[Wed Aug 24 23:55:23 2016] >Input file: TM3JC2ATG.pdb >TM segments: 130-45_179-94_1115-127_1156-170_1176-188_1245-259_1287-301_1361-376_1424-438_1442-455_328-41_236-50_w13-29 MAIDEN score = -69.3633 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 ----------- ---------------- I2911-C3721 1.27920535619245 I362-I2561 1.19793587575113 I841-I1231 1.17006328349904 I1251-F1561 1.10677125758615 F442-C1881 1.04775922787546 I2561-V4511 1.02864640304053 I502-L431 1.02753667319048 Q2591-L4481 1.00750592138019 L3691-L4261 0.857777365594533 F442-I1871 0.790287291455103 V2551-L4481 0.735738627663729 C3721-G4291 0.734735458301154 S1801-I4531 0.730480224408704 V28w-N3001 0.718237898272906 L24w-L2971 0.712259481901435 T402-V4511 0.706554163386202 I2911-F3751 0.702066666012598 C25w-L2971 0.623582428626938 S871-F1191 0.603498085375039 I4281-T4451 0.589951714553265 V851-G1781 0.582466770183581 I841-T1241 0.578425567649143 I811-V1621 0.575110898320721 I811-G1591 0.557799144564774 N1861-A4501 0.556344471428767 W341-L1691 0.555915807415954 S3761-G4251 0.539202066471111 S4321-G4441 0.537672688168191 I841-K1171 0.534476212854027 L3691-C4271 0.529392185955071 I362-V4511 0.52737369105564 F1821-L4491 0.525484731807897 G881-F1191 0.525308208941009 F1821-A4501 0.523362743325055 G432-I1871 0.518232919723861 P831-G1201 0.517354374174979 I502-V441 0.516982677242185 N2881-I4281 0.516383406594899 I2911-G4251 0.499456017390782 F2521-V4511 0.499407374511414 F421-L1811 0.499404671338858 N21w-V2981 0.496995482231707 C25w-L2931 0.490950730745697 T351-F401 0.485548642612908 Q26w-P831 0.478331868329043 C25w-T861 0.474177200637058 N21w-Q2941 0.471958052390529 K311-L1691 0.463658524474154 I1831-L4491 0.460188391882101 L22w-I901 0.459360962131797 T1241-F1561 0.458082583342759 L1651-S1771 0.457848961325312 I362-Y4551 0.457571048360236 S2951-S3711 0.45258617753533 Q2591-V4511 0.452272375939246 F2521-L4481 0.450690339455696 Q921-K1171 0.450279869826159 M1211-L1601 0.436662479383807 G801-V1621 0.43656218078096 A2471-L4381 0.419131195498026 I1831-I4531 0.41682510633751 S871-G1201 0.414939817316576 M472-I1871 0.412014147560047 V2511-L4341 0.401778641585638 I811-L1631 0.401373537296603 F3671-C3721 0.401327033798957 Q26w-T861 0.399813249708133 V2511-A4351 0.399740254684933 V4331-L4381 0.398637543403254 Q2941-F3751 0.397799652461876 I1791-I4531 0.395112699546639 L3691-A4301 0.393406632211245 I2561-L4481 0.390985745677895 L22w-Q2941 0.390566098017748 P831-I1231 0.386523618041561 L1691-S1771 0.386132860262069 S2951-M3681 0.385528897833761 Q2591-T4521 0.379399816284901 I362-I4541 0.377807821389159 A392-I4541 0.374811950761527 L4311-D4361 0.372938299170533 L791-Q1271 0.369809033263174 I3651-V4331 0.367593023472311 L791-T1241 0.36696995307642 T402-C1881 0.362404010246881 C3721-T4451 0.361349658442322 T351-L1691 0.359263816798921 L22w-L2971 0.35111436459306 L391-A1841 0.350555255110035 G3701-L4261 0.350420857434085 L3691-I4281 0.347788066083545 T1241-L1601 0.341063712798686 A412-A4501 0.339286128673873 P831-P2901 0.338074791021529 V851-G1201 0.337037715154786 F421-V1621 0.334151049302617 F2521-I4471 0.331891809501225 G3701-C4271 0.329414443312653 M472-V321 0.32686342615141 M472-A1841 0.326280866297351 A4301-G4441 0.322974586028173 C1881-I2491 0.319104811248523 G432-I4541 0.317301340695466 C1881-I4531 0.31657688322105 K1171-L1631 0.316395803055957 T381-L1691 0.314418605249397 V29w-Q1271 0.312453475960415 G432-I1831 0.311755021537893 I502-F401 0.309087376956331 G4441-A4501 0.308908193403253 L3691-G4251 0.306947918847202 I841-F1191 0.306814664049532 L431-A1841 0.304627725403782 T351-E1671 0.304577490246349 L24w-N3001 0.303472282598273 V441-C1881 0.303019492351814 I3651-A4301 0.301316381047684 A372-I2561 0.299616772093988 G801-S1771 0.295783543741566 V2511-D4361 0.295199495014809 V2551-I4471 0.29425994672219 L791-A1581 0.292405569570642 A452-A1841 0.291971519657444 K311-S1771 0.291484799217562 S3761-G4291 0.290102020850647 T381-L1651 0.289814738309504 A372-G432 0.287336186397307 G432-L391 0.285721200009878 L1681-G1781 0.284211555146038 Q1701-S1771 0.280199756720725 V2511-I4471 0.27809200922828 M472-V4511 0.277226128272138 T402-T2481 0.276638646212552 C451-G1591 0.276602442559872 V19w-L931 0.272445355360096 V2551-V4511 0.269357043204635 V19w-I901 0.267065098231988 S20w-G27w 0.267051316849439 I2921-C3721 0.26551053139461 Y3641-D4361 0.263911935878379 M3681-G4291 0.263800039406675 N21w-S2991 0.263242813732965 S2871-G4461 0.262842836908876 L4341-G4421 0.261197046515301 S3711-L4261 0.2587528694058 I3651-G4291 0.25778133554787 A4351-T4451 0.257688781934862 C451-F1821 0.257114388247516 N2881-G4241 0.256210943981638 P2901-S3711 0.255523318440115 G1761-F1821 0.254475667865651 F421-G1591 0.253829182394316 I841-M1211 0.251789526870972 Q26w-Q921 0.250309998035225 P831-L1601 0.250235726549374 N21w-S2951 0.249829489347414 L3691-S4321 0.249210101312947 L431-T1851 0.248393162861714 A372-A2531 0.247214342055047 I411-C1881 0.24655222515354 C3721-L4261 0.245262911192403 N2881-L2931 0.243451746174142 G4291-D4361 0.243174468796957 T2481-L4381 0.243063853057897 F3751-G4241 0.242301769533112 G4291-G4461 0.242060138995168 Q1701-G1761 0.24163478652173 T351-L1811 0.241333523063246 I1831-A4501 0.240049979849477 F3741-G4291 0.239405182345629 N1861-I4471 0.238451285065139 G1591-D1661 0.238379325155694 Q1161-T1241 0.238019141359811 N21w-Q26w 0.237147919856124 L1691-S1801 0.237116606905491 I2911-A3731 0.236722812376875 Q2941-N3001 0.23572533380678 F2521-G4441 0.235156515371374 V1621-E1671 0.23360792452388 S871-P2901 0.232808682315112 T2481-A4351 0.230841317450688 T2481-L4481 0.22792431892165 Q2591-Y4551 0.22780885871258 V851-D1661 0.224754262062118 S20w-S2951 0.22423329073512 F2501-G4421 0.221849088329853 L4311-T4451 0.221326331320841 I2911-S3761 0.221114536122023 Q26w-G1201 0.220025637051319 Y3641-A4301 0.219720498478111 L2931-T4451 0.219322275167292 S821-A1581 0.218746885237112 A361-S1771 0.218115259060633 L791-G1591 0.217924111692873 Q2941-F3671 0.21689679353479 F492-C451 0.215730409748678 C3721-G4461 0.215374167943017 T402-L4481 0.215052679631547 C25w-G801 0.2148041789643 L391-S1771 0.214747247664201 L791-T861 0.214210576223952 I422-C1881 0.212976016884705 S20w-V2981 0.212752775083215 G482-F401 0.212616886387124 G4241-T4451 0.211395398780947 C25w-Q1271 0.210493100381635 I3651-C4271 0.209631827442132 V851-F1821 0.209591414129038 S20w-S2991 0.208523521812928 V1621-G1761 0.207607022363977 I422-I4541 0.206993631723926 S2991-S4321 0.206915111675877 S821-P2901 0.206456695374007 I811-L1811 0.2064283889443 N1861-L4491 0.20545206681844 L23w-I901 0.204287256229712 Q921-G1201 0.204255620710188 I2921-C4271 0.203979556672479 T1851-I4541 0.203293968288175 N21w-L3011 0.203123587597321 L24w-P2901 0.20272986591875 C25w-I1231 0.201765361037461 N2881-G4251 0.201279530524371 Q26w-M911 0.200902894015567 L431-G801 0.199239193919874 I811-G1201 0.197965891735079 I422-T4521 0.197903457540827 L23w-V28w 0.197608640495148 N1861-G4441 0.197593837438479 G432-T351 0.197375553404848 C25w-I2911 0.197320608793647 A392-Y4551 0.19559458606659 F492-V441 0.19552633422141 I2461-G4421 0.194367024458642 Y3641-S4321 0.192616094327644 T861-I1251 0.192520330661067 L3691-V4331 0.192234632814847 P831-Q921 0.192114518520226 D1661-G1781 0.192000607237628 V18w-L931 0.191880296999826 I2921-T4451 0.191405634617493 I841-L1631 0.191323518918208 I2561-T4521 0.190228576438016 Q921-P2901 0.189768301884029 F421-G1781 0.189261983359998 N2881-L3691 0.188270956389974 L931-P2901 0.188097050755399 N1861-F2521 0.186210712546882 G482-L391 0.186143351511948 Q2591-C4271 0.184736407637161 V18w-F3751 0.183884226491523 T861-Q2941 0.183267248915946 G801-A1841 0.18208329952815 A452-I502 0.181489921585861 I2911-G4291 0.181372603225397 I422-M472 0.180785331548886 I2891-G4461 0.179845300115408 I841-G1201 0.179000045258346 G432-L4491 0.178401040505411 L23w-G1261 0.178394947138674 G4291-L4481 0.177836500357134 I1831-I4541 0.177798063291514 C451-L1651 0.1772002866144 S20w-L2931 0.177040448609434 D1661-G1761 0.175652340055902 S821-K1171 0.175252169910043 C451-L1811 0.174582271488141 Y2571-G4241 0.174303847175969 S2951-A4301 0.173741281324359 T1851-T4521 0.173506887181588 K311-L391 0.173448009204689 M3681-G4241 0.173295017922633 T351-T1851 0.172930596835625 A2471-D4361 0.172344703927406 T402-T1851 0.171601062204446 A3731-A4301 0.170832880494075 L14w-S3761 0.170682801445128 M472-I1831 0.17062023236063 S2871-S2951 0.170526385741189 P831-L1811 0.17000082477691 G1201-F1561 0.169110542678347 F3671-C4271 0.167882989896027 I2921-G4251 0.167686073244689 G4251-A4351 0.167591570159198 F442-T1851 0.167553754119385 P2901-S3761 0.167360739583594 V851-G1591 0.167244463532287 A3611-G3701 0.165544610607466 K1171-I1221 0.165479146566888 I371-C451 0.165326023961278 A2471-V4331 0.165235309137211 I2491-A4351 0.165147774583526 Q26w-P2901 0.165132355071073 G801-V1571 0.164829628427852 F3751-C4271 0.164562920857101 C451-L791 0.164136526643603 I1791-I1871 0.164134172295668 L1811-N1861 0.16347162670235 M1211-L1651 0.163379828161954 C25w-L791 0.16332764021725 C3721-L4311 0.163241211130313 G801-S1801 0.163093767192271 K1171-E1671 0.1630880132049 I362-I4471 0.16300247746112 I1791-N1861 0.162630104916892 I1831-T4451 0.162403081081409 A412-Y4551 0.161031037660786 G4421-I4471 0.160763936987355 V1621-S1801 0.160577097076013 N2881-G4441 0.160479089940083 V2511-L4381 0.160134916732368 K311-E1671 0.159159659186147 S3761-L4261 0.158921298977972 L2931-S4321 0.158556815783032 Q2591-G4461 0.158211577894701 V19w-F3751 0.157904086323667 M911-F1191 0.157880332234074 F442-S1801 0.157716330156321 T381-L1631 0.156518698477754 L4341-T4451 0.156052664412021 L791-S871 0.155841153458162 I901-I2891 0.155465156362407 G801-I1791 0.155288390444344 V18w-A2961 0.155096395027076 I1791-V4511 0.155065836575082 L891-N2881 0.154685391494711 S4431-L4491 0.15421653209157 T1851-L4491 0.152858594618287 I901-T1241 0.152635121104675 G1261-G1591 0.152348632339783 G801-L1641 0.152138557819357 T381-T1851 0.152134009754317 I811-I1221 0.151627498678508 P831-Q1271 0.150375884795309 A3731-G4241 0.150282654274961 I1251-I1611 0.15025266364416 A2531-I4541 0.149958997458134 V2551-S4321 0.149760513777466 V2511-L4311 0.149733963884914 V2541-A4501 0.149348877607218 T351-L1681 0.149185125424038 I2891-I4531 0.149068449213457 I371-A1841 0.148860485698498 L2931-G4461 0.148104493584492 A4351-G4421 0.147524304156449 Q26w-G881 0.147467280735638 T402-Q2591 0.147237604303387 V29w-G801 0.146664060946621 M1211-L1631 0.14663507735955 C451-T1851 0.146353976070121 V28w-V851 0.145871473322011 G1591-L1811 0.145710493191955 G27w-T1241 0.145386755312054 I1611-D1661 0.145078041858785 G1591-G1781 0.144766245821097 F3741-G4241 0.144719203106815 G801-N1861 0.144649636105865 I1871-A4501 0.144245311820594 V19w-V28w 0.143965471190453 S2951-C3721 0.143838161272934 C451-I811 0.143747200703222 I462-I411 0.143736865762952 F1821-V4511 0.143283351711345 Y2571-I4541 0.142529438148922 N21w-L2971 0.141081071236126 M1211-A1581 0.140752539963686 P2901-F3751 0.140429976625251 F492-A1841 0.140311244807748 C25w-I841 0.14000024871203 L24w-I2921 0.139762561583351 L24w-L3011 0.139641810983362 N21w-L2931 0.139505761691638 K311-D1661 0.13939245109251 L1691-G1761 0.139138392670236 G1201-I1251 0.13907097380884 G4461-I4531 0.139015130247861 E1671-S1771 0.138879178165444 E1671-G1761 0.138674926180065 S1801-V4511 0.138483818655088 W341-S1771 0.137696301164464 I811-D1661 0.13725986401106 S2951-T4451 0.137033614226636 I2561-I4281 0.136795488551479 L931-L2931 0.135775963494106 I811-K1171 0.135718109370598 I901-K1171 0.135232605159963 Q2941-G4291 0.135164615456146 I2561-I4531 0.135080373786918 M382-A2531 0.134631244771808 V28w-S2951 0.134424964301501 G1781-N1861 0.133790912499745 L431-S1771 0.133544080132223 G1201-L1631 0.133535059405981 Q2941-G3701 0.133107485069158 N2881-A2961 0.132555563638154 Y2571-I4281 0.132460061351442 C1881-I4471 0.132397186775925 Y3641-L4341 0.132102691428612 L1181-G1591 0.132057819572077 T381-I1831 0.131529521587472 A1841-T4521 0.131522537313779 K311-G1761 0.131391915358848 G432-T4521 0.131384230532129 A2531-G4441 0.131310431489994 I1251-V1571 0.131018112378559 G432-L1811 0.130513031530797 L1641-I1791 0.130159235727353 V2551-L4341 0.130142749418168 I2891-G4241 0.129517593669251 L23w-I841 0.129343031919503 S20w-F3751 0.129154088782355 F492-C1881 0.128788953177397 I2921-I4471 0.128654969623687 L891-G1781 0.128280366601413 G1591-E1671 0.12801207559066 I411-L1601 0.127983418414227 I901-Q1161 0.127865730301485 V2541-S4321 0.127827652668257 T351-I1831 0.127313030276737 C25w-G1261 0.127283897978256 A412-A1841 0.127116981833331 T861-I2911 0.126444228808166 W341-L1641 0.126378581160991 S2951-V3661 0.126330620144074 I2491-T4451 0.126309926769406 A372-F2501 0.126176733750466 L17w-V2981 0.125681131587966 V851-I1791 0.125596313356945 F421-N1861 0.125506976159317 T861-G1261 0.125164737911025 L931-I2911 0.124373309677485 F3751-G4291 0.124314750854783 G27w-P831 0.124036655757261 V2551-L4491 0.123949347309987 P831-L2931 0.123680976215757 I2921-A4351 0.123585857138594 V441-V1571 0.123435661139754 G432-F1821 0.12311092053864 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