[Wed Aug 24 18:49:17 2016] >Input file: TM3LLQCGD.pdb >TM segments: A36-73_A78-99_A129-151_A158-176_A200-225_B234-255_B366-386_B390-409_B437-459 MAIDEN score = -95.0607 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. ----------- ---------------- BBeads pair Empirical energy ----------- ---------------- L48A-P161A 2.00067685263473 L48A-I162A 1.07846302743492 A73A-K222A 0.897669263474328 I379B-W455B 0.811651639002338 F36A-H172A 0.810455480349484 Y52A-V380B 0.803483906469774 I371B-V446B 0.786364610745901 I137A-V212A 0.786314791306598 I145A-W221A 0.769880543098749 L45A-L400B 0.724315090810707 N63A-V85A 0.718877996860072 V380B-I398B 0.713005509026484 F43A-L168A 0.670779187509149 L45A-A401B 0.667207142629016 V146A-I164A 0.662694641449225 L70A-A218A 0.661027538432837 L144A-A218A 0.655944846013897 V47A-I164A 0.654168240901145 V85A-A90A 0.640163563712667 V68A-A73A 0.626863929580843 A65A-V212A 0.61556423334887 I145A-S150A 0.611674996734577 E136A-V212A 0.59782654372846 E370B-A375B 0.586478456321206 I135A-S175A 0.585108369391947 V146A-A160A 0.582756706840446 A73A-W221A 0.577761350318677 E136A-A141A 0.57625538623784 P161A-L166A 0.572902359380807 F43A-G165A 0.572753460725935 A40A-L173A 0.570340993612012 V68A-I211A 0.569882967370275 F143A-A167A 0.565391042723777 L378B-A452B 0.56076367438458 V146A-A167A 0.560331433601753 F377B-G451B 0.558162347466499 F377B-A401B 0.554011576696796 A40A-L170A 0.551494091108577 A40A-T169A 0.546812710887878 I147A-A160A 0.545564217407843 I379B-S384B 0.543921608030763 L48A-I164A 0.54145553386816 V54A-G383B 0.541407475553464 P83A-Q88A 0.540455832678645 L48A-A397B 0.539980199362285 P395B-L400B 0.539717542690659 V47A-Y52A 0.536380044346167 V380B-A401B 0.535764619575998 I369B-S409B 0.535721581120757 A42A-L407B 0.530998158495864 E370B-V446B 0.526166494610569 P64A-Q88A 0.51898485548747 L249B-C254B 0.518569614078194 G158A-P390B 0.497418903277296 I381B-I398B 0.49565997472903 F43A-T169A 0.495153711150429 I137A-P210A 0.494563308103805 G44A-I164A 0.493543437642941 N63A-Q88A 0.486798055331601 I371B-P444B 0.486291117235705 V39A-H172A 0.476482340505633 A375B-V446B 0.475491657944333 W204A-A209A 0.47431931763929 I381B-A394B 0.473933123308742 L139A-I171A 0.465944162232642 L373B-I405B 0.456030636300436 F143A-G214A 0.455187560444854 L373B-P444B 0.454094003477017 I220A-G225A 0.451819966357018 T46A-A51A 0.451366832208535 A65A-T140A 0.451036521480906 F36A-I176A 0.445559458037408 F376B-I381B 0.443254907565202 T37A-H172A 0.439015699627403 A53A-I381B 0.432544855749416 Y52A-A397B 0.425017387812037 P64A-I211A 0.424997776252236 F143A-G217A 0.423122355718149 S150A-A163A 0.421714010655818 K238B-F243B 0.419327515662469 A141A-V212A 0.419220197423483 T46A-G165A 0.418239746947993 T140A-G217A 0.416246505387002 I147A-I164A 0.414262387297247 F142A-I147A 0.412702046358063 F377B-G448B 0.401520778273552 V68A-L81A 0.400731679392834 I371B-G448B 0.400293652080443 F36A-L173A 0.40012786696985 T49A-A401B 0.398370907484861 A53A-I379B 0.393247280806498 S384B-A397B 0.390536328507296 N63A-Y84A 0.388354828819453 A73A-V219A 0.387858874981442 S67A-Y84A 0.384072411083993 L368B-A443B 0.381241069660871 A65A-I211A 0.37999633237107 I454B-G459B 0.378258503362532 A40A-L168A 0.377486389280395 V82A-A87A 0.377187198535552 A42A-A167A 0.376817231760004 A51A-A394B 0.375907650627041 T374B-G451B 0.374783912330382 L439B-P444B 0.374558659440678 I137A-G214A 0.372880681263973 W438B-A443B 0.372248996153568 L134A-A209A 0.3722234149431 T49A-V380B 0.37148642360446 M50A-W455B 0.368244345939139 I137A-I211A 0.36635101868251 H61A-Q88A 0.366242588398414 T374B-I445B 0.360708662248239 L45A-L404B 0.359304649677528 T49A-L400B 0.358444867409258 F143A-I164A 0.356779510911847 F377B-I398B 0.35627730513783 A53A-L382B 0.355425593264501 V66A-L144A 0.353843555181558 I371B-I445B 0.35178598439441 T140A-V212A 0.351340099585107 L139A-G213A 0.345396125099509 L45A-M50A 0.342996834492547 T374B-V446B 0.341754368405713 L373B-G447B 0.341060786913643 V47A-P161A 0.340446861809757 M50A-V66A 0.336433635386711 V380B-A397B 0.332888535276275 G38A-L407B 0.332204008347721 P161A-S384B 0.331428611348562 M50A-G60A 0.331003162838035 A53A-G158A 0.329757373840002 L205A-P210A 0.328365634142596 E242B-F247B 0.327739307520191 W248B-G253B 0.32504021040576 A53A-A401B 0.324191855826083 A73A-G149A 0.323174995856822 M50A-G55A 0.318278548108251 V146A-A163A 0.317663738227955 G383B-A391B 0.31738360715173 G69A-G149A 0.313894574872818 G165A-A397B 0.313184761183913 G44A-G399B 0.312859828048256 H61A-S80A 0.31231723834339 F142A-G217A 0.310060530223786 W441B-V446B 0.308564003620272 I137A-F142A 0.304753635541209 P64A-V85A 0.304680946710365 T37A-L173A 0.304043757098601 G44A-G60A 0.301818823695832 L382B-W455B 0.301076094065046 I445B-A450B 0.300585053976077 A132A-L205A 0.299977480530198 P210A-A215A 0.297702160965534 I371B-A450B 0.297534187855464 G56A-A160A 0.296535431143689 I137A-A216A 0.296235586390176 L41A-L168A 0.295690247281128 A366B-L439B 0.29556945847384 L367B-L439B 0.294565450070922 V39A-L407B 0.292719438158823 P64A-L81A 0.292398986827823 T374B-A450B 0.289823055352015 G69A-Y84A 0.288983339048835 L378B-G459B 0.285160756212802 V72A-A215A 0.284733395607098 T385B-A394B 0.284053600191762 L48A-G59A 0.283004773767025 L148A-G214A 0.282741293212543 T151A-A160A 0.282179477918943 F243B-W248B 0.282037307968578 S384B-P390B 0.281719491764534 G253B-L402B 0.281014938571721 T140A-I211A 0.280990542858748 F376B-G451B 0.280525486008871 L70A-G213A 0.278637501391834 A141A-A218A 0.278427481260972 M50A-H386B 0.277016182289522 G158A-G383B 0.276780301365459 G165A-L400B 0.276386554396715 L249B-G399B 0.275314071415407 L133A-L205A 0.275246052990553 L382B-G448B 0.275079508414455 I211A-A216A 0.272931735266323 T49A-P390B 0.2721377286509 G60A-A87A 0.271020960586427 M50A-N63A 0.270390408257798 C254B-H406B 0.268887835620006 G158A-G165A 0.268789935646687 S58A-G459B 0.268220181090673 A375B-A401B 0.265999477438344 A141A-A167A 0.26525467538979 S58A-A87A 0.264633585000672 Y52A-G399B 0.26391452253001 I135A-A209A 0.263774630822278 T140A-W221A 0.262898358284831 L144A-S150A 0.262685678523458 Q202A-P210A 0.262100806211869 G69A-L144A 0.259684847967041 A375B-A452B 0.258403617965822 T374B-W455B 0.25663019769704 L48A-A160A 0.256408842951354 T37A-A42A 0.256218551622343 G60A-A65A 0.255773707172207 L144A-G225A 0.255729320872574 L45A-G165A 0.255310924053727 G158A-F393B 0.254868718836434 A51A-A160A 0.254044682890266 T49A-I398B 0.25349843935273 G60A-L70A 0.249110962750247 G44A-A160A 0.248423819686357 G59A-G158A 0.247200726571787 L48A-G383B 0.246964097820608 V39A-T169A 0.246440110560364 L148A-W221A 0.246369549680555 S67A-G217A 0.245393395440252 I372B-F377B 0.243685097337538 G38A-L168A 0.242894793257105 I138A-G213A 0.242127736858604 T140A-L170A 0.241878615525103 G59A-G69A 0.240624369490417 T71A-L144A 0.238983420244547 S80A-Q88A 0.23755113210182 G392B-G399B 0.237521431593925 T385B-W455B 0.236005026642257 V250B-G255B 0.233691165160344 V380B-I454B 0.23257761240877 S67A-G213A 0.232358426760758 V380B-A394B 0.231764684723398 T140A-A216A 0.230987919765374 H61A-P161A 0.230185118481583 Y52A-F62A 0.229745691447731 A160A-F393B 0.228928748294816 V39A-I405B 0.22679092043397 T374B-L404B 0.226617045729946 V54A-V380B 0.226518343488792 G253B-G399B 0.226076668592174 G55A-N63A 0.225803761913079 F377B-A394B 0.225296862471794 G59A-L148A 0.224846488468779 L41A-T169A 0.219642792634421 P444B-A449B 0.219463373018696 S150A-F159A 0.219131687056477 A65A-S80A 0.21773225335293 S384B-F393B 0.217384893220364 S150A-G165A 0.217127359294892 P64A-L205A 0.216862271792362 L48A-T169A 0.21646753197323 L139A-P210A 0.215787689975256 I135A-T140A 0.215561079779327 L48A-A53A 0.214558606850868 V47A-I396B 0.213913087696673 F143A-A160A 0.21321454169065 T374B-H406B 0.213057787510684 F142A-V219A 0.2124008747595 T374B-W441B 0.212311077436675 G69A-V146A 0.21216731905467 T151A-W221A 0.211799827455542 L70A-T151A 0.211548495711625 T140A-H172A 0.209889349619358 G55A-T385B 0.209823351859899 H61A-G214A 0.209489699951045 L41A-P161A 0.209180666630925 G60A-G69A 0.208375055869186 A42A-T169A 0.208199504940712 V146A-I220A 0.208014578905101 H61A-T71A 0.207427293894468 F159A-A397B 0.206665728491073 V72A-V219A 0.205743391653599 T140A-W207A 0.205241969459111 S384B-G399B 0.205177645150407 T71A-A218A 0.204210523619892 H61A-L81A 0.204186138878565 I369B-T374B 0.203724825081851 A375B-K456B 0.203711161184037 S67A-L81A 0.202514943568755 G158A-A397B 0.201952675134005 G383B-A452B 0.201286750071568 L45A-P395B 0.201278064848151 A375B-P444B 0.200068881128905 V39A-I174A 0.199469311382876 I135A-G213A 0.199423819279143 L144A-P210A 0.19900015934161 I379B-G459B 0.198982833208635 I369B-A443B 0.198276730978954 A51A-G60A 0.197461883561387 G60A-G158A 0.197043017639713 G59A-T71A 0.196957178017211 V68A-V212A 0.196932622957194 V66A-V72A 0.19674114264471 A141A-K222A 0.196343333153408 H61A-V146A 0.194415093736583 I93A-A98A 0.19421707262876 A51A-G56A 0.194211785318754 F376B-V446B 0.19376941939686 T49A-H386B 0.193744620731649 L144A-G149A 0.192541507367369 T46A-T374B 0.191483792282917 F376B-V453B 0.190215488675384 T37A-A167A 0.18975426957818 E136A-G213A 0.189089899213753 F247B-G252B 0.188951141173284 G158A-T385B 0.188949307841411 I137A-G213A 0.188557981073755 T246B-G255B 0.188483083763664 A40A-I171A 0.187661930983889 I371B-G451B 0.186353727116128 V39A-L404B 0.186190133192405 I145A-A160A 0.185153402783008 S67A-V212A 0.18436091019661 V39A-L168A 0.184157535832417 G214A-G225A 0.18376350079809 T140A-G165A 0.183537831412197 P64A-L144A 0.183233017771182 M50A-L402B 0.182465001203198 P390B-P395B 0.182148860787381 V39A-L45A 0.182032590356592 L382B-P390B 0.181756076594827 F159A-F393B 0.180950542940947 L378B-P395B 0.180888246745855 T71A-A78A 0.180402907199321 M235B-L240B 0.180202011565719 G383B-L457B 0.179715270032998 L133A-G214A 0.179605367190813 L367B-G448B 0.179463108157871 G38A-G165A 0.179216501627096 L139A-G165A 0.178626957227275 G38A-L402B 0.178258107949313 I145A-G225A 0.177916960726616 G69A-L139A 0.177664002464422 F43A-N63A 0.177363727530047 I369B-G447B 0.177294243204718 H61A-T140A 0.177165831535167 N63A-G213A 0.176585762953331 N63A-L208A 0.175655513300495 V94A-L99A 0.1755452418323 T46A-I381B 0.175066936923982 T46A-A401B 0.174944212289407 G56A-H61A 0.174913328946388 G253B-H406B 0.174792382171231 M50A-L373B 0.174764188865575 I372B-G447B 0.174716639399385 M50A-V380B 0.174479794092171 G44A-A397B 0.174177011784535 H61A-V82A 0.173558005779821 T49A-T169A 0.172833791694473 H61A-P83A 0.172396157825448 H386B-K456B 0.1722669917477 H61A-F159A 0.171662426730011 F159A-H386B 0.171453322554441 H61A-S67A 0.171262525545642 L382B-P395B 0.171031093910595 A95A-I372B 0.169560625021924 V47A-V146A 0.169517253262501 A167A-I174A 0.169296188584921 G55A-H386B 0.168922351527781 F62A-V68A 0.167990762154314 Y84A-V89A 0.167520943526963 G56A-A394B 0.16665862375975 I137A-G217A 0.165806957996862 A401B-I408B 0.165630089817156 P161A-L400B 0.165243043122337 H61A-G165A 0.16496926657314 A65A-V146A 0.164674651015978 I371B-I454B 0.164148688435511 A51A-G149A 0.163679011465825 G60A-A397B 0.163637352315556 G56A-A397B 0.163525557534014 S131A-L208A 0.163457142320168 T37A-H406B 0.162698941669195 L70A-P210A 0.162515365971425 T71A-T151A 0.162072605225316 G245B-C254B 0.160884515307134 I162A-I398B 0.159912852524694 I137A-I220A 0.159383099626108 L144A-G214A 0.159258695641403 G252B-L402B 0.158912582244525 V72A-G213A 0.158562136174886 F36A-L41A 0.15813386610928 T46A-F377B 0.157928997860458 E370B-G451B 0.157804172307445 I135A-I174A 0.157498297935316 F43A-S175A 0.157279014182588 I371B-A443B 0.157052113899191 A42A-L404B 0.156992999160088 F440B-I445B 0.156862008095684 G60A-G214A 0.156697610940213 G399B-H406B 0.156408084560721 W207A-V212A 0.156339972225416 V146A-G214A 0.156040554769093 I379B-A394B 0.155859450167897 G149A-G217A 0.155599556344848 F377B-T403B 0.154111260349813 A65A-W207A 0.153897527471134 H61A-L144A 0.153485174365372 G55A-V380B 0.153039267055038 L139A-W207A 0.152576114653801 T246B-C254B 0.152377567449064 A375B-A449B 0.152204475011324 G149A-L223A 0.151710459040608 T151A-P161A 0.151465828933154 F159A-A391B 0.151416338851572 I369B-I408B 0.151408776392574 T37A-T46A 0.15131826636862 T385B-P395B 0.150742577618943 V66A-I147A 0.150618743216386 L148A-G158A 0.150602313591904 T140A-I145A 0.150521466892383 T71A-L81A 0.15045303689954 G149A-A218A 0.150342843943164 S58A-V66A 0.150193950304969 A132A-I211A 0.150132632389048 A366B-I445B 0.150127749949379 I164A-A397B 0.149804676598601 A97A-I372B 0.14967216928279 A163A-I396B 0.149460725731095 G383B-G451B 0.149028410626324 T151A-K222A 0.148938100689549 N63A-S79A 0.148875525160715 G60A-G165A 0.148625368627775 I171A-I176A 0.148315702138156 G158A-I396B 0.147982039898036 T46A-H406B 0.147636664890368 G56A-A391B 0.147602053409537 L41A-L404B 0.147099227655356 H61A-A78A 0.146623782564974 T71A-W221A 0.146473980877593 G44A-G55A 0.146253662450751 T49A-F159A 0.146119803779513 Y52A-A401B 0.146096458155212 V54A-S384B 0.146004879988551 G383B-A450B 0.145865869754843 E370B-G447B 0.145538844304323 A65A-A215A 0.144935750306045 V146A-T151A 0.144804662375071 A141A-A215A 0.144629505171234 T71A-G213A 0.144538587698922 L373B-G399B 0.144353463090185 F43A-F143A 0.144126561895295 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