[Fri Aug 26 18:16:13 2016] >Input file: TMD8DWG7M2D.pdb >TM segments: 19-32_ 47-64_ 76-89_ 99-119_ 138-153_ 165-183_ 222-258 MAIDEN score = 19.7730 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 ----------- ---------------- F172 -A177 10 C80 -I173 10 E236 -A248 10 L81 -L171 4.32962051960737 L19 -F138 1.83011803562808 C80 -F172 1.7617395427346 L26 -M146 1.57074398886023 L27 -M146 1.5066661661033 L81 -I173 1.22041685224115 I173 -L178 1.13340094800743 I49 -I102 1.10262966215304 I79 -I173 1.06979502936159 K234 -A248 1.02337304536428 I79 -F172 0.876997999651879 L81 -F172 0.870370304914726 P29 -P150 0.856418790928229 L78 -F172 0.83265693038421 L26 -N142 0.830866024556421 L27 -I148 0.789254394859743 I252 -S257 0.741728844561771 F83 -F88 0.737367005397036 F24 -T180 0.732998195306686 F172 -L178 0.72031593924719 A170 -T176 0.713690007808074 Y25 -T180 0.688586209679134 A23 -M146 0.678472234477839 I239 -T245 0.673150254364692 L27 -A170 0.669123538290677 E236 -F247 0.662783701819579 G52 -I102 0.655721005032344 I49 -T105 0.641252551295366 C80 -L171 0.637274966918943 L27 -A145 0.633062710879051 L27 -P150 0.626738355678067 F24 -A145 0.612242059675771 F24 -A177 0.60665955140334 A147 -F255 0.600055204708938 L81 -A170 0.592389676587768 A23 -L144 0.585430490063678 A82 -F172 0.583940907863348 L77 -P110 0.582997102446653 L27 -S149 0.576117444518328 Y25 -N142 0.570686566508791 T28 -M146 0.557472794306626 F22 -F138 0.547902471555757 L78 -I173 0.546073627094557 F22 -A145 0.544898789851054 L27 -N142 0.529037754129699 F83 -L171 0.524016249920793 Y25 -A145 0.521173613651703 F85 -F167 0.519862820406947 T28 -T176 0.492048343807014 V116 -L229 0.478344931588292 I79 -P110 0.457876286326385 A23 -N143 0.457084740069806 I86 -F167 0.456421524761248 L30 -P150 0.453108485644728 G52 -I103 0.453105965311792 L78 -P110 0.446889611782638 L27 -A147 0.444209917153914 A23 -N142 0.443398262109415 S149 -L166 0.440569659067549 A82 -L171 0.437028183052362 F24 -I179 0.436331253459575 S233 -L250 0.433542139912134 Y25 -A177 0.427573103154447 L20 -F138 0.425022804194139 T54 -G108 0.41867475451423 C80 -R104 0.415956151597124 Y53 -I102 0.411256816490146 L81 -F167 0.403321728390997 I152 -L166 0.400598334112889 L20 -S183 0.399754901907613 A82 -A170 0.397569467276027 T28 -S149 0.39335496349106 T115 -A230 0.390876716423953 A82 -I173 0.390352547947285 L171 -A177 0.388570181058213 A89 -T105 0.382717231689593 S64 -S117 0.37947188727003 A82 -A174 0.376559424075201 T28 -L171 0.373080460853008 S233 -S251 0.372085939969874 I169 -A174 0.368927889429967 C80 -A174 0.368693843867624 L81 -W168 0.365820122312495 A23 -A170 0.365056479086224 F83 -W168 0.363214748614208 I169 -G175 0.361474813146032 C226 -F247 0.359287975617038 Y246 -G253 0.356165216241057 T57 -C226 0.355249872641966 A145 -A170 0.352315566240532 F22 -S141 0.351621740355056 F232 -F247 0.350290877851904 A56 -G108 0.347556597147849 S64 -A113 0.34586333312545 L81 -A174 0.345118923644045 A23 -A177 0.343740269747089 A230 -A248 0.341876350171665 C226 -I231 0.341809072338555 N142 -P150 0.337681949238299 C226 -T245 0.336616943125362 L26 -N143 0.335606266514019 Y21 -S141 0.334779911660887 E235 -F247 0.329477608935567 C226 -F232 0.327776979061557 K234 -Y246 0.323951398003892 A147 -G253 0.323584882780264 V116 -L225 0.323420536453457 I60 -C226 0.323276724860476 C80 -I165 0.321377874498138 F24 -A170 0.315638196481178 Y25 -G112 0.313200499593358 E235 -T243 0.311838069862926 P62 -P110 0.311267824808641 P29 -N143 0.310452484342893 A147 -L254 0.309883904141079 T115 -L229 0.308856685656473 G112 -I231 0.30845913620752 A56 -S64 0.299454563817422 A23 -S183 0.298155726798329 S51 -G108 0.297253344997443 P110 -T176 0.296295369356519 A82 -I169 0.295429175403286 E235 -L250 0.293750984442079 T54 -P62 0.291476133406946 S233 -F247 0.289847218351322 A174 -A181 0.289757386405568 L249 -R258 0.288916132630769 T54 -P110 0.288778744699372 L55 -G112 0.288191999859282 S64 -G108 0.286380484841147 I49 -R104 0.285889355791504 G112 -S233 0.283073784575139 H238 -A248 0.277346919139576 N143 -I148 0.277227183084607 F22 -G139 0.276665813987905 I48 -M99 0.276163976480003 I48 -I102 0.274841441746885 T28 -C80 0.271788301533255 P29 -S151 0.271700631684038 S64 -G112 0.271564896068951 G112 -N227 0.270634149828966 F172 -I179 0.269516423980599 P29 -K234 0.267915302719361 P29 -S233 0.266814148894368 G153 -L166 0.266003359577688 G108 -A230 0.264743684433705 F24 -N142 0.263877636390666 G253 -R258 0.259994792602087 T54 -C226 0.259407474083067 F222 -N227 0.258784808097511 F222 -G244 0.257790420353347 Y53 -L106 0.256976858541549 C87 -I169 0.256243077336592 F24 -G139 0.254197546835407 S114 -L229 0.25276896728338 A113 -L229 0.250862304134252 L78 -S114 0.250639634785789 R61 -N118 0.243964992257004 R61 -Y228 0.243754262802163 S119 -N142 0.243603654450711 S64 -N118 0.242768797768795 L26 -T180 0.241847971505304 E235 -T241 0.241046620789489 Y25 -A181 0.240261265145682 G112 -L225 0.239269168788639 G175 -S182 0.236368109136309 A23 -L140 0.235687757682077 C226 -G244 0.235177613929455 L31 -G108 0.235075500179165 Y53 -F100 0.233681230258735 A230 -S251 0.232623759419513 N143 -S149 0.232475191297624 L78 -T115 0.232117041465698 L55 -H107 0.231685894927181 R104 -A109 0.231354800877569 T28 -P150 0.23134626492195 G153 -W168 0.229905142453037 P32 -S251 0.228205394813191 S141 -S183 0.227497235016199 A82 -C87 0.226356625931405 L78 -G175 0.224131299099554 Y53 -R104 0.223091528540325 F167 -A177 0.222697856659026 S114 -Y228 0.221755804790942 L30 -P110 0.219887876333487 F138 -A145 0.219521605937793 L19 -G139 0.218166534719519 L77 -T115 0.216913249542691 H238 -G244 0.216696349254681 Y53 -I103 0.216626950883451 A174 -S182 0.216626261454051 T115 -C226 0.215786894268714 I79 -G108 0.215093777379667 L31 -G112 0.21332090805441 N142 -S149 0.212231721945003 F84 -A170 0.211561017453548 R61 -A109 0.210592986309978 H238 -T243 0.209416652013003 I60 -A113 0.209302700443169 P150 -L254 0.209166147394225 G47 -I102 0.208470662755467 F232 -T245 0.208096139959693 P150 -S251 0.208005766405408 E236 -Y246 0.207287402922288 P62 -L225 0.20666502928118 C87 -I102 0.205590345547366 A170 -A177 0.204129424917204 A230 -F247 0.203814964190314 H107 -T115 0.203211862342914 L171 -T180 0.203141965782355 T57 -P62 0.199120305166778 I76 -T176 0.198583249937388 S151 -S251 0.197288368954268 L31 -T105 0.195702973679706 G52 -T105 0.195466970235904 G52 -L106 0.195112918837973 I49 -G101 0.194998272157195 S114 -A177 0.193746378735644 T115 -N227 0.193716284020544 G223 -T243 0.192562094842368 P32 -Y53 0.192261669835891 G52 -F100 0.191977754559825 T28 -A230 0.190672752600043 A82 -F167 0.190020267938287 N142 -L254 0.189695222831209 T115 -L225 0.189298242009272 L20 -S141 0.18779322214397 G108 -A113 0.186902321374842 E236 -L249 0.186149901543573 T240 -T245 0.185884576259657 T28 -N143 0.185844029755665 L20 -N118 0.185604027119426 F232 -Y246 0.184361321092412 Y53 -S114 0.183617911205462 L27 -T180 0.183089467653225 I49 -A56 0.182996361765503 T57 -G112 0.182723617089999 P32 -S233 0.181797786947717 L19 -S141 0.18106006617054 I60 -A109 0.180868294094028 P29 -F111 0.179970202320705 A113 -S119 0.179597655324652 T54 -F111 0.178968884391294 N143 -G253 0.178772646178083 C87 -F172 0.178510494073031 Y25 -S182 0.176175730581023 L27 -P110 0.176145780139639 W168 -G175 0.175824778839884 P32 -E235 0.175288201114466 T28 -L78 0.175233569292066 A145 -T180 0.173753448593232 Y228 -E235 0.173545098811434 P32 -G112 0.173100468354257 A248 -R258 0.172112614820906 E236 -G253 0.171973553726549 L19 -N142 0.171915784109452 I79 -T115 0.171712250136724 L81 -S114 0.171519249224494 Y25 -P150 0.17044970828482 R61 -V116 0.170086634379223 L78 -S182 0.168486516546917 S51 -K234 0.167374455930412 K234 -F247 0.166855196119283 N118 -T180 0.165264767661147 G47 -A56 0.165263389573001 P110 -L171 0.16525565546337 F22 -M146 0.165150009319955 A23 -I179 0.164527043204318 M146 -G253 0.164313604587823 S233 -G244 0.164290913568633 L58 -A113 0.164037264174967 A82 -G108 0.163457834435982 L50 -G101 0.162964478668678 K234 -T240 0.161766173608983 N227 -L250 0.161217909444206 L31 -G47 0.160948076629194 G112 -A230 0.16084781079032 F84 -A174 0.160664135512093 Y25 -S117 0.160154523588307 F24 -F172 0.158896976154354 G47 -G108 0.157971028604864 F88 -R104 0.157812587552581 L26 -G175 0.157527162772355 P110 -T115 0.156162906931024 F22 -S182 0.15569619844955 L55 -M99 0.1554286997725 C80 -L166 0.154206401705065 S114 -L225 0.154003473720208 I86 -T105 0.153322126745735 F84 -F167 0.152893887431279 N143 -L254 0.15223534245836 T115 -K234 0.15223353517674 F22 -L140 0.151584736308694 S233 -A248 0.151309037643678 T105 -P110 0.15125276428783 Y21 -S117 0.150650901245778 I76 -A113 0.149790385674879 T115 -T180 0.148683019445595 T28 -G112 0.147068005676914 G112 -L229 0.145875769913085 P29 -G175 0.145164397650396 N118 -L225 0.144662076766074 L26 -Y228 0.143976593873474 A56 -F111 0.143541310164184 T115 -T176 0.14340930199624 L81 -A177 0.142348590464522 I48 -A56 0.141909400167157 I148 -T176 0.141063583095498 T28 -P110 0.140570163070751 M146 -A170 0.139654490770235 F22 -N118 0.139614245908495 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