[Fri Aug 26 18:15:27 2016] >Input file: TMA3WVD7M8D.pdb >TM segments: 418-438_ 481-555 MAIDEN score = 18.1165 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 ----------- ---------------- E528 -C534 10 K504 -V541 10 A428 -I503 1.94476225247416 I503 -I540 1.71081237196877 T427 -L502 1.30942422388914 L502 -T539 1.27249242762951 L502 -I540 1.21857659094858 A428 -K504 1.06470812031696 A499 -R537 0.977993072699238 Q426 -I496 0.953487835644218 K524 -A529 0.910291628655789 V526 -N536 0.909511512889996 R493 -V498 0.851941201957671 Q426 -A501 0.836853762252295 L510 -T515 0.821203112091268 I503 -V541 0.8105508911049 D505 -A543 0.783659802641078 D505 -I540 0.772956762488697 V526 -C534 0.72774404192006 V498 -N536 0.712855882536039 A428 -R493 0.709353347154726 Q527 -C534 0.690526997302658 V434 -G485 0.640878907274238 A501 -T538 0.630815876553806 R493 -A501 0.608396643764554 I542 -H547 0.583384841688375 A428 -D433 0.573169418785332 V526 -T538 0.56060570756968 D512 -H547 0.560018754058222 A506 -V541 0.558196121871831 P507 -L518 0.519980565565309 Y429 -I503 0.518847203175405 R424 -I496 0.507574793702155 Y429 -A506 0.503050524998861 V418 -L423 0.462914050429173 D519 -H547 0.457568627543527 Q426 -K504 0.454518506834606 Q527 -N536 0.443326217451484 P507 -E513 0.441920601606552 H547 -D553 0.436760838947894 P507 -E521 0.431846093756857 Y429 -D505 0.431537098710251 Q432 -T486 0.426660643632525 L502 -T538 0.4230954811947 R424 -A497 0.423019164804647 V434 -L488 0.403721878809513 R425 -L502 0.398761725475886 L502 -V541 0.394378159932889 L488 -R493 0.387683694336463 Y429 -Q492 0.374101067792749 P507 -D519 0.37296050113871 E521 -V526 0.369062174136673 V526 -R535 0.368760599390139 I542 -T548 0.363645649872115 R425 -V498 0.359072795594248 Q432 -G485 0.358332653232645 T486 -A506 0.355906227628219 D433 -R493 0.347357572303798 L502 -R537 0.345946484365108 I503 -T538 0.342572713720632 G431 -I508 0.335812250065072 H544 -H551 0.334574657930458 R545 -I555 0.334506956049319 E523 -T548 0.333634613698304 K504 -S522 0.333536240836287 A428 -S489 0.332310501729257 K524 -A552 0.322463043042217 A428 -G485 0.32005546219073 T427 -T486 0.319274035280393 R500 -T539 0.319204987010589 Q494 -E528 0.318796384052755 E483 -L510 0.312239272577668 Q527 -H532 0.311344949571076 Y435 -R493 0.308212663492517 A506 -I540 0.30059648913481 A499 -N536 0.296985392926496 A506 -I542 0.296199978380854 A529 -C534 0.296021777232935 A501 -S522 0.295852340128306 Q494 -A501 0.295299252130043 D505 -M550 0.295248373718356 V430 -I503 0.291501559041298 S422 -A499 0.289971728616803 S489 -A501 0.287898824571295 G490 -A497 0.287682086241113 R537 -D553 0.284687785713502 E523 -R535 0.284134262413095 E513 -H544 0.280692772516912 G431 -A506 0.279599368939461 A501 -I540 0.27136677261424 D505 -I542 0.270228522653747 G491 -A501 0.266804902819963 V430 -I508 0.265503004017442 A428 -R500 0.262929026520881 P507 -S520 0.261990532017852 Q426 -Q494 0.259003718367319 Y429 -L502 0.255796778931578 G431 -H484 0.250915302979654 P507 -T539 0.24939456657428 D519 -V541 0.247796447223726 Q432 -E483 0.244480402582862 G431 -Q487 0.237229923949418 G431 -G490 0.236988971457237 G482 -G490 0.234451019936143 V526 -I540 0.230110791087602 G431 -D505 0.229881793331581 G490 -N536 0.227764408562429 D512 -H544 0.227012785311063 G482 -L518 0.225681695707352 E523 -T539 0.224323706163834 T548 -I555 0.223823292802429 T486 -L510 0.223692814340489 L502 -P507 0.223161704886595 R495 -A501 0.221092625415954 R493 -L502 0.220954697104938 Y429 -A501 0.220296014740668 A514 -S522 0.219021692310828 S522 -A529 0.218707717812216 V541 -D553 0.218247630499569 S489 -P507 0.217984579328175 G491 -V498 0.217433098136266 T539 -H547 0.217335969254492 G431 -E483 0.217062280614965 Q494 -S522 0.215612173382873 V541 -M550 0.214361110933274 G431 -L510 0.21432015273354 Q525 -N536 0.213854889528605 G491 -N536 0.213733979381425 L436 -G485 0.21342869622713 V434 -G482 0.209661414122535 Q426 -N536 0.201366244149854 R424 -N536 0.198766070234216 Q426 -Q487 0.198695449616389 A506 -E521 0.198477343966857 R425 -C534 0.196863171081049 V418 -R425 0.196761806511029 G491 -I496 0.195779318145486 T486 -D505 0.194871458197556 Q432 -Q494 0.194279801787046 D505 -D512 0.192767605520025 D505 -T548 0.191312194274562 D505 -T515 0.188265422108427 E521 -A529 0.187058982686435 S489 -K504 0.186581116672714 K524 -E531 0.186034219294504 S489 -N536 0.183661579444027 D433 -A506 0.180940701794503 H484 -L518 0.180713039461559 I542 -H551 0.179979738962878 R537 -A554 0.179874940173841 G431 -L436 0.179634051268727 Y429 -G485 0.179310932854593 G431 -I509 0.178672715544207 S520 -N536 0.178481028071266 I542 -A552 0.178294637045239 Y435 -G491 0.178127205046564 H547 -A552 0.17729236612418 I509 -H544 0.175064320597654 V526 -M550 0.173685396144987 Q426 -Q525 0.173655121981985 T515 -H551 0.173512888451821 A428 -G491 0.17327160933028 Q525 -E531 0.172602184130761 R424 -V498 0.170994961800368 S522 -N536 0.170319325629026 A506 -H544 0.1695278994511 A497 -R537 0.168390022614751 A529 -R535 0.167799709641657 Y435 -G490 0.167644094153402 V526 -E531 0.167441527441762 T515 -E523 0.165257808496196 T486 -D519 0.164826069007624 Q487 -P507 0.163559858897798 G431 -A543 0.161636831452177 T486 -P507 0.15953546597461 T427 -D505 0.159303646448671 R424 -R535 0.158653174179478 E483 -A514 0.157271276357269 V434 -A506 0.156107114807682 P507 -H551 0.153881903411051 Q432 -G491 0.152983411466791 Q426 -A499 0.152840239715889 Q432 -A506 0.151269445051943 T486 -E521 0.150448206083494 I503 -A552 0.150009081587462 A506 -A543 0.149625418795793 R493 -A506 0.149593642229046 D519 -M550 0.149023028910716 H484 -A506 0.148995030385512 Q487 -K524 0.148713193330623 R420 -A501 0.14828260963112 E483 -E513 0.148121519093896 A506 -H551 0.147665266057397 I508 -T548 0.147172375506897 H484 -E521 0.147035923096555 Q492 -R500 0.14647601557415 R420 -A428 0.146136523947058 A497 -Q525 0.145706721371065 E531 -N536 0.145674170394146 K504 -D519 0.144821516090659 G491 -A499 0.143725674111894 A501 -Q527 0.143494992598996 V498 -H532 0.143224107701753 G490 -E521 0.142893906418861 Q426 -R535 0.142655496935804 S489 -E521 0.142481130154262 K524 -N536 0.142448741973562 T515 -H544 0.141232486999441 A516 -H544 0.140595485799525 E523 -A552 0.140513842443308 I508 -E513 0.140311715465256 P507 -R545 0.139916958796008 V526 -R537 0.138745175724358 A428 -A506 0.138333098147153 K524 -D553 0.137855336462419 G490 -V498 0.135798651485252 R438 -G485 0.134763952151206 A516 -R545 0.134344251969795 A514 -D519 0.132659526319462 V430 -I540 0.13233512704249 R495 -N536 0.132036929259216 H484 -D519 0.130665518310222 I503 -T548 0.12983471371381 N536 -A552 0.129283846704767 L488 -I503 0.129008210383885 V434 -H484 0.128833940304759 T515 -I549 0.127395837812324 G490 -E523 0.127391435277254 D519 -V526 0.127290683860286 L488 -L518 0.127243583346916 H544 -A554 0.126998534899174 T515 -I542 0.12678887421281 E513 -L518 0.126377198355771 I503 -L518 0.125977479062662 E483 -S520 0.125975591665139 S522 -A554 0.124891682016846 K504 -I509 0.124157519841482 S522 -T539 0.124076357174605 A428 -H484 0.123598173023819 V498 -R537 0.122924118242324 G485 -I508 0.122319081806734 R420 -A499 0.122206813641704 Y429 -L488 0.121756226109125 A428 -A501 0.120381726645213 I542 -I549 0.120329602730298 Q525 -T539 0.119998470213783 Q487 -I503 0.119971962869699 A516 -K524 0.119910506626702 D519 -D553 0.119523884819134 D433 -G490 0.119517398751021 S422 -V498 0.116924544579986 G431 -I542 0.116902376410241 V481 -A514 0.116760521319419 K524 -R535 0.116463698403089 Q487 -A517 0.116433565094276 R493 -T538 0.116312597231646 I508 -A514 0.116291572211841 P507 -I542 0.115849052127459 L423 -A499 0.115720005105784 A501 -A552 0.115494459518377 L423 -A501 0.115386049684662 G491 -E521 0.115079815298389 A516 -E521 0.114410733527037 E483 -A516 0.114111699329986 H544 -I555 0.113334636079296 V526 -D553 0.113321240036745 Q494 -N536 0.112501737606185 T427 -V526 0.111752404894429 R545 -A554 0.111112630148249 A428 -I542 0.110890197486292 S422 -T427 0.110829864628543 V481 -L510 0.110215781916214 R424 -R493 0.109471986361902 Q525 -I540 0.109084362438523 T427 -V541 0.108919833753587 S422 -A501 0.108780904412141 V541 -H551 0.108095680766831 I530 -R535 0.106143984910502 A506 -V526 0.105971224899698 V481 -S489 0.105329830763508 T515 -V541 0.104765106061282 A517 -V526 0.104469096294155 A529 -N536 0.104268861908307 Q432 -L488 0.103947839188184 D505 -H547 0.103873803653608 Q494 -R535 0.103848019156821 V526 -T548 0.10380781225888 Q492 -I503 0.103722516249186 A501 -A506 0.103085380420262 A506 -A517 0.102680733009469 G491 -I503 0.10258536412495 V430 -A543 0.102507268862404 A506 -A514 0.10225025981074 A499 -T539 0.101964831385133 S422 -A497 0.101292382222113 V526 -H532 0.100854807747122 R425 -R537 0.100457931589292 Q527 -L533 0.0994390443151119 G485 -I509 0.0993029927754161 L510 -L546 0.0981301987583452 E523 -E531 0.0980191285783149 E483 -D519 0.0979329736088235 G431 -T515 0.0977600114962422 S522 -C534 0.0972222956957043 H484 -A514 0.0969824060463305 G482 -T515 0.0967019858210019 A517 -L546 0.0965665707182977 S522 -V541 0.0959319427312937 Q525 -R535 0.0954660756225401 G490 -K504 0.0946781874326587 G431 -V541 0.0943793897344696 A497 -H532 0.093978852416079 G482 -A516 0.0938300434624919 L423 -Q494 0.0934044891778685 A428 -I496 0.0933131873038553 G490 -K524 0.0932586696483021 D519 -A552 0.0931431036538477 T427 -A506 0.0929810683654462 R425 -G490 0.0927392127018409 G490 -I540 0.0924802783358638 Q487 -L510 0.0916826349713189 L518 -I549 0.091095071324613 L436 -V481 0.0909667538784762 V430 -S489 0.0903846017281715 I496 -C534 0.0903553209385338 I503 -V526 0.0901589401755083 S520 -A552 0.0887812453009529 I496 -N536 0.0885299196484937 G490 -T538 0.0880390806509146 Q426 -V526 0.0877855700871257 T427 -G491 0.0876730864774404 T427 -V434 0.0876647302348239 T486 -I509 0.0868435474447912 Q527 -A552 0.086032581523515 T486 -S520 0.0859570811048321 Q426 -A497 0.0854395434642683 R500 -Q527 0.0853500680215316 V498 -Q525 0.0849456324246358 I540 -D553 0.0849360825436229 I496 -L533 0.0849227219278381 T486 -L518 0.0848650751570172 A428 -T538 0.0834587707118906 E513 -E521 0.0822664370109791 I503 -Q525 0.0817326536846883 D433 -R438 0.0816911545395058 S419 -T427 0.0811543385339863 V434 -S489 0.0811495092054448 G485 -Q494 0.0803607754351783 R495 -R537 0.0799702098262873 K524 -H547 0.0798537612323553 I530 -N536 0.0794158130532212 A428 -L488 0.0794004651962963 I549 -A554 0.0787356513070474 S520 -C534 0.0786031972050091 S520 -A529 0.0779065507249932 V498 -I503 0.0778222415458432 L423 -R493 0.0775676121698743 L511 -D519 0.0775332628903502 Y429 -T538 0.077432244403441 R493 -R500 0.077416024149155 G490 -R537 0.0772208173483635 D505 -L546 0.0768698402589822 D512 -S522 0.0756473066723657 I508 -A543 0.0753764558012531 K524 -C534 0.0753753468472178 V430 -G490 0.0753392362965473 S522 -R537 0.0752723071229174 E528 -R535 0.0751452800678454 S522 -R535 0.0746186549980931 E528 -R537 0.0745093174496292 A501 -C534 0.0744180526190072 V481 -L511 0.073829864310938 V430 -Y435 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