 G703A-Q722A 0.215661240114061 S580A-Q629A 0.215295923647318 Q629A-S642A 0.211609062407058 E288A-Y314A 0.211250174960334 D490A-V564A 0.211189366110253 L653A-V702A 0.20989976908564 L394A-V430A 0.207957631276446 H457A-V483A 0.207799501454105 R659A-A689A 0.207143331035242 E645A-G688A 0.206827534147587 Q413A-L432A 0.20516533752621 L517A-A557A 0.204258541509758 L653A-A691A 0.203874565508642 K358A-H416A 0.201611404757372 I410A-T456A 0.200743499884543 A414A-H431A 0.200464015764476 S373A-A390A 0.199904996923195 V628A-T639A 0.199684938574657 V514A-V560A 0.199411667638742 S373A-H416A 0.198154446361514 V654A-Y706A 0.197391599572496 K358A-E391A 0.193807217438036 T374A-D395A 0.193676948730108 H431A-R482A 0.192453019830543 K358A-D395A 0.191791615864112 Q486A-N558A 0.191787176124957 Q413A-P434A 0.191076601910527 Q655A-Q686A 0.190534687608241 H431A-K452A 0.190185162579278 A87B-T639A 0.187315456773397 T356A-Q376A 0.185308040522339 V372A-V396A 0.183556068565601 G582A-L608A 0.183436283752851 W693A-W699A 0.182923504435 H317A-K333A 0.181775148686748 L453A-Q486A 0.181487753256583 K333A-Q357A 0.181379070581359 G627A-A638A 0.180343296146809 A451A-F487A 0.180291974604378 Y518A-Q559A 0.180259769056667 R429A-H457A 0.180147679823493 G285A-D330A 0.179883938092615 Q413A-R429A 0.178841843496949 Y660A-Y706A 0.178771831424862 Y585A-Y630A 0.178628455273195 V396A-L432A 0.178376320556326 S643A-Y706A 0.177704334187374 G563A-V609A 0.176931740099656 R513A-D613A 0.176890691316393 T561A-F587A 0.176415870783027 S88B-A689A 0.174171201929271 G362A-N397A 0.173462653935057 W610A-G627A 0.17339462381995 T614A-T639A 0.172643530790725 N328A-K358A 0.172331702930854 F359A-H416A 0.171408568618322 L432A-V483A 0.17099494596602 A611A-D631A 0.169479862192334 K452A-A557A 0.168600787267104 V286A-Q316A 0.167791810221312 G582A-A638A 0.167263871234752 Y516A-G606A 0.166323255493253 Y516A-S556A 0.166151420239193 F487A-Y516A 0.165600384903581 T371A-A390A 0.165280259498917 G606A-A611A 0.165254477638723 I695A-S700A 0.164964596557356 D613A-T639A 0.164859434815742 V690A-G720A 0.164554018416784 K488A-T562A 0.163855212835148 E288A-W315A 0.16182386675208 S580A-R625A 0.161782226780667 Y585A-G606A 0.159019125164805 D613A-V637A 0.15742643721558 Y516A-Y586A 0.15739972345285 A87B-V690A 0.15631354142339 V489A-A557A 0.154940089023721 D85B-N657A 0.154878487327162 W610A-S640A 0.153862169558642 N328A-D395A 0.15363996574636 Y331A-S373A 0.153037417819382 Y706A-Y734A 0.152271698993494 T614A-Q629A 0.152097656579604 Y615A-Y646A 0.151224935784547 I410A-K452A 0.150717652293989 T332A-T374A 0.150077184427736 H317A-T332A 0.149841192998191 S360A-Q376A 0.149777107204486 G612A-V628A 0.149705354028215 Y630A-S641A 0.149564254349841 Q357A-Q393A 0.149070623461199 D85B-R659A 0.148805662492354 L644A-N657A 0.148805297928704 S373A-N397A 0.148740523350629 A455A-V519A 0.148167824428859 I695A-V702A 0.147518261807031 I410A-E450A 0.147004076053342 E433A-I554A 0.146978834384484 R482A-A555A 0.146099416971686 K452A-S556A 0.145303560840984 T562A-G606A 0.144865768446004 Y411A-P434A 0.144582493543884 T639A-R659A 0.144555811310077 F359A-T374A 0.144399979506138 L656A-G688A 0.144196795156006 L721A-G733A 0.144194470153948 K358A-T371A 0.144144239186505 A611A-G627A 0.143909677424894 V560A-S607A 0.143778127026955 F587A-G606A 0.143396356665413 Q686A-A704A 0.141880029081754 V564A-V609A 0.141386489288799 S318A-Y331A 0.140994115029969 L432A-P485A 0.140984023272864 A611A-S626A 0.140113565628939 K488A-R513A 0.13978908560513 S318A-S373A 0.139470223940678 T588A-S607A 0.1370670212106 V581A-S626A 0.136676083610183 Y586A-G606A 0.136314366078916 N558A-L608A 0.136044157933553 S373A-V396A 0.13521904739573 P520A-T588A 0.134937411783933 E450A-V489A 0.134604553573791 G606A-Y630A 0.134512063970355 V514A-V609A 0.134339306702787 A451A-D490A 0.134252729407531 N558A-S607A 0.134240054253647 S700A-G733A 0.133683877089013 E433A-E450A 0.133398011640266 S373A-E391A 0.133277955535184 V286A-F313A 0.131633183173973 D490A-R513A 0.131543731097317 Y521A-Y586A 0.131432314606844 A87B-Y705A 0.131270219146963 V560A-F587A 0.130386612190659 V560A-L608A 0.130238725180469 N397A-A414A 0.130158096084575 T435A-T456A 0.128775565910346 A390A-V430A 0.128703391782274 S318A-G362A 0.127820328426774 Q583A-W610A 0.12773232110569 V637A-R659A 0.127349631988478 L624A-L653A 0.127219573668337 D395A-G412A 0.125961655878343 A611A-Y630A 0.125654245047465 Y705A-Q717A 0.124793290193681 N397A-Q413A 0.124614109986418 A451A-S556A 0.124384311471725 Q316A-R326A 0.124117838122254 R513A-Q559A 0.123749062259359 D631A-S640A 0.12351298247374 R482A-P520A 0.123084965488288 L453A-P485A 0.122816404787875 L721A-Y728A 0.122671117512288 D290A-W315A 0.122216386789038 G362A-T371A 0.121534094196816 V581A-V628A 0.120578602630701 F327A-Q393A 0.120055389383911 G627A-R659A 0.120028116668293 T86B-N657A 0.119658231854541 T562A-G612A 0.119468081764716 S360A-A414A 0.118649227491535 L312A-Q357A 0.117894595614636 Q316A-V329A 0.117773453501366 S626A-Y660A 0.117743233586157 S318A-Q357A 0.117324052234538 V702A-G733A 0.117127210384731 V560A-Q583A 0.116586132202827 N657A-Q686A 0.116159939323505 S626A-T639A 0.115407472851894 T371A-P392A 0.115142578828451 S641A-L656A 0.115095955049981 A87B-R659A 0.114139709415356 H317A-V361A 0.113805671403923 F313A-T332A 0.113702026677194 V579A-S626A 0.113560304124753 V396A-G412A 0.11325372008772 S580A-S641A 0.113176613438936 S692A-W699A 0.111751970654503 Q559A-T588A 0.111707704700171 N328A-K375A 0.111683221737221 T435A-E450A 0.111627058252002 V361A-V415A 0.11097511328334 G582A-T614A 0.110804883631365 V514A-I584A 0.110504279743763 L453A-P520A 0.110346749550247 T562A-I584A 0.11033569572086 A557A-F587A 0.109895435822732 A87B-A689A 0.109619338233773 A557A-S607A 0.109251197995386 V581A-G612A 0.109138898241157 S692A-Q717A 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