# Complex Name: 1S1Q
# ligand file: ./DBD4/1S1Q_l_u.pdb
# Receptor file: ./DBD4/1S1Q_r_u.pdb
# Ligand Name: 1S1Q_l:
# Receptor Name: 1S1Q_r:
# Time taken (s): 852.274865866
# Number of examples: 10010
AUC = 0.793830298155
1S1Q_l:A G 47 45 45 1S1Q_r:A S 41 38 38 0.740678797828 1
1S1Q_l:A A 46 44 44 1S1Q_r:A Y 42 39 39 0.285532888839 1
1S1Q_l:A G 47 45 45 1S1Q_r:A Y 42 39 39 0.496837250801 1
1S1Q_l:A K 48 46 46 1S1Q_r:A Y 42 39 39 0.586053357196 1
1S1Q_l:A R 42 40 40 1S1Q_r:A V 43 40 40 0.577284430522 1
1S1Q_l:A I 44 42 42 1S1Q_r:A V 43 40 40 0.916663094618 1
1S1Q_l:A F 45 43 43 1S1Q_r:A V 43 40 40 0.0217956576416 1
1S1Q_l:A A 46 44 44 1S1Q_r:A V 43 40 40 0.67360982395 1
1S1Q_l:A G 47 45 45 1S1Q_r:A V 43 40 40 0.899364574665 1
1S1Q_l:A K 48 46 46 1S1Q_r:A V 43 40 40 0.915841103694 1
1S1Q_l:A Q 49 47 47 1S1Q_r:A V 43 40 40 0.663735054789 1
1S1Q_l:A I 44 42 42 1S1Q_r:A F 44 41 41 1.19678961501 1
1S1Q_l:A G 47 45 45 1S1Q_r:A F 44 41 41 1.0173606027 1
1S1Q_l:A V 70 68 68 1S1Q_r:A F 44 41 41 1.26989991341 1
1S1Q_l:A L 8 7 7 1S1Q_r:A N 45 42 42 0.512389195068 1
1S1Q_l:A I 44 42 42 1S1Q_r:A N 45 42 42 0.514161853466 1
1S1Q_l:A F 45 43 43 1S1Q_r:A N 45 42 42 -0.242631977529 1
1S1Q_l:A A 46 44 44 1S1Q_r:A N 45 42 42 0.381277461417 1
1S1Q_l:A G 47 45 45 1S1Q_r:A N 45 42 42 0.303497559548 1
1S1Q_l:A H 68 66 66 1S1Q_r:A N 45 42 42 0.710578301357 1
1S1Q_l:A L 69 67 67 1S1Q_r:A N 45 42 42 -0.0552887584754 1
1S1Q_l:A V 70 68 68 1S1Q_r:A N 45 42 42 0.5517266813 1
1S1Q_l:A L 8 7 7 1S1Q_r:A D 46 43 43 0.0415727848456 1
1S1Q_l:A R 42 40 40 1S1Q_r:A D 46 43 43 -0.0638211684723 1
1S1Q_l:A I 44 42 42 1S1Q_r:A D 46 43 43 0.193119817704 1
1S1Q_l:A H 68 66 66 1S1Q_r:A D 46 43 43 0.325225827852 1
1S1Q_l:A V 70 68 68 1S1Q_r:A D 46 43 43 0.139225565569 1
1S1Q_l:A R 42 40 40 1S1Q_r:A G 47 44 44 0.122246758679 1
1S1Q_l:A I 44 42 42 1S1Q_r:A G 47 44 44 0.5694841984 1
1S1Q_l:A Q 49 47 47 1S1Q_r:A G 47 44 44 0.153522049199 1
1S1Q_l:A V 70 68 68 1S1Q_r:A G 47 44 44 0.657169693515 1
1S1Q_l:A R 42 40 40 1S1Q_r:A S 48 45 45 0.243200426857 1
1S1Q_l:A A 46 44 44 1S1Q_r:A W 75 72 72 0.227292452701 1
1S1Q_l:A G 47 45 45 1S1Q_r:A W 75 72 72 0.485396054305 1
1S1Q_l:A A 46 44 44 1S1Q_r:A F 88 85 85 -0.0822549515437 1
1S1Q_l:A G 47 45 45 1S1Q_r:A F 88 85 85 0.319797372451 1
1S1Q_l:A F 45 43 43 1S1Q_r:A K 90 87 87 -0.57518802848 1
1S1Q_l:A A 46 44 44 1S1Q_r:A K 90 87 87 0.372168009097 1
1S1Q_l:A Y 59 57 57 1S1Q_r:A P 91 88 88 -0.771769725855 1
1S1Q_l:A N 60 58 58 1S1Q_r:A P 91 88 88 -0.655366239625 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A P 91 88 88 -0.539095916782 1
1S1Q_l:A N 60 58 58 1S1Q_r:A T 92 89 89 -0.551845252169 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A T 92 89 89 -0.326524707893 1
1S1Q_l:A N 60 58 58 1S1Q_r:A S 93 90 90 -0.863435809121 1
1S1Q_l:A N 60 58 58 1S1Q_r:A S 94 91 91 -0.706624238434 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A T 96 93 93 -0.533589970489 1
1S1Q_l:A K 63 61 61 1S1Q_r:A T 96 93 93 -0.549961236125 1
1S1Q_l:A N 60 58 58 1S1Q_r:A I 97 94 94 -0.840210279092 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A I 97 94 94 -0.651198984202 1
1S1Q_l:A K 63 61 61 1S1Q_r:A I 97 94 94 -0.342009809104 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A K 98 95 95 -0.453343860151 1
1S1Q_l:A K 63 61 61 1S1Q_r:A T 99 96 96 -0.48941842372 1
1S1Q_l:A F 45 43 43 1S1Q_r:A A 105 102 102 0.302200572284 1
1S1Q_l:A Q 62 60 60 1S1Q_r:A A 105 102 102 -0.167217993262 1
1S1Q_l:A K 63 61 61 1S1Q_r:A A 105 102 102 0.169295280151 1
1S1Q_l:A E 64 62 62 1S1Q_r:A A 105 102 102 0.149574205458 1
1S1Q_l:A S 65 63 63 1S1Q_r:A A 105 102 102 -0.162307140386 1
1S1Q_l:A T 66 64 64 1S1Q_r:A A 105 102 102 0.672994073583 1
1S1Q_l:A F 45 43 43 1S1Q_r:A N 106 103 103 -0.172076409372 1
1S1Q_l:A A 46 44 44 1S1Q_r:A N 106 103 103 0.147242582857 1
1S1Q_l:A E 64 62 62 1S1Q_r:A N 106 103 103 -0.214422423432 1
1S1Q_l:A S 65 63 63 1S1Q_r:A N 106 103 103 -0.355277133647 1
1S1Q_l:A T 66 64 64 1S1Q_r:A N 106 103 103 0.297362448301 1
1S1Q_l:A L 67 65 65 1S1Q_r:A N 106 103 103 -0.620060254767 1
1S1Q_l:A F 45 43 43 1S1Q_r:A G 107 104 104 -1.32917411873 1
1S1Q_l:A K 63 61 61 1S1Q_r:A F 142 139 139 -0.300962941472 1
1S1Q_l:A I 36 34 34 1S1Q_r:A S 49 46 46 -0.482816877261 -1
1S1Q_l:A D 32 31 31 1S1Q_r:A P 37 34 34 -1.4413913756 -1
1S1Q_l:A F 4 3 3 1S1Q_r:A V 134 131 131 -0.117993697031 -1
1S1Q_l:A A 46 44 44 1S1Q_r:A V 133 130 130 0.574799171386 -1
1S1Q_l:A T 55 53 53 1S1Q_r:A H 102 99 99 -1.24282929982 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A F 44 41 41 -0.275719015489 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A E 51 48 48 -1.56313992802 -1
1S1Q_l:A E 18 17 17 1S1Q_r:A V 43 40 40 -0.318197968469 -1
1S1Q_l:A L 8 7 7 1S1Q_r:A L 125 122 122 0.751015106851 -1
1S1Q_l:A H 68 66 66 1S1Q_r:A I 86 83 83 0.228495136516 -1
1S1Q_l:A S 65 63 63 1S1Q_r:A G 126 123 123 -0.788691004267 -1
1S1Q_l:A R 54 52 52 1S1Q_r:A G 57 54 54 -0.769947209473 -1
1S1Q_l:A E 64 62 62 1S1Q_r:A T 79 76 76 0.0202840856916 -1
1S1Q_l:A V 26 25 25 1S1Q_r:A L 8 5 5 -2.70107853763 -1
1S1Q_l:A K 29 28 28 1S1Q_r:A I 86 83 83 -1.54250043587 -1
1S1Q_l:A L 71 69 69 1S1Q_r:A Q 121 118 118 0.260621899503 -1
1S1Q_l:A P 38 36 36 1S1Q_r:A P 81 78 78 -2.19421740449 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A C 87 84 84 -1.38187751374 -1
1S1Q_l:A K 63 61 61 1S1Q_r:A L 74 71 71 -1.75852271586 -1
1S1Q_l:A R 42 40 40 1S1Q_r:A P 84 81 81 0.195188767793 -1
1S1Q_l:A G 10 9 9 1S1Q_r:A I 59 56 56 -0.374402312012 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A T 58 55 55 -0.689628845457 -1
1S1Q_l:A V 26 25 25 1S1Q_r:A F 142 139 139 -1.39825259711 -1
1S1Q_l:A Q 49 47 47 1S1Q_r:A E 5 2 2 -0.191230665217 -1
1S1Q_l:A T 12 11 11 1S1Q_r:A V 133 130 130 0.0331074867898 -1
1S1Q_l:A K 27 26 26 1S1Q_r:A L 127 124 124 -2.49857626447 -1
1S1Q_l:A F 4 3 3 1S1Q_r:A Q 7 4 4 -0.215802156935 -1
1S1Q_l:A P 38 36 36 1S1Q_r:A L 111 108 108 -1.30235627513 -1
1S1Q_l:A T 66 64 64 1S1Q_r:A D 34 31 31 -0.285852981273 -1
1S1Q_l:A S 65 63 63 1S1Q_r:A V 43 40 40 -0.423429770383 -1
1S1Q_l:A F 45 43 43 1S1Q_r:A D 34 31 31 -0.661884106676 -1
1S1Q_l:A Q 49 47 47 1S1Q_r:A M 131 128 128 -1.46878804219 -1
1S1Q_l:A F 4 3 3 1S1Q_r:A I 29 26 26 -0.212658986449 -1
1S1Q_l:A E 64 62 62 1S1Q_r:A F 44 41 41 0.430874743803 -1
1S1Q_l:A L 56 54 54 1S1Q_r:A L 52 49 49 -1.71589385671 -1
1S1Q_l:A T 14 13 13 1S1Q_r:A F 142 139 139 -0.00369010329351 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A E 24 21 21 -0.957863666794 -1
1S1Q_l:A Q 49 47 47 1S1Q_r:A V 22 19 19 -0.685368545112 -1
1S1Q_l:A F 4 3 3 1S1Q_r:A T 79 76 76 -0.0535149331274 -1
1S1Q_l:A A 28 27 27 1S1Q_r:A T 67 64 64 -0.954507956304 -1
1S1Q_l:A T 12 11 11 1S1Q_r:A L 74 71 71 -1.28868684289 -1
1S1Q_l:A R 42 40 40 1S1Q_r:A P 140 137 137 -0.38102598744 -1
1S1Q_l:A K 11 10 10 1S1Q_r:A I 132 129 129 -0.268103209099 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A V 130 127 127 -2.01248764724 -1
1S1Q_l:A V 5 4 4 1S1Q_r:A K 101 98 98 -1.79453085594 -1
1S1Q_l:A I 44 42 42 1S1Q_r:A Y 15 12 12 -0.046628014058 -1
1S1Q_l:A V 70 68 68 1S1Q_r:A H 102 99 99 0.477280982374 -1
1S1Q_l:A T 14 13 13 1S1Q_r:A S 122 119 119 -0.35245409428 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A H 119 116 116 -0.42498683696 -1
1S1Q_l:A T 22 21 21 1S1Q_r:A W 75 72 72 -1.06239595377 -1
1S1Q_l:A I 23 22 22 1S1Q_r:A S 48 45 45 -1.54798055939 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A P 139 136 136 -0.742479350727 -1
1S1Q_l:A T 12 11 11 1S1Q_r:A P 140 137 137 -0.283603328407 -1
1S1Q_l:A V 70 68 68 1S1Q_r:A G 100 97 97 0.484773153457 -1
1S1Q_l:A Y 59 57 57 1S1Q_r:A L 111 108 108 -0.890417476882 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A K 36 33 33 -0.639068676376 -1
1S1Q_l:A K 11 10 10 1S1Q_r:A L 8 5 5 -1.12523207202 -1
1S1Q_l:A I 23 22 22 1S1Q_r:A V 3 0 0 -1.52888229733 -1
1S1Q_l:A V 17 16 16 1S1Q_r:A D 123 120 120 -1.29924262862 -1
1S1Q_l:A L 56 54 54 1S1Q_r:A M 131 128 128 -2.09068981292 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A Q 129 126 126 -1.28462220156 -1
1S1Q_l:A F 45 43 43 1S1Q_r:A E 5 2 2 -0.978987964745 -1
1S1Q_l:A E 24 23 23 1S1Q_r:A H 102 99 99 -1.27269695034 -1
1S1Q_l:A E 64 62 62 1S1Q_r:A D 104 101 101 0.0879106344817 -1
1S1Q_l:A K 27 26 26 1S1Q_r:A W 75 72 72 -1.52753788486 -1
1S1Q_l:A I 13 12 12 1S1Q_r:A D 78 75 75 -0.916895724698 -1
1S1Q_l:A D 58 56 56 1S1Q_r:A L 20 17 17 -0.544648998863 -1
1S1Q_l:A Y 59 57 57 1S1Q_r:A R 23 20 20 -0.628581964225 -1
1S1Q_l:A K 29 28 28 1S1Q_r:A Q 7 4 4 -0.903390290831 -1
1S1Q_l:A E 24 23 23 1S1Q_r:A S 94 91 91 -0.683242532287 -1
1S1Q_l:A P 37 35 35 1S1Q_r:A K 10 7 7 -0.103436684187 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A V 28 25 25 -1.60901233271 -1
1S1Q_l:A A 46 44 44 1S1Q_r:A P 91 88 88 0.216201883175 -1
1S1Q_l:A L 8 7 7 1S1Q_r:A Q 7 4 4 0.14081767642 -1
1S1Q_l:A L 50 48 48 1S1Q_r:A G 100 97 97 -1.70808105264 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A N 69 66 66 -0.44602720307 -1
1S1Q_l:A I 13 12 12 1S1Q_r:A V 38 35 35 -0.617228770886 -1
1S1Q_l:A P 38 36 36 1S1Q_r:A P 140 137 137 -2.28401352213 -1
1S1Q_l:A K 11 10 10 1S1Q_r:A I 59 56 56 -0.624918803397 -1
1S1Q_l:A I 13 12 12 1S1Q_r:A C 87 84 84 -1.44091014932 -1
1S1Q_l:A D 32 31 31 1S1Q_r:A D 123 120 120 -0.742217739205 -1
1S1Q_l:A I 13 12 12 1S1Q_r:A N 45 42 42 -0.33280790497 -1
1S1Q_l:A L 56 54 54 1S1Q_r:A A 105 102 102 -0.124555514371 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A P 91 88 88 -0.615455169245 -1
1S1Q_l:A D 21 20 20 1S1Q_r:A P 62 59 59 -0.609442980444 -1
1S1Q_l:A D 21 20 20 1S1Q_r:A G 107 104 104 -1.55743801597 -1
1S1Q_l:A D 21 20 20 1S1Q_r:A N 69 66 66 -0.839237363572 -1
1S1Q_l:A D 58 56 56 1S1Q_r:A E 51 48 48 -0.0812023062145 -1
1S1Q_l:A L 15 14 14 1S1Q_r:A P 145 142 142 -1.26056648254 -1
1S1Q_l:A P 19 18 18 1S1Q_r:A P 62 59 59 -0.458357689636 -1
1S1Q_l:A L 67 65 65 1S1Q_r:A T 21 18 18 -2.24444332573 -1
1S1Q_l:A I 13 12 12 1S1Q_r:A Q 121 118 118 -0.624509080038 -1
1S1Q_l:A Q 31 30 30 1S1Q_r:A S 13 10 10 -0.93887207402 -1
1S1Q_l:A Q 41 39 39 1S1Q_r:A E 5 2 2 -1.42230524741 -1
1S1Q_l:A V 17 16 16 1S1Q_r:A E 5 2 2 -1.80309124309 -1
1S1Q_l:A K 29 28 28 1S1Q_r:A P 145 142 142 -1.24045787199 -1
1S1Q_l:A R 42 40 40 1S1Q_r:A D 104 101 101 0.333672834063 -1
1S1Q_l:A T 22 21 21 1S1Q_r:A L 127 124 124 -2.15808080027 -1
1S1Q_l:A K 63 61 61 1S1Q_r:A Y 15 12 12 -0.745485668871 -1
1S1Q_l:A K 27 26 26 1S1Q_r:A V 103 100 100 -1.78376190122 -1
1S1Q_l:A P 19 18 18 1S1Q_r:A E 51 48 48 -0.424308240654 -1
1S1Q_l:A Q 31 30 30 1S1Q_r:A Y 80 77 77 -1.7348606991 -1
1S1Q_l:A L 15 14 14 1S1Q_r:A R 144 141 141 -0.597442994558 -1
1S1Q_l:A F 4 3 3 1S1Q_r:A K 16 13 13 -0.147493845338 -1
1S1Q_l:A D 21 20 20 1S1Q_r:A K 9 6 6 -0.86213478115 -1
1S1Q_l:A Q 62 60 60 1S1Q_r:A G 136 133 133 -0.837097776905 -1
1S1Q_l:A Q 2 1 1 1S1Q_r:A W 75 72 72 -0.00570227192057 -1
1S1Q_l:A L 50 48 48 1S1Q_r:A K 118 115 115 -1.22236565162 -1
1S1Q_l:A K 63 61 61 1S1Q_r:A V 89 86 86 -1.37237603861 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A L 52 49 49 -1.39562263182 -1
1S1Q_l:A Q 62 60 60 1S1Q_r:A L 8 5 5 -1.33547484349 -1
1S1Q_l:A L 69 67 67 1S1Q_r:A S 49 46 46 0.00748447333219 -1
1S1Q_l:A K 27 26 26 1S1Q_r:A K 90 87 87 -1.23701496757 -1
1S1Q_l:A S 20 19 19 1S1Q_r:A R 64 61 61 -0.498994194533 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A R 64 61 61 -0.78768478619 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A I 29 26 26 -2.09561318132 -1
1S1Q_l:A Q 40 38 38 1S1Q_r:A P 60 57 57 0.0675792468633 -1
1S1Q_l:A Q 62 60 60 1S1Q_r:A W 117 114 114 -0.636647775433 -1
1S1Q_l:A D 52 50 50 1S1Q_r:A N 83 80 80 -0.690781903297 -1
1S1Q_l:A S 65 63 63 1S1Q_r:A M 11 8 8 -0.901116219871 -1
1S1Q_l:A L 56 54 54 1S1Q_r:A V 3 0 0 -1.35174132734 -1
1S1Q_l:A R 54 52 52 1S1Q_r:A G 47 44 44 -0.894775355187 -1
1S1Q_l:A T 9 8 8 1S1Q_r:A R 50 47 47 0.437976590271 -1
1S1Q_l:A Q 49 47 47 1S1Q_r:A T 96 93 93 -0.010935807095 -1
1S1Q_l:A D 52 50 50 1S1Q_r:A V 103 100 100 -1.40200115819 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A Y 63 60 60 0.190734836791 -1
1S1Q_l:A K 63 61 61 1S1Q_r:A S 49 46 46 -0.269040390803 -1
1S1Q_l:A A 46 44 44 1S1Q_r:A I 128 125 125 -0.367851585691 -1
1S1Q_l:A L 50 48 48 1S1Q_r:A W 117 114 114 -1.94385937893 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A G 57 54 54 -0.807533563076 -1
1S1Q_l:A R 54 52 52 1S1Q_r:A T 79 76 76 -0.560575849312 -1
1S1Q_l:A N 25 24 24 1S1Q_r:A L 111 108 108 -0.665092145118 -1
1S1Q_l:A Q 41 39 39 1S1Q_r:A S 6 3 3 -1.2983454477 -1
1S1Q_l:A E 16 15 15 1S1Q_r:A K 33 30 30 -0.239916237005 -1
1S1Q_l:A E 24 23 23 1S1Q_r:A E 51 48 48 -0.715811501921 -1
1S1Q_l:A S 20 19 19 1S1Q_r:A C 87 84 84 -1.9118774195 -1
1S1Q_l:A G 53 51 51 1S1Q_r:A G 126 123 123 -0.742279896663 -1
1S1Q_l:A K 6 5 5 1S1Q_r:A D 137 134 134 0.687662801469 -1
1S1Q_l:A P 37 35 35 1S1Q_r:A M 11 8 8 -0.43263358652 -1
1S1Q_l:A L 1 0 0 1S1Q_r:A E 138 135 135 -0.486949565796 -1
1S1Q_l:A T 12 11 11 1S1Q_r:A L 125 122 122 0.127088081806 -1
1S1Q_l:A Q 62 60 60 1S1Q_r:A T 56 53 53 -0.89654306462 -1
1S1Q_l:A E 34 33 33 1S1Q_r:A Y 15 12 12 -0.755478664415 -1
1S1Q_l:A T 9 8 8 1S1Q_r:A S 49 46 46 0.339212717183 -1
1S1Q_l:A Q 41 39 39 1S1Q_r:A Y 80 77 77 -1.76447477551 -1
1S1Q_l:A K 6 5 5 1S1Q_r:A P 140 137 137 -0.615569240342 -1
1S1Q_l:A D 21 20 20 1S1Q_r:A Q 121 118 118 -0.585194312957 -1
1S1Q_l:A I 23 22 22 1S1Q_r:A V 26 23 23 -1.8993396777 -1
1S1Q_l:A K 33 32 32 1S1Q_r:A T 96 93 93 -1.04327519698 -1
1S1Q_l:A V 70 68 68 1S1Q_r:A G 65 62 62 0.969579612241 -1
1S1Q_l:A L 43 41 41 1S1Q_r:A I 29 26 26 -1.05768790426 -1
1S1Q_l:A I 3 2 2 1S1Q_r:A F 88 85 85 -1.81850123047 -1
1S1Q_l:A E 18 17 17 1S1Q_r:A I 29 26 26 -1.16703680076 -1
1S1Q_l:A E 18 17 17 1S1Q_r:A L 111 108 108 -0.739956667338 -1
1S1Q_l:A S 65 63 63 1S1Q_r:A S 122 119 119 -0.969820563052 -1
1S1Q_l:A T 14 13 13 1S1Q_r:A K 10 7 7 0.188181538105 -1
1S1Q_l:A D 39 37 37 1S1Q_r:A V 133 130 130 -0.858235785751 -1
1S1Q_l:A L 69 67 67 1S1Q_r:A T 25 22 22 -1.83642732086 -1
1S1Q_l:A L 69 67 67 1S1Q_r:A L 114 111 111 -0.407778909962 -1
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