[Wed Aug 24 18:09:16 2016] >Input file: TM3J08CGD.pdb >TM segments: A12-31_A34-51_A72-90_A94-111_A242-265_A274-296_A578-602_A608-636_B655-675_B680-696_B717-735_B740-757_B887-909_B920-941_B1223-1247_B1253-1281 MAIDEN score = -139.7518 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 ----------- ---------------- L666B-I926B 1.24978441851053 L21A-I281A 1.24960126227767 K579A-L632A 1.17952629239737 K1224B-L1277B 1.17938205177075 L747B-E1258B 0.956780156746868 L102A-E613A 0.956725179264557 V35A-F95A 0.926195114501731 V680B-F740B 0.926028409164203 F671B-L682B 0.897942475473129 F26A-L37A 0.897598891424829 V931B-I1240B 0.886746413202237 V286A-I595A 0.886065851903949 A658B-D889B 0.860764891971252 A13A-D244A 0.860607853774254 H25A-L37A 0.816592126544501 H670B-L682B 0.816578983258066 I27A-L37A 0.810815355656655 I672B-L682B 0.810811958327758 I44A-L103A 0.753181191890238 I689B-L748B 0.753058897177549 V727B-L746B 0.732358147304237 V82A-L101A 0.732216192863359 I580A-S630A 0.702947378608948 I580A-L631A 0.702789418842378 I1225B-S1275B 0.702678386063457 I1225B-L1276B 0.702395504023074 F671B-L683B 0.69569874193704 F26A-L38A 0.69568907222479 L655B-F660B 0.687346460597187 V928B-I1240B 0.642424334881373 V283A-I595A 0.642408029190165 A906B-L1247B 0.626673182795036 A261A-L602A 0.626532545927938 A618A-V624A 0.617942242180081 A1263B-V1269B 0.617835137723168 V931B-L1239B 0.613115271717834 V286A-L594A 0.612527078054781 P596A-L601A 0.608402441969082 P1241B-L1246B 0.608171170795204 F1255B-A1260B 0.601361337469919 F610A-A615A 0.601260761085278 L686B-V745B 0.598667124105265 A282A-F610A 0.598492350863566 L41A-V100A 0.598396662280592 A927B-F1255B 0.598380861348629 V680B-Y741B 0.591812798757002 V35A-Y96A 0.591775712177002 S726B-L746B 0.586194930658793 S81A-L101A 0.586145833412839 F250A-A287A 0.584493410166354 F895B-A932B 0.584361379076492 A927B-R1256B 0.583663528591472 A282A-R611A 0.583354172353239 L102A-P612A 0.576647508094873 L747B-P1257B 0.576467221419275 V931B-Y1235B 0.570392886433495 V286A-Y590A 0.570391556201838 V930B-G1261B 0.563207698832001 V285A-G616A 0.562807533469374 A598A-F610A 0.543282388985362 A1243B-F1255B 0.543008582603992 F723B-A749B 0.537906512428967 F78A-A104A 0.537821217840944 F22A-L102A 0.532598113838336 F667B-L747B 0.532575520361271 L41A-S99A 0.52625977990372 L686B-S744B 0.526119053130563 F667B-L748B 0.523227462789023 F22A-L103A 0.523200385649379 A940B-V1272B 0.52265273431519 A932B-V1237B 0.522604851265625 A287A-V592A 0.52252744143351 A295A-V627A 0.522398650624288 F690B-L748B 0.516197126222232 F45A-L103A 0.516080441905801 A669B-F922B 0.514246942208312 A24A-F277A 0.514028228350363 L101A-P612A 0.51294266135444 L746B-P1257B 0.512270327858376 Y46A-I51A 0.497094559554596 Y691B-I696B 0.496980862620518 I689B-S694B 0.487343427566233 I44A-S49A 0.485995909101229 A291A-M619A 0.479699075394939 A936B-M1264B 0.479690070654063 L655B-R755B 0.477563791575333 T924B-A1243B 0.47645463922593 T279A-A598A 0.47630305299915 A685B-V745B 0.4674101564607 A40A-V100A 0.46716092854809 V82A-A104A 0.463458843295225 V727B-A749B 0.463407070959005 K1226B-W1231B 0.454004162055035 K581A-W586A 0.453552064177866 L79A-S84A 0.451520551313177 L724B-S729B 0.451311056680089 I926B-P1257B 0.439491039983942 I281A-P612A 0.439264913830735 N1228B-V1271B 0.427619701571158 N583A-V626A 0.427563598749205 Q582A-L631A 0.416723075418368 Q1227B-L1276B 0.414265317683279 V257A-A599A 0.41114280327364 V902B-A1244B 0.410987835009752 V663B-L929B 0.403347999879931 V18A-L284A 0.403295150745391 L21A-S99A 0.403117829918826 L666B-S744B 0.40279153012497 K579A-I584A 0.40221528688324 K1224B-I1229B 0.401961323240281 P735B-E742B 0.40154289941233 P90A-E97A 0.401368568779473 K245A-F250A 0.400516793544294 K890B-F895B 0.400285152508862 I44A-S81A 0.397503945624443 E613A-A618A 0.397263854995856 E1258B-A1263B 0.396507801532046 A940B-V1269B 0.396426935382335 A295A-V624A 0.396301620682544 I689B-S726B 0.396048687208943 W1231B-M1266B 0.393960857771907 W586A-M621A 0.393895607254537 A936B-V1269B 0.39099443916531 A291A-V624A 0.39096501431442 A14A-P289A 0.390401935025787 A659B-P934B 0.390101559764643 P289A-N591A 0.387329978330193 P934B-N1236B 0.38730687159678 W586A-N591A 0.386878580925066 W1231B-N1236B 0.386876089019092 I44A-A104A 0.380886014318725 I689B-A749B 0.380275950277461 A258A-A282A 0.377527353715307 A903B-A927B 0.377331406262122 A597A-A615A 0.375870256535516 A1242B-A1260B 0.37586167814608 A587A-A628A 0.375700625913467 A1232B-A1273B 0.375467865209244 F723B-L753B 0.374891845194643 F78A-L108A 0.374783045384474 A287A-A597A 0.374189984409043 A932B-A1242B 0.373795314111294 A936B-A1260B 0.373094516450004 A291A-A615A 0.373067785860769 L751B-T756B 0.372200847613682 L106A-T111A 0.372140457369354 N1236B-P1241B 0.367886785814044 N591A-P596A 0.367850145977154 A921B-A1243B 0.365376236556083 A276A-A598A 0.365213804045736 P289A-W586A 0.36307976406936 P934B-W1231B 0.362925548146819 A40A-A104A 0.362728278557575 A685B-A749B 0.362690254374331 T743B-L748B 0.3595483574579 T98A-L103A 0.359279120512337 P596A-P612A 0.35809454722357 P1241B-P1257B 0.358093609046429 G17A-Y249A 0.356531114786552 G662B-Y894B 0.356472383997315 A24A-A282A 0.354974161690966 A669B-A927B 0.354924290960287 P42A-S81A 0.352683342624161 P687B-S726B 0.352510509849949 Y249A-V283A 0.350721677886635 Y894B-V928B 0.350698746938203 V283A-A598A 0.345717009449528 N1236B-P1257B 0.345630262890218 N591A-P612A 0.345623666274912 V928B-A1243B 0.345448314704365 G693B-L752B 0.343105206791138 G48A-L107A 0.342931652064444 K579A-L631A 0.340215834895282 H25A-L38A 0.339853455575076 H670B-L683B 0.339022725131048 T85A-E613A 0.338899331164035 T730B-E1258B 0.338859697806027 I1240B-G1245B 0.337354464761724 I595A-G600A 0.336904080524054 K1224B-L1276B 0.336585267459098 K245A-P252A 0.33124556458113 C288A-R611A 0.330975262754664 C933B-R1256B 0.330766284989718 K890B-P897B 0.330684301094755 A659B-C933B 0.329571414594775 A14A-C288A 0.32918887868613 A940B-A1273B 0.32736558738099 A295A-A628A 0.326852566899023 W586A-V627A 0.326144133936327 W1231B-V1272B 0.325475777381511 G754B-A1265B 0.325330917935828 G109A-A620A 0.325161934310451 A1232B-S1268B 0.323723727695917 A587A-S623A 0.323462774796892 P675B-Q681B 0.322782395284801 P30A-Q36A 0.322730419157169 A40A-S84A 0.322333853660521 A685B-S729B 0.322196061701824 L256A-A261A 0.32212108460417 L901B-A906B 0.322064643390967 I580A-F585A 0.321042321415378 S49A-A77A 0.320915481093508 S694B-A722B 0.320713695945463 I1225B-F1230B 0.320490895879455 G293A-A628A 0.319138228582096 G1261B-M1266B 0.319132463441536 G48A-A76A 0.318903905933623 G938B-A1273B 0.318897532631339 G616A-M621A 0.318739944427496 G693B-A721B 0.318736299154183 A1265B-A1273B 0.316281580774003 A620A-A628A 0.315983926506309 Y249A-V592A 0.313638686963359 Y894B-V1237B 0.313231814426873 G662B-G754B 0.312465454463152 G17A-G109A 0.312441973825456 L601A-V608A 0.311896736278774 I251A-C290A 0.311688802078589 I896B-C935B 0.311486436327475 A927B-G1245B 0.311067291876893 A282A-G600A 0.310857700311835 L1246B-V1253B 0.310568804633078 C288A-M619A 0.307629143215499 C933B-M1264B 0.307508703983686 A932B-L1239B 0.307177177966857 A287A-L594A 0.306951162352181 S578A-L631A 0.306136242843704 C935B-V1271B 0.306095520573656 H670B-Q681B 0.306051913478406 C290A-V626A 0.305953922798686 A749B-A1265B 0.30563146393091 H25A-Q36A 0.305567917972494 S1223B-L1276B 0.305531938644342 K579A-S625A 0.305377153084634 A104A-A620A 0.305162689660154 K1224B-S1270B 0.30506882322065 I904B-Y909B 0.304732932309249 I259A-Y264A 0.304238040931314 A14A-G109A 0.303745757256564 A659B-G754B 0.303725907132007 G693B-A725B 0.302997128162581 L594A-A599A 0.302903600160997 L1239B-A1244B 0.30282348178489 G48A-A80A 0.302818236929218 A685B-S692B 0.300200968260777 A40A-S47A 0.300126571470445 I689B-V745B 0.29978932199834 I44A-V100A 0.299757096063252 V657B-Y894B 0.29950398466287 S99A-G616A 0.299414551545934 S744B-G1261B 0.299359759464805 V12A-Y249A 0.299232986139888 L19A-A24A 0.295808714789361 L664B-A669B 0.295717671342631 T253A-P596A 0.295351182593992 T898B-P1241B 0.29535006403767 R611A-G616A 0.294453288772282 V246A-C290A 0.294357267621096 V891B-C935B 0.294217430598962 R1256B-G1261B 0.29387933804932 D889B-Y894B 0.293072633634535 D244A-Y249A 0.293001422531926 A243A-G293A 0.292468500672481 A888B-G938B 0.292106777804872 G75A-A104A 0.292022058559041 G720B-A749B 0.291942119014096 V286A-A615A 0.290846578432452 Q582A-V627A 0.290687664963801 Q1227B-V1272B 0.290508395794797 V931B-A1260B 0.290141650600136 D244A-F250A 0.283053589959421 D889B-F895B 0.28271268871605 L900B-S905B 0.28246303364566 L255A-S260A 0.282339705683446 L686B-L748B 0.281416295807643 G17A-H25A 0.281339789040757 G662B-H670B 0.281276829907807 L41A-L103A 0.28124796641498 A287A-L588A 0.280739543283121 A932B-L1233B 0.280733960513611 G718B-L753B 0.2797955343566 G73A-L108A 0.27973552384675 Y1235B-P1257B 0.278298847882574 Y590A-P612A 0.27827275290848 S744B-A749B 0.276882021397812 S99A-A104A 0.276488076881703 G938B-N1228B 0.275116650938568 G293A-N583A 0.275034028964579 S260A-W265A 0.274737411082981 M1264B-V1269B 0.272865156720083 M619A-V624A 0.272310707857741 P42A-T98A 0.270310009042687 P687B-T743B 0.269919342547196 L21A-L280A 0.269589783740055 L666B-L925B 0.269476953336117 L751B-G1261B 0.268834589890001 L106A-G616A 0.268526801522672 Q1227B-S1275B 0.268200873640493 Q582A-S630A 0.267916241773857 V930B-C935B 0.265735173311941 V285A-C290A 0.265670124390426 P612A-L617A 0.264160904297148 S260A-P596A 0.263929305898168 S905B-P1241B 0.263860814228113 V928B-C933B 0.26332388893511 S726B-V745B 0.263314264266444 P1257B-L1262B 0.263085441900188 S81A-V100A 0.262950478037475 V283A-C288A 0.262630940928543 L748B-G1261B 0.261807356486701 L103A-G616A 0.261776897999805 A40A-S81A 0.260148873562131 A685B-S726B 0.259732932372195 V100A-E613A 0.259473805005598 V745B-E1258B 0.25947295516573 V928B-L1239B 0.257186703886763 V283A-L594A 0.25618268750029 T253A-C288A 0.255100305034073 T898B-C933B 0.255025721980263 V1269B-N1274B 0.254400672214229 V624A-N629A 0.254221003744945 V930B-P1257B 0.252395633375385 V285A-P612A 0.252101177100876 Y590A-S622A 0.250518569775666 Y1235B-S1267B 0.25041285158226 Y894B-V931B 0.250402980175965 Y249A-V286A 0.250081365651852 G73A-A80A 0.25004001429967 G718B-A725B 0.249869775076139 V931B-N1236B 0.249507272958265 V286A-N591A 0.249485173389624 L1262B-S1267B 0.249395399428605 Q1227B-S1268B 0.249393641161683 Q582A-S623A 0.249383242014337 L617A-S622A 0.249290387764872 C288A-Y590A 0.248405940738391 C933B-Y1235B 0.248359514540879 Q582A-A587A 0.243552763049125 V930B-E1258B 0.243384610642872 V285A-E613A 0.243378050455221 Q1227B-A1232B 0.242868957982445 A86A-S94A 0.242666776584047 T279A-E613A 0.242300867701229 T924B-E1258B 0.242274430444672 T923B-L929B 0.242166196219736 T278A-L284A 0.24216281186016 H25A-Y31A 0.242082818960917 T278A-L602A 0.241695991267696 T923B-L1247B 0.241695390172411 V931B-V1237B 0.241556115976337 V286A-V592A 0.241453376837872 F723B-L728B 0.241432181235384 F78A-L83A 0.240253749415555 P675B-L682B 0.237129100975176 P30A-L37A 0.237128421075169 L748B-P1257B 0.235990564511434 L103A-P612A 0.235948539038657 I1229B-I1234B 0.234920940467024 K1226B-R1279B 0.234881491790775 K581A-R634A 0.234880167105764 I584A-I589A 0.23477097246836 L682B-P687B 0.232922334357955 L37A-P42A 0.232882656805709 F667B-A685B 0.232124237797369 F22A-A40A 0.231974288423153 C935B-N1228B 0.231865718438861 C290A-N583A 0.231643597720315 H25A-P42A 0.231446183812505 H670B-P687B 0.231375387748586 F22A-S99A 0.228552814953572 F667B-S744B 0.228277865715997 S94A-S99A 0.228201743541521 Y46A-F105A 0.227549351328489 Y691B-F750B 0.227495344155646 F105A-A615A 0.22625295631132 L106A-P612A 0.226199616793472 L751B-P1257B 0.226099034781186 A661B-G754B 0.225912455852849 F750B-A1260B 0.225883432775789 A16A-G109A 0.225547170666714 S695B-S726B 0.225380212377194 S50A-S81A 0.225370127362823 I580A-V626A 0.225274345914035 C933B-P1257B 0.225162327203998 C288A-P612A 0.225155478289141 I1225B-V1271B 0.225149548406172 A725B-F750B 0.223896311949224 A80A-F105A 0.223878989471814 F292A-Y590A 0.220013836267152 F937B-Y1235B 0.21976281531669 V899B-V928B 0.218897641710325 V254A-V283A 0.218746685300769 L41A-T85A 0.218158242993164 L686B-T730B 0.218046955449502 S260A-A598A 0.217850106813238 S905B-A1243B 0.217601374624291 Y1235B-I1240B 0.216670863552063 V727B-G1261B 0.216663247858744 V82A-G616A 0.216446840802534 L728B-P735B 0.216101312971538 L83A-P90A 0.216034552286448 Y590A-I595A 0.21602466515574 N583A-M621A 0.215221903359774 S578A-A628A 0.215113660418028 S1223B-A1273B 0.215061983477699 N1228B-M1266B 0.214759718750702 C290A-I580A 0.213077465825421 R611A-M619A 0.212996440008796 R1256B-M1264B 0.212923132694338 C935B-I1225B 0.212765069017635 G938B-V1272B 0.21238838093476 G293A-V627A 0.212353920709234 L1239B-P1257B 0.211214688280214 L747B-V930B 0.210970366413516 L102A-V285A 0.210950252314933 L594A-P612A 0.210879194420354 L617A-V624A 0.210643520581763 L1262B-V1269B 0.210604670732176 A24A-I281A 0.210421591987092 A669B-I926B 0.209832381972268 L23A-S99A 0.20891475515584 F937B-Q1227B 0.208800230959299 F292A-Q582A 0.208699943797738 L668B-S744B 0.208142466414917 V100A-L106A 0.207742650700377 V745B-L751B 0.207699192485693 S81A-G87A 0.207415480096082 F660B-A932B 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