*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 28 3 RMSD = 0.79 A TRANSFORM -0.7999 0.5259 -0.2890 -0.5125 -0.3480 0.7850 0.3123 0.7761 0.5479 28.896 32.744 47.831 A 241 ASP B 68 ASP~? A 265 GLU A 33 GLU^? A 369 ASP A 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 RMSD = 0.83 A TRANSFORM 0.7826 -0.5819 -0.2211 0.5637 0.5117 0.6484 -0.2642 -0.6321 0.7285 25.176 -3.164 86.700 A 241 ASP A 68 ASP~? A 265 GLU B 33 GLU^? A 369 ASP B 56 ASP.? ULMNm 3 1cns_c00 CHITINASE user 4 3 RMSD = 0.92 A TRANSFORM 0.3117 0.9236 -0.2233 0.3959 0.0874 0.9141 0.8638 -0.3733 -0.3384 -43.050 -27.111 92.022 A 67 GLU B 52 GLU.? A 89 GLU B 22 GLU.? A 120 SER B 49 SER.? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.95 A TRANSFORM 0.0289 -0.8334 -0.5519 0.5650 0.4690 -0.6788 0.8246 -0.2922 0.4845 37.636 -0.835 -12.723 B 99 ARG A 126 ARG~? B 101 ASP B 68 ASP~? B 132 ASP A 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 24 3 RMSD = 0.97 A TRANSFORM 0.0945 0.8791 0.4672 -0.7084 -0.2703 0.6520 0.6995 -0.3926 0.5972 -28.574 30.642 58.861 A 241 ASP B 61 ASP~? A 265 GLU A 69 GLU~? A 369 ASP A 61 ASP~? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 0.97 A TRANSFORM -0.0751 0.6865 -0.7233 -0.6061 -0.6074 -0.5136 -0.7919 0.3998 0.4617 7.999 41.127 0.297 B 99 ARG B 126 ARG~? B 101 ASP A 68 ASP~? B 132 ASP B 56 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.98 A TRANSFORM -0.0318 0.8267 0.5617 -0.4845 -0.5043 0.7148 0.8742 -0.2495 0.4166 -14.719 24.065 -13.892 A 99 ARG A 126 ARG~? A 101 ASP B 68 ASP~? A 132 ASP A 56 ASP.? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 RMSD = 0.99 A TRANSFORM 0.0615 -0.8377 -0.5426 0.5771 0.4734 -0.6655 0.8144 -0.2722 0.5125 36.685 -1.323 -13.530 B 99 ARG A 126 ARG~? B 101 ASP B 68 ASP~? B 132 ASP A 56 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.00 A TRANSFORM 0.0787 -0.6778 0.7311 0.5280 0.6504 0.5461 -0.8456 0.3431 0.4090 14.492 -16.833 2.920 A 99 ARG B 126 ARG~? A 101 ASP A 68 ASP~? A 132 ASP B 56 ASP.? ULMNm 3 1cns_c00 CHITINASE user 2 3 RMSD = 1.00 A TRANSFORM -0.3072 -0.9516 -0.0068 -0.4020 0.1233 0.9073 -0.8626 0.2815 -0.4204 6.595 -11.875 109.153 A 67 GLU A 52 GLU.? A 89 GLU A 22 GLU.? A 120 SER A 49 SER.? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 RMSD = 1.01 A TRANSFORM -0.0430 0.8246 0.5641 -0.4657 -0.5160 0.7189 0.8839 -0.2318 0.4062 -14.330 23.735 -14.300 A 99 ARG A 126 ARG~? A 101 ASP B 68 ASP~? A 132 ASP A 56 ASP.? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 17 3 RMSD = 1.01 A TRANSFORM 0.3874 -0.0409 0.9210 0.1977 -0.9721 -0.1263 0.9004 0.2311 -0.3685 -14.735 64.010 75.711 A 241 ASP B 56 ASP.? A 279 GLU B 23 GLU.? A 369 ASP A 68 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 RMSD = 1.02 A TRANSFORM -0.1073 0.6932 -0.7128 -0.6171 -0.6085 -0.4989 -0.7795 0.3863 0.4931 7.907 41.144 -0.203 B 99 ARG B 126 ARG~? B 101 ASP A 68 ASP~? B 132 ASP B 56 ASP.? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.04 A TRANSFORM 0.0902 -0.6754 0.7319 0.5093 0.6628 0.5489 -0.8558 0.3233 0.4038 14.413 -17.032 3.620 A 99 ARG B 126 ARG~? A 101 ASP A 68 ASP~? A 132 ASP B 56 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 32 3 RMSD = 1.07 A TRANSFORM 0.5722 0.6559 -0.4923 0.1373 0.5152 0.8460 0.8085 -0.5517 0.2047 41.408 1.777 0.077 199 ASP B 68 ASP~? 218 GLU A 90 GLU~? 329 ASP A 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 RMSD = 1.11 A TRANSFORM 0.4310 -0.2835 0.8567 0.0576 0.9561 0.2874 -0.9005 -0.0745 0.4284 -15.965 8.632 95.362 A 241 ASP A 56 ASP.? A 265 GLU A 132 GLU~? A 369 ASP B 68 ASP~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.13 A TRANSFORM -0.3701 0.2911 0.8822 -0.1791 0.9095 -0.3752 -0.9116 -0.2968 -0.2844 -7.587 32.472 118.126 A 241 ASP A 56 ASP.? A 279 GLU A 23 GLU.? A 369 ASP B 68 ASP~? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.14 A TRANSFORM -0.8004 -0.5675 -0.1929 -0.4557 0.7852 -0.4193 0.3894 -0.2477 -0.8871 40.906 30.663 84.579 D 203 GLN B 130 GLN~? D 207 HIS B 44 HIS^? D 385 TYR B 30 TYR^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 25 3 RMSD = 1.14 A TRANSFORM 0.4391 -0.8875 0.1394 0.4139 0.3375 0.8455 -0.7974 -0.3136 0.5155 39.710 57.779 14.583 193 ASP B 61 ASP~? 231 ASP B 121 ASP~? 294 ASP A 61 ASP~? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.14 A TRANSFORM 0.7207 0.5697 -0.3950 0.4813 -0.8213 -0.3064 -0.4990 0.0307 -0.8661 -6.469 48.550 93.761 D 203 GLN A 130 GLN~? D 207 HIS A 44 HIS^? D 385 TYR A 30 TYR^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 23 3 RMSD = 1.14 A TRANSFORM -0.3556 0.4648 0.8108 -0.0259 -0.8721 0.4886 0.9343 0.1528 0.3222 -18.261 48.138 60.178 A 241 ASP B 56 ASP.? A 265 GLU B 132 GLU~? A 369 ASP A 68 ASP~? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.15 A TRANSFORM -0.7897 -0.5983 -0.1360 -0.3478 0.2539 0.9025 -0.5054 0.7600 -0.4086 51.800 6.961 -5.767 A 203 GLN B 130 GLN~? A 207 HIS B 44 HIS^? A 385 TYR B 30 TYR^? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.15 A TRANSFORM 0.7130 0.6107 -0.3445 0.4600 -0.0365 0.8872 0.5292 -0.7910 -0.3070 3.228 -0.696 9.421 A 203 GLN A 130 GLN~? A 207 HIS A 44 HIS^? A 385 TYR A 30 TYR^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 29 3 RMSD = 1.15 A TRANSFORM 0.0903 -0.2323 -0.9684 -0.9959 -0.0289 -0.0859 -0.0080 0.9722 -0.2340 38.488 61.131 72.403 A 241 ASP B 68 ASP~? A 265 GLU A 132 GLU~? A 369 ASP A 56 ASP.? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.16 A TRANSFORM 0.7926 0.6043 0.0812 0.2907 -0.2574 -0.9215 -0.5360 0.7540 -0.3797 33.144 60.426 53.556 C 203 GLN B 130 GLN~? C 207 HIS B 44 HIS^? C 385 TYR B 30 TYR^? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.16 A TRANSFORM -0.7209 -0.6282 0.2928 -0.4057 0.0400 -0.9131 0.5619 -0.7771 -0.2837 82.405 66.165 67.306 C 203 GLN A 130 GLN~? C 207 HIS A 44 HIS^? C 385 TYR A 30 TYR^? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.16 A TRANSFORM 0.7869 0.5973 0.1549 0.5049 -0.7676 0.3949 0.3548 -0.2325 -0.9056 43.174 37.342 24.241 B 203 GLN B 130 GLN~? B 207 HIS B 44 HIS^? B 385 TYR B 30 TYR^? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.16 A TRANSFORM -0.7083 -0.6058 0.3624 -0.5309 0.7955 0.2921 -0.4653 0.0145 -0.8850 91.492 21.937 32.978 B 203 GLN A 130 GLN~? B 207 HIS A 44 HIS^? B 385 TYR A 30 TYR^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 9 3 RMSD = 1.17 A TRANSFORM -0.4091 0.9118 -0.0370 -0.3829 -0.1347 0.9139 0.8283 0.3880 0.4042 17.131 81.393 -28.404 193 ASP A 61 ASP~? 231 ASP A 121 ASP~? 294 ASP B 61 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 3 3 RMSD = 1.17 A TRANSFORM -0.3895 -0.7779 -0.4931 0.7764 -0.5653 0.2786 -0.4955 -0.2743 0.8241 69.187 54.434 24.452 A 228 ASP A 56 ASP.? A 261 ASP A 140 ASP~? A 329 ASP B 68 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 RMSD = 1.18 A TRANSFORM -0.1777 0.0211 -0.9839 0.9841 -0.0032 -0.1778 -0.0069 -0.9998 -0.0202 37.461 27.643 113.357 A 241 ASP A 68 ASP~? A 265 GLU B 132 GLU~? A 369 ASP B 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 9 3 RMSD = 1.18 A TRANSFORM -0.1031 -0.7481 0.6555 0.7453 0.3783 0.5490 -0.6587 0.5452 0.5185 8.363 -8.238 63.256 A 241 ASP A 61 ASP~? A 265 GLU B 69 GLU~? A 369 ASP B 61 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 RMSD = 1.18 A TRANSFORM -0.5933 -0.7477 -0.2982 -0.0814 -0.3128 0.9463 -0.8009 0.5857 0.1247 90.322 22.616 3.878 199 ASP A 68 ASP~? 218 GLU B 90 GLU~? 329 ASP B 56 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 21 3 RMSD = 1.21 A TRANSFORM 0.3387 0.6358 -0.6935 -0.7495 0.6279 0.2096 0.5687 0.4488 0.6893 27.950 55.169 -7.985 A 228 ASP B 56 ASP.? A 261 ASP B 140 ASP~? A 329 ASP A 68 ASP~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 6 3 RMSD = 1.24 A TRANSFORM -0.8970 0.4357 0.0744 0.2266 0.5979 -0.7689 -0.3795 -0.6728 -0.6351 33.614 -0.673 67.293 A 44 HIS B 133 HIS~? A 45 HIS B 44 HIS^? A 261 PHE B 103 PHE^? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 RMSD = 1.24 A TRANSFORM 0.5638 0.7528 0.3397 0.6357 -0.6581 0.4034 0.5272 -0.0115 -0.8496 21.867 -20.131 -15.691 A 37 ASP A 112 ASP^? A 56 ILE A 5 ILE~? A 82 TYR A 88 TYR~? ULMNm 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 3 3 RMSD = 1.25 A TRANSFORM -0.2059 -0.5274 0.8243 0.9504 0.0930 0.2969 -0.2332 0.8445 0.4821 -7.600 -16.142 -54.921 A 150 TYR A 143 TYR~? A 245 ASP B 68 ASP~? A 273 LYS A 55 LYS^? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 3 3 RMSD = 1.26 A TRANSFORM 0.9022 -0.4253 0.0716 -0.2962 -0.7318 -0.6137 0.3134 0.5325 -0.7863 21.858 36.263 30.660 A 44 HIS A 133 HIS~? A 45 HIS A 44 HIS^? A 261 PHE A 103 PHE^? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 11 3 RMSD = 1.27 A TRANSFORM 0.0479 0.3781 0.9245 -0.6779 -0.6675 0.3081 0.7336 -0.6415 0.2243 -48.989 80.967 42.109 D 130 SER A 82 SER~? D 166 PHE A 41 PHE^? D 182 PHE A 29 PHE^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 RMSD = 1.27 A TRANSFORM 0.5595 0.7570 0.3374 0.6235 -0.6527 0.4304 0.5461 -0.0305 -0.8372 24.855 -36.414 -43.846 B 37 ASP A 112 ASP^? B 56 ILE A 5 ILE~? B 82 TYR A 88 TYR~? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 25 3 RMSD = 1.28 A TRANSFORM -0.0075 -0.1695 0.9855 0.6949 0.7078 0.1270 -0.7191 0.6858 0.1125 -36.896 29.121 39.261 D 130 SER B 82 SER~? D 166 PHE B 41 PHE^? D 182 PHE B 29 PHE^? ULMNm 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 1 3 RMSD = 1.28 A TRANSFORM 0.9657 0.0986 -0.2401 0.1027 -0.9947 0.0044 -0.2384 -0.0289 -0.9707 -5.668 15.201 34.717 A 78 GLN A 130 GLN~? A 79 PHE A 134 PHE~? A 80 THR A 136 THR.? ULMNm 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 7 3 RMSD = 1.29 A TRANSFORM 0.2901 0.6871 0.6661 -0.9118 -0.0130 0.4105 0.2907 -0.7264 0.6227 -40.723 16.867 -30.532 A 150 TYR B 143 TYR~? A 245 ASP A 68 ASP~? A 273 LYS B 55 LYS.? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 10 3 RMSD = 1.30 A TRANSFORM -0.5078 0.1278 -0.8519 0.6767 0.6711 -0.3027 0.5331 -0.7302 -0.4273 -4.708 20.490 105.252 B 130 SER A 82 SER~? B 166 PHE A 41 PHE^? B 182 PHE A 29 PHE^? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 16 3 RMSD = 1.30 A TRANSFORM 0.7193 0.6822 0.1313 -0.6677 0.7310 -0.1407 -0.1919 0.0135 0.9813 -0.191 77.569 3.910 A 228 ASP B 68 ASP~? A 260 ASP B 61 ASP~? A 329 ASP A 58 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.31 A TRANSFORM 0.2040 0.7967 -0.5689 0.6668 -0.5385 -0.5151 -0.7168 -0.2743 -0.6411 -18.885 14.257 26.336 141 ASP B 36 ASP.? 166 GLY A 37 GLY.? 169 GLU B 76 GLU~? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 24 3 RMSD = 1.31 A TRANSFORM 0.4677 -0.3158 -0.8255 -0.6931 -0.7106 -0.1208 -0.5485 0.6287 -0.5512 -11.924 72.417 95.577 B 130 SER B 82 SER~? B 166 PHE B 41 PHE^? B 182 PHE B 29 PHE^? ULMNm 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 RMSD = 1.33 A TRANSFORM -0.9488 -0.2321 0.2142 -0.3155 0.6650 -0.6770 0.0147 -0.7099 -0.7041 -15.206 -2.277 38.682 B 14 ARG B 159 ARG.? B 161 ASP B 112 ASP^? B 174 TYR B 114 TYR^? ULMNm 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 RMSD = 1.33 A TRANSFORM 0.7388 0.6047 0.2974 0.3460 -0.7191 0.6027 0.5783 -0.3424 -0.7405 -14.744 10.307 38.352 A 14 ARG B 159 ARG.? A 161 ASP B 112 ASP^? A 174 TYR B 114 TYR^? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 RMSD = 1.33 A TRANSFORM -0.2690 0.5802 -0.7688 -0.3385 -0.8042 -0.4885 -0.9017 0.1288 0.4127 12.456 16.235 59.711 B 16 TYR B 74 TYR~? B 40 ASP A 68 ASP~? B 103 ASP B 56 ASP.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 28 3 RMSD = 1.33 A TRANSFORM 0.9756 0.0624 0.2104 -0.1897 0.7215 0.6659 -0.1103 -0.6896 0.7158 0.998 78.599 7.430 193 ASP B 68 ASP~? 231 ASP B 83 ASP~? 294 ASP A 56 ASP.? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 5 3 RMSD = 1.33 A TRANSFORM -0.3527 0.5943 -0.7228 0.3445 0.8007 0.4901 0.8700 -0.0762 -0.4871 11.178 -53.491 85.453 A 16 TYR B 74 TYR~? A 40 ASP A 68 ASP~? A 103 ASP B 56 ASP.? ULMNm 3 1kqf_c03 FORMATE DEHYDROGENASE, NITRATE-INDUCuser 6 3 RMSD = 1.33 A TRANSFORM 0.6272 -0.4630 -0.6263 0.1568 0.8627 -0.4807 0.7629 0.2033 0.6137 37.457 29.157 86.710 A 94 LYS B 154 LYS~? A 197 HIS B 44 HIS^? A 446 ARG B 126 ARG~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.33 A TRANSFORM 0.6801 -0.5866 -0.4397 0.7242 0.4441 0.5276 -0.1142 -0.6773 0.7268 16.949 -4.668 79.536 A 241 ASP A 56 ASP.? A 265 GLU A 33 GLU^? A 369 ASP B 68 ASP~? ULMNm 3 1dhp_c01 DIHYDRODIPICOLINATE SYNTHASE user 2 3 RMSD = 1.34 A TRANSFORM -0.5310 -0.2117 0.8205 0.8129 -0.4007 0.4227 0.2393 0.8914 0.3849 16.069 87.643 59.755 B 133 TYR A 104 TYR^? B 138 ARG A 28 ARG^? B 161 LYS A 108 LYS.? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.34 A TRANSFORM 0.4880 0.4445 0.7512 -0.5224 -0.5408 0.6593 0.6993 -0.7142 -0.0317 -29.912 9.006 11.197 B 99 ARG A 126 ARG~? B 101 ASP A 56 ASP.? B 132 ASP B 68 ASP~? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.34 A TRANSFORM 0.2169 -0.7422 -0.6341 0.2963 0.6690 -0.6817 0.9301 -0.0400 0.3650 31.617 -24.872 32.371 B 16 TYR A 74 TYR~? B 40 ASP B 68 ASP~? B 103 ASP A 56 ASP.? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.34 A TRANSFORM 0.3039 -0.7461 -0.5924 -0.3023 -0.6652 0.6827 -0.9035 -0.0283 -0.4277 27.842 -12.327 114.314 A 16 TYR A 74 TYR~? A 40 ASP B 68 ASP~? A 103 ASP A 56 ASP.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.34 A TRANSFORM -0.4068 -0.6529 -0.6389 -0.7463 0.6409 -0.1797 0.5268 0.4037 -0.7480 67.685 74.282 13.979 B 194 SER A 78 SER~? B 292 ASP B 58 ASP~? B 322 HIS A 35 HIS.? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 10 3 RMSD = 1.35 A TRANSFORM 0.2359 -0.4332 0.8699 0.5802 0.7809 0.2315 -0.7796 0.4501 0.4355 -49.895 7.099 85.876 A 130 SER A 82 SER~? A 166 PHE A 41 PHE^? A 182 PHE A 29 PHE^? ULMNm 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 3 3 RMSD = 1.35 A TRANSFORM 0.5658 0.3197 -0.7600 -0.7156 0.6484 -0.2599 0.4097 0.6909 0.5956 19.534 22.901 -8.588 A 68 ASP B 68 ASP~? A 74 ASP A 121 ASP~? A 98 GLU B 72 GLU~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.35 A TRANSFORM -0.4643 -0.4578 -0.7582 0.6159 0.4483 -0.6478 0.6365 -0.7678 0.0738 52.885 15.807 9.817 A 99 ARG A 126 ARG~? A 101 ASP A 56 ASP.? A 132 ASP B 68 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 11 3 RMSD = 1.35 A TRANSFORM -0.9591 -0.0074 0.2830 0.2399 -0.5519 0.7987 0.1503 0.8339 0.5310 35.235 97.653 -28.389 193 ASP A 68 ASP~? 231 ASP A 83 ASP~? 294 ASP B 56 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 21 3 RMSD = 1.35 A TRANSFORM 0.7383 -0.6264 0.2500 -0.2203 -0.5743 -0.7885 0.6375 0.5271 -0.5620 56.129 61.750 -11.094 199 ASP B 36 ASP.? 218 GLU A 22 GLU.? 329 ASP A 83 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 RMSD = 1.35 A TRANSFORM -0.4029 -0.9136 0.0551 -0.7204 0.3537 0.5966 -0.5646 0.2006 -0.8006 33.859 50.774 50.490 179 ASP A 68 ASP~? 227 GLU B 33 GLU^? 289 ASP B 56 ASP.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 16 3 RMSD = 1.35 A TRANSFORM 0.7984 0.5722 0.1874 -0.5966 0.7939 0.1178 -0.0814 -0.2059 0.9752 23.634 16.707 -2.315 199 ASP B 56 ASP.? 242 GLU B 6 GLU~? 329 ASP A 68 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 34 3 RMSD = 1.35 A TRANSFORM 0.8351 -0.5269 -0.1577 -0.4932 -0.8443 0.2093 -0.2434 -0.0970 -0.9651 51.114 52.322 26.410 199 ASP B 83 ASP~? 218 GLU A 6 GLU~? 329 ASP A 36 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 21 3 RMSD = 1.36 A TRANSFORM -0.7154 0.4782 -0.5095 -0.6803 -0.3100 0.6642 0.1597 0.8217 0.5470 18.394 34.596 43.906 A 241 ASP B 56 ASP.? A 265 GLU B 33 GLU^? A 369 ASP A 68 ASP~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.36 A TRANSFORM 0.0989 0.3366 -0.9364 0.5325 -0.8129 -0.2360 -0.8406 -0.4753 -0.2597 40.524 43.550 71.253 A 194 SER A 78 SER~? A 292 ASP B 58 ASP~? A 322 HIS A 35 HIS.? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 25 3 RMSD = 1.36 A TRANSFORM -0.1930 0.6137 0.7656 -0.5733 -0.7038 0.4195 0.7963 -0.3580 0.4877 -64.453 57.375 75.757 A 130 SER B 82 SER~? A 166 PHE B 41 PHE^? A 182 PHE B 29 PHE^? ULMNm 3 1dhp_c00 DIHYDRODIPICOLINATE SYNTHASE user 2 3 RMSD = 1.36 A TRANSFORM 0.5435 0.2003 -0.8151 -0.7449 -0.3324 -0.5784 -0.3868 0.9216 -0.0314 17.228 141.872 82.251 A 133 TYR A 104 TYR^? A 138 ARG A 28 ARG^? A 161 LYS A 108 LYS.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.37 A TRANSFORM -0.6988 0.6968 0.1615 0.1792 0.3892 -0.9036 -0.6925 -0.6025 -0.3968 53.172 35.293 35.001 199 ASP A 36 ASP.? 218 GLU B 22 GLU.? 329 ASP B 83 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 3 3 RMSD = 1.37 A TRANSFORM -0.0623 -0.9481 0.3119 -0.1328 0.3176 0.9389 -0.9892 0.0171 -0.1456 43.926 42.902 55.843 A 228 ASP A 56 ASP.? A 260 ASP B 61 ASP~? A 329 ASP B 68 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.37 A TRANSFORM -0.4351 -0.2574 0.8628 0.5571 0.6759 0.4826 -0.7074 0.6906 -0.1507 0.183 -34.390 6.122 B 99 ARG B 126 ARG~? B 101 ASP B 56 ASP.? B 132 ASP A 68 ASP~? ULMNm 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 RMSD = 1.37 A TRANSFORM -0.7245 -0.6244 -0.2920 0.3002 -0.6672 0.6818 -0.6205 0.4062 0.6708 -0.607 8.067 -2.000 D 14 ARG B 159 ARG.? D 161 ASP B 112 ASP^? D 174 TYR B 114 TYR^? ULMNm 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 RMSD = 1.38 A TRANSFORM -0.6124 -0.4884 -0.6216 0.7068 -0.6904 -0.1540 -0.3540 -0.5337 0.7681 56.099 26.480 29.629 A 68 ASP A 68 ASP~? A 74 ASP B 121 ASP~? A 98 GLU A 72 GLU~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 10 3 RMSD = 1.38 A TRANSFORM 0.3246 0.0394 -0.9450 -0.5727 -0.7870 -0.2295 -0.7527 0.6157 -0.2329 -1.859 94.333 56.766 C 130 SER A 82 SER~? C 166 PHE A 41 PHE^? C 182 PHE A 29 PHE^? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.38 A TRANSFORM 0.4109 0.2689 -0.8711 -0.6506 -0.5828 -0.4868 -0.6386 0.7668 -0.0645 23.091 58.556 -0.168 A 99 ARG B 126 ARG~? A 101 ASP B 56 ASP.? A 132 ASP A 68 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 21 3 RMSD = 1.38 A TRANSFORM 0.3999 0.8989 -0.1792 0.7639 -0.2188 0.6071 0.5065 -0.3797 -0.7742 -17.180 37.625 44.489 179 ASP B 68 ASP~? 227 GLU A 33 GLU^? 289 ASP A 56 ASP.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 5 3 RMSD = 1.39 A TRANSFORM 0.3481 0.4836 -0.8031 0.7287 -0.6786 -0.0928 -0.5898 -0.5529 -0.5885 31.672 76.881 52.468 B 194 SER B 78 SER~? B 292 ASP A 58 ASP~? B 322 HIS B 35 HIS.? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 23 3 RMSD = 1.40 A TRANSFORM -0.3681 -0.2364 -0.8992 0.5661 0.7102 -0.4185 0.7376 -0.6631 -0.1276 15.801 44.047 57.977 C 130 SER B 82 SER~? C 166 PHE B 41 PHE^? C 182 PHE B 29 PHE^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 13 3 RMSD = 1.40 A TRANSFORM -0.3600 0.7729 0.5224 0.3957 -0.3806 0.8358 0.8449 0.5076 -0.1688 -22.632 24.330 56.765 A 241 ASP A 68 ASP~? A 265 GLU B 164 GLU~? A 369 ASP B 121 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 8 3 RMSD = 1.40 A TRANSFORM -0.7074 -0.6301 0.3202 0.6608 -0.7504 -0.0168 0.2508 0.1997 0.9472 51.372 85.518 -7.571 A 228 ASP A 68 ASP~? A 260 ASP A 61 ASP~? A 329 ASP B 58 ASP~? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 RMSD = 1.40 A TRANSFORM 0.1504 0.5952 0.7894 0.9809 -0.1896 -0.0439 0.1235 0.7809 -0.6123 -31.666 66.310 90.250 B 137 ARG B 126 ARG~? B 141 THR B 125 THR~? B 235 ASP B 61 ASP~? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.41 A TRANSFORM 0.7058 -0.6491 0.2839 0.2724 0.6186 0.7370 -0.6540 -0.4428 0.6134 17.556 -27.288 32.418 A 317 GLU A 72 GLU~? A 319 ASP A 68 ASP~? A 359 ARG B 126 ARG~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 25 3 RMSD = 1.41 A TRANSFORM 0.5188 -0.2011 0.8309 0.2885 0.9561 0.0513 -0.8047 0.2131 0.5541 14.522 59.836 44.201 229 ASP B 68 ASP~? 264 GLU A 52 GLU.? 328 ASP A 56 ASP.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 20 3 RMSD = 1.42 A TRANSFORM 0.6959 0.5281 0.4867 -0.6694 0.2315 0.7059 0.2601 -0.8171 0.5146 13.124 27.052 7.617 199 ASP B 68 ASP~? 242 GLU B 11 GLU~? 329 ASP A 58 ASP~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 5 3 RMSD = 1.42 A TRANSFORM -0.1804 -0.5382 -0.8233 -0.5524 0.7480 -0.3679 0.8138 0.3884 -0.4323 63.347 29.491 25.798 A 194 SER B 78 SER~? A 292 ASP A 58 ASP~? A 322 HIS B 35 HIS.? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.42 A TRANSFORM -0.6755 0.7180 0.1679 -0.2270 -0.4192 0.8791 0.7016 0.5556 0.4461 12.892 2.578 -11.155 A 317 GLU B 72 GLU~? A 319 ASP B 68 ASP~? A 359 ARG A 126 ARG~? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.42 A TRANSFORM -0.0466 -0.4164 0.9080 -0.9863 0.1632 0.0242 -0.1583 -0.8944 -0.4183 -7.895 91.100 129.813 B 137 ARG A 126 ARG~? B 141 THR A 125 THR~? B 235 ASP A 61 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 32 3 RMSD = 1.43 A TRANSFORM 0.4171 -0.6394 0.6459 -0.3092 0.5685 0.7624 -0.8547 -0.5177 0.0394 -6.367 16.220 106.022 A 241 ASP B 68 ASP~? A 265 GLU A 164 GLU~? A 369 ASP A 121 ASP~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 12 3 RMSD = 1.44 A TRANSFORM -0.3758 0.1317 -0.9173 -0.0293 0.9877 0.1538 0.9263 0.0847 -0.3673 64.948 -47.474 -26.154 B 37 ASP B 112 ASP^? B 56 ILE B 5 ILE~? B 82 TYR B 9 TYR~? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 RMSD = 1.45 A TRANSFORM 0.6237 -0.7570 0.1947 0.1859 -0.0982 -0.9776 0.7592 0.6460 0.0795 21.196 125.094 -13.601 193 ASP B 68 ASP~? 219 GLU B 72 GLU~? 294 ASP A 121 ASP~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 12 3 RMSD = 1.45 A TRANSFORM -0.3803 0.1370 -0.9147 0.0016 0.9891 0.1475 0.9249 0.0547 -0.3763 61.891 -30.909 2.364 A 37 ASP B 112 ASP^? A 56 ILE B 5 ILE~? A 82 TYR B 9 TYR~? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.45 A TRANSFORM -0.6231 0.7802 0.0542 -0.2542 -0.1365 -0.9575 -0.7396 -0.6104 0.2834 10.654 133.347 37.658 193 ASP A 68 ASP~? 219 GLU A 72 GLU~? 294 ASP B 121 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 RMSD = 1.45 A TRANSFORM -0.6596 0.7502 -0.0453 0.7304 0.6257 -0.2739 -0.1771 -0.2138 -0.9607 -4.363 35.285 44.739 179 ASP A 83 ASP~? 227 GLU B 90 GLU~? 289 ASP B 36 ASP.? ULMNm 3 3hde_o00 LYSOZYME user 8 3 RMSD = 1.46 A TRANSFORM -0.5987 -0.2827 -0.7494 -0.5416 -0.5463 0.6388 -0.5901 0.7884 0.1740 28.395 -19.232 -28.016 A 35 GLU B 76 GLU~? A 44 ASP A 121 ASP~? A 50 THR A 122 THR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 24 3 RMSD = 1.46 A TRANSFORM 0.7434 0.6652 0.0701 -0.6381 0.7367 -0.2240 -0.2006 0.1218 0.9721 24.440 27.731 -10.441 199 ASP B 56 ASP.? 218 GLU A 26 GLU^? 329 ASP A 68 ASP~? ULMNm 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 RMSD = 1.46 A TRANSFORM 0.4075 0.2965 -0.8637 0.8143 0.3100 0.4907 0.4132 -0.9033 -0.1151 22.502 -16.674 55.298 B 325 ASP A 34 ASP.? B 354 GLU A 33 GLU^? B 421 ASP B 83 ASP~? ULMNm 3 1bgl_c08 BETA-GALACTOSIDASE user 5 3 RMSD = 1.46 A TRANSFORM 0.5695 -0.0515 0.8204 0.7654 0.3971 -0.5064 -0.2997 0.9163 0.2655 2.976 128.155 -33.823 A 461 GLU B 149 GLU~? A 503 TYR B 160 TYR~? A 537 GLU B 153 GLU~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.46 A TRANSFORM -0.7284 -0.6281 0.2736 0.6276 -0.7719 -0.1012 0.2748 0.0980 0.9565 75.872 37.674 -18.016 199 ASP A 56 ASP.? 218 GLU B 26 GLU^? 329 ASP B 68 ASP~? ULMNm 3 3hde_o00 LYSOZYME user 4 3 RMSD = 1.46 A TRANSFORM 0.5220 0.0860 -0.8486 0.5929 0.6786 0.4335 0.6131 -0.7295 0.3033 2.226 -63.232 -16.860 A 35 GLU A 76 GLU~? A 44 ASP B 121 ASP~? A 50 THR B 122 THR~? ULMNm 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 RMSD = 1.47 A TRANSFORM -0.4274 -0.3492 0.8339 -0.9038 0.1879 -0.3845 -0.0224 -0.9180 -0.3960 35.853 70.166 77.913 A 325 ASP A 34 ASP.? A 354 GLU A 33 GLU^? A 421 ASP B 83 ASP~? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.47 A TRANSFORM 0.1847 0.8767 -0.4441 0.9724 -0.0976 0.2119 0.1425 -0.4710 -0.8706 -70.396 -42.552 -0.597 A 114 HIS A 44 HIS^? A 197 ASP A 56 ASP.? A 223 ALA A 31 ALA^? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 10 3 RMSD = 1.47 A TRANSFORM -0.4632 0.2200 0.8585 0.7104 -0.4869 0.5081 0.5298 0.8453 0.0693 -4.471 31.022 -30.547 A 10 ASP B 121 ASP~? A 186 ASN B 118 ASN.? A 260 ALA B 128 ALA~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 28 3 RMSD = 1.47 A TRANSFORM -0.7579 0.5381 0.3687 -0.5500 -0.8311 0.0825 0.3508 -0.1403 0.9259 8.893 59.964 50.525 A 241 ASP B 68 ASP~? A 279 GLU B 11 GLU~? A 369 ASP A 58 ASP~? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 5 3 RMSD = 1.47 A TRANSFORM 0.5561 -0.0201 0.8308 -0.6526 0.6085 0.4515 -0.5146 -0.7933 0.3253 -16.421 30.944 20.452 A 10 ASP A 121 ASP~? A 186 ASN A 118 ASN.? A 260 ALA A 128 ALA~? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 5 3 RMSD = 1.47 A TRANSFORM 0.6543 -0.3193 -0.6855 0.5848 -0.3612 0.7263 -0.4796 -0.8761 -0.0496 102.079 82.617 135.165 A 451 GLU B 149 GLU~? A 504 TYR B 160 TYR~? A 540 GLU B 153 GLU~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 26 3 RMSD = 1.47 A TRANSFORM 0.7011 0.6703 0.2430 -0.4251 0.6667 -0.6122 -0.5724 0.3259 0.7524 20.855 36.568 -6.884 199 ASP B 56 ASP.? 218 GLU A 52 GLU.? 329 ASP A 68 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 14 3 RMSD = 1.47 A TRANSFORM 0.7544 -0.6487 -0.1002 -0.5395 -0.6997 0.4684 -0.3740 -0.2993 -0.8778 57.996 65.791 35.769 199 ASP B 36 ASP.? 242 GLU B 153 GLU~? 329 ASP A 83 ASP~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.47 A TRANSFORM -0.1864 -0.8829 0.4310 -0.9824 0.1726 -0.0712 -0.0115 -0.4367 -0.8995 -23.007 35.513 5.367 B 114 HIS A 44 HIS^? B 197 ASP A 56 ASP.? B 223 ALA A 31 ALA^? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 10 3 RMSD = 1.48 A TRANSFORM 0.7967 -0.4287 0.4261 0.5308 0.8333 -0.1541 -0.2890 0.3489 0.8915 2.438 7.389 51.265 A 241 ASP A 68 ASP~? A 279 GLU A 11 GLU~? A 369 ASP B 58 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 RMSD = 1.48 A TRANSFORM -0.6457 -0.4069 0.6461 0.7232 -0.0545 0.6885 -0.2449 0.9119 0.3295 55.089 9.333 -19.449 199 ASP A 68 ASP~? 242 GLU A 11 GLU~? 329 ASP B 58 ASP~? ULMNm 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 2 3 RMSD = 1.48 A TRANSFORM -0.9900 -0.1245 -0.0664 -0.1049 0.9642 -0.2436 0.0943 -0.2343 -0.9676 29.898 -20.603 33.119 A 78 GLN B 130 GLN~? A 79 PHE B 134 PHE~? A 80 THR B 136 THR.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 RMSD = 1.48 A TRANSFORM -0.6814 -0.5868 0.4374 0.3794 -0.7943 -0.4745 0.6259 -0.1574 0.7639 70.041 53.430 -17.066 199 ASP A 56 ASP.? 218 GLU B 52 GLU.? 329 ASP B 68 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 33 3 RMSD = 1.48 A TRANSFORM 0.7716 0.4408 0.4586 -0.6253 0.3930 0.6742 0.1170 -0.8070 0.5789 -7.791 32.818 88.195 A 241 ASP B 83 ASP~? A 265 GLU A 90 GLU~? A 369 ASP A 36 ASP.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 RMSD = 1.48 A TRANSFORM -0.2033 -0.9521 -0.2285 -0.9555 0.1420 0.2585 -0.2136 0.2709 -0.9386 -25.897 -15.100 -10.091 A 114 HIS B 44 HIS^? A 197 ASP B 56 ASP.? A 223 ALA B 31 ALA^? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 RMSD = 1.49 A TRANSFORM 0.2039 0.9552 0.2144 0.9771 -0.1847 -0.1060 -0.0616 0.2311 -0.9710 -67.736 9.988 -7.735 B 114 HIS B 44 HIS^? B 197 ASP B 56 ASP.? B 223 ALA B 31 ALA^? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 RMSD = 1.49 A TRANSFORM 0.5942 0.0955 0.7987 -0.7640 0.3775 0.5233 -0.2515 -0.9211 0.2973 -1.862 102.961 18.207 193 ASP A 121 ASP~? 219 GLU B 72 GLU~? 294 ASP B 68 ASP~? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 RMSD = 1.49 A TRANSFORM -0.5625 0.1466 -0.8137 0.7955 -0.1724 -0.5810 -0.2255 -0.9741 -0.0196 51.948 111.302 49.758 193 ASP A 68 ASP~? 219 GLU A 69 GLU~? 294 ASP B 121 ASP~?