*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.62 A TRANSFORM 0.9008 -0.3837 -0.2033 0.2673 0.1210 0.9560 0.3422 0.9155 -0.2115 -54.741 -43.940 -33.570 G 51 ALA A 102 ALA~? G 148 HIS A 83 HIS^? G 163 ASP A 49 ASP~? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.69 A TRANSFORM 0.5594 0.6398 -0.5271 -0.6372 -0.0748 -0.7671 0.5302 -0.7649 -0.3658 -34.998 38.817 -60.920 E 51 ALA B 102 ALA.? E 148 HIS B 83 HIS^? E 163 ASP B 49 ASP~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.70 A TRANSFORM -0.5920 -0.1836 -0.7848 0.5121 0.6662 -0.5421 -0.6224 0.7228 0.3004 20.427 -18.034 74.912 B 51 ALA B 102 ALA.? B 148 HIS B 83 HIS^? B 163 ASP B 49 ASP~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.70 A TRANSFORM 0.6383 0.0654 0.7670 -0.5535 0.7315 0.3982 0.5351 0.6787 -0.5031 -73.792 20.451 38.099 B 51 ALA A 102 ALA~? B 148 HIS A 83 HIS^? B 163 ASP A 49 ASP~? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.71 A TRANSFORM -0.2853 -0.2335 -0.9295 0.8784 -0.4517 -0.1561 0.3834 0.8611 -0.3340 27.443 -40.083 38.485 D 51 ALA A 102 ALA~? D 148 HIS A 83 HIS^? D 163 ASP A 49 ASP~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.71 A TRANSFORM 0.1176 -0.7926 -0.5982 -0.9591 0.0656 -0.2755 -0.2576 -0.6061 0.7525 34.318 44.262 37.095 A 49 ASP B 49 ASP~? A 86 HIS B 83 HIS^? A 250 ALA B 102 ALA.? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.71 A TRANSFORM 0.1176 -0.7926 -0.5982 -0.9591 0.0656 -0.2755 -0.2576 -0.6061 0.7525 34.318 44.262 37.095 A 49 ASP B 49 ASP~? A 86 HIS B 83 HIS^? A 250 ALA B 102 ALA.? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.71 A TRANSFORM -0.6360 -0.0417 -0.7706 -0.5771 0.6886 0.4391 -0.5123 -0.7240 0.4620 41.081 20.305 38.693 A 51 ALA A 102 ALA~? A 148 HIS A 83 HIS^? A 163 ASP A 49 ASP~? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.72 A TRANSFORM 0.2488 0.2608 0.9328 0.8840 -0.4546 -0.1088 -0.3957 -0.8517 0.3437 -59.175 -41.214 38.230 C 51 ALA A 102 ALA~? C 148 HIS A 83 HIS^? C 163 ASP A 49 ASP~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.72 A TRANSFORM -0.5561 -0.4853 -0.6747 0.7788 -0.5877 -0.2192 0.2901 0.6474 -0.7048 112.327 -50.703 -9.200 C 49 ASP B 49 ASP~? C 86 HIS B 83 HIS^? C 250 ALA B 102 ALA.? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.75 A TRANSFORM 0.5458 0.6239 -0.5593 0.6646 0.0842 0.7424 -0.5103 0.7770 0.3687 -33.477 -40.836 -2.847 F 51 ALA B 102 ALA.? F 148 HIS B 83 HIS^? F 163 ASP B 49 ASP~? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.76 A TRANSFORM 0.5853 0.2103 0.7831 0.5382 0.6217 -0.5691 0.6065 -0.7545 -0.2507 -52.893 -18.972 2.026 A 51 ALA B 102 ALA.? A 148 HIS B 83 HIS^? A 163 ASP B 49 ASP~? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.77 A TRANSFORM -0.2110 0.0051 -0.9775 -0.8459 -0.5021 0.1799 0.4899 -0.8648 -0.1102 2.579 42.649 8.793 C 51 ALA B 102 ALA.? C 148 HIS B 83 HIS^? C 163 ASP B 49 ASP~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.77 A TRANSFORM -0.9480 0.0287 -0.3170 -0.1734 0.7885 0.5900 -0.2669 -0.6143 0.7425 106.332 -65.658 4.215 D 49 ASP B 49 ASP~? D 86 HIS B 83 HIS^? D 250 ALA B 102 ALA.? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.78 A TRANSFORM -0.5814 0.6883 0.4338 -0.7019 -0.1546 -0.6953 0.4115 0.7088 -0.5730 6.773 57.142 -24.840 F 51 ALA A 102 ALA~? F 148 HIS A 83 HIS^? F 163 ASP A 49 ASP~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.78 A TRANSFORM 0.8917 -0.4121 -0.1871 -0.2926 -0.2095 -0.9330 -0.3453 -0.8867 0.3074 -55.132 42.951 -30.779 H 51 ALA A 102 ALA~? H 148 HIS A 83 HIS^? H 163 ASP A 49 ASP~? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.80 A TRANSFORM -0.5943 0.6933 0.4077 0.6823 0.1662 0.7120 -0.4258 -0.7013 0.5718 7.925 -57.423 -36.923 E 51 ALA A 102 ALA~? E 148 HIS A 83 HIS^? E 163 ASP A 49 ASP~? ULMNm 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 0.84 A TRANSFORM -0.1364 0.8343 0.5342 -0.9615 0.0185 -0.2743 0.2388 0.5511 -0.7996 -95.337 81.772 26.771 F 49 ASP B 49 ASP~? F 86 HIS B 83 HIS^? F 250 ALA B 102 ALA.? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.84 A TRANSFORM 0.2447 0.0249 0.9693 -0.8421 -0.4900 0.2251 -0.4806 0.8714 0.0989 -37.781 41.354 67.288 D 51 ALA B 102 ALA.? D 148 HIS B 83 HIS^? D 163 ASP B 49 ASP~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.87 A TRANSFORM -0.7671 0.6207 0.1620 -0.5553 -0.5160 -0.6523 0.3213 0.5903 -0.7405 16.055 51.833 25.532 B 49 ASP B 49 ASP~? B 86 HIS B 83 HIS^? B 250 ALA B 102 ALA.? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.88 A TRANSFORM -0.8658 -0.4354 0.2467 0.2505 0.0497 0.9668 0.4332 -0.8989 -0.0660 26.715 -23.128 -56.102 H 51 ALA B 102 ALA.? H 148 HIS B 83 HIS^? H 163 ASP B 49 ASP~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 0.90 A TRANSFORM 0.7479 -0.6437 -0.1622 -0.5675 -0.4934 -0.6591 -0.3442 -0.5850 0.7343 -76.241 85.652 36.811 E 49 ASP B 49 ASP~? E 86 HIS B 83 HIS^? E 250 ALA B 102 ALA.? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 0.90 A TRANSFORM -0.8746 -0.4134 0.2534 -0.2135 -0.1408 -0.9667 -0.4353 0.8996 -0.0348 27.409 20.064 -4.107 G 51 ALA B 102 ALA.? G 148 HIS B 83 HIS^? G 163 ASP B 49 ASP~? ULMNm 3 1uk7_c00 3.07.01.0009 user 2 3 RMSD = 1.01 A TRANSFORM 0.4876 0.6931 -0.5309 0.7197 0.0252 0.6939 -0.4943 0.7204 0.4865 -26.729 -15.666 5.793 A 103 ALA B 102 ALA.? A 224 ASP B 49 ASP~? A 252 HIS B 83 HIS^? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 RMSD = 1.02 A TRANSFORM -0.9654 0.1093 0.2367 -0.1363 -0.9855 -0.1012 -0.2222 0.1300 -0.9663 71.578 34.121 33.744 A 105 ALA B 102 ALA.? A 244 ASP B 49 ASP~? A 271 HIS B 83 HIS^? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.04 A TRANSFORM 0.6091 -0.2242 0.7608 -0.7180 -0.5634 0.4087 -0.3370 0.7952 0.5042 21.043 7.132 1.428 C 49 ASP A 49 ASP~? C 86 HIS A 83 HIS^? C 250 ALA A 102 ALA~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.04 A TRANSFORM 0.9449 0.1978 0.2610 0.0990 0.5874 -0.8032 0.3122 -0.7848 -0.5354 -0.120 -44.789 -2.269 D 49 ASP A 49 ASP~? D 86 HIS A 83 HIS^? D 250 ALA A 102 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.06 A TRANSFORM -0.0436 -0.5885 0.8074 0.9524 0.2197 0.2116 0.3019 -0.7781 -0.5508 7.644 -60.954 32.157 A 49 ASP A 49 ASP~? A 86 HIS A 83 HIS^? A 250 ALA A 102 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.06 A TRANSFORM -0.0436 -0.5885 0.8074 0.9524 0.2197 0.2116 0.3019 -0.7781 -0.5508 7.644 -60.954 32.157 A 49 ASP A 49 ASP~? A 86 HIS A 83 HIS^? A 250 ALA A 102 ALA~? ULMNm 3 1qrz_c20 PLASMINOGEN user 7 3 RMSD = 1.09 A TRANSFORM 0.6655 -0.0086 -0.7463 -0.5687 -0.6534 -0.4996 0.4834 -0.7569 0.4397 -30.160 54.850 11.615 A 603 HIS B 66 HIS^? A 646 ASP B 69 ASP.? A 739 GLY B 130 GLY.? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.10 A TRANSFORM 0.7058 0.6074 -0.3645 0.6081 -0.2555 0.7516 -0.3634 0.7521 0.5497 -42.405 -39.008 36.925 B 49 ASP A 49 ASP~? B 86 HIS A 83 HIS^? B 250 ALA A 102 ALA~? ULMNm 3 1qrz_c22 PLASMINOGEN user 7 3 RMSD = 1.10 A TRANSFORM -0.2610 0.7212 -0.6417 0.5871 0.6463 0.4875 -0.7663 0.2495 0.5921 20.208 -61.493 23.077 C 603 HIS B 66 HIS^? C 646 ASP B 69 ASP.? C 739 GLY B 130 GLY.? ULMNm 3 1qrz_c21 PLASMINOGEN user 7 3 RMSD = 1.11 A TRANSFORM 0.6273 -0.0292 -0.7782 -0.6263 -0.6127 -0.4819 0.4628 -0.7898 0.4027 -54.746 56.307 -24.063 B 603 HIS B 66 HIS^? B 646 ASP B 69 ASP.? B 739 GLY B 130 GLY.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.12 A TRANSFORM 0.3446 0.4508 -0.8234 -0.8619 0.4995 -0.0872 -0.3720 -0.7398 -0.5607 21.876 53.995 50.131 A 57 HIS A 83 HIS^? A 102 ASP A 49 ASP~? A 193 GLY A 86 GLY.? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.12 A TRANSFORM -0.0066 0.7719 0.6357 -0.7683 0.4030 -0.4973 0.6400 0.4917 -0.5904 -19.640 29.070 -25.355 C 603 HIS A 66 HIS^? C 646 ASP A 69 ASP.? C 739 GLY A 130 GLY.? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 1.13 A TRANSFORM -0.6290 -0.2295 0.7428 0.7534 -0.4157 0.5095 -0.1919 -0.8801 -0.4343 6.059 -34.489 64.927 A 603 HIS A 66 HIS^? A 646 ASP A 69 ASP.? A 739 GLY A 130 GLY.? ULMNm 3 1qrz_c23 PLASMINOGEN user 7 3 RMSD = 1.13 A TRANSFORM -0.2197 0.7489 -0.6253 0.6213 0.6015 0.5021 -0.7521 0.2782 0.5974 -36.781 -62.446 59.970 D 603 HIS B 66 HIS^? D 646 ASP B 69 ASP.? D 739 GLY B 130 GLY.? ULMNm 3 1qrz_c21 PLASMINOGEN user 2 3 RMSD = 1.14 A TRANSFORM -0.5863 -0.2355 0.7751 0.7938 -0.3579 0.4918 -0.1616 -0.9036 -0.3968 -24.044 -37.389 25.068 B 603 HIS A 66 HIS^? B 646 ASP A 69 ASP.? B 739 GLY A 130 GLY.? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 4 3 RMSD = 1.14 A TRANSFORM 0.4570 0.6216 -0.6363 -0.0507 -0.6960 -0.7163 0.8880 -0.3596 0.2865 -43.511 64.843 -18.843 A1132 ASP B 69 ASP.? A1134 ALA A 131 ALA.? A1137 ASN A 127 ASN.? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 RMSD = 1.15 A TRANSFORM -0.5196 -0.8011 0.2970 0.0583 -0.3800 -0.9231 -0.8524 0.4624 -0.2441 32.811 37.507 53.979 30 GLY A 86 GLY.? 48 HIS A 83 HIS^? 99 ASP A 49 ASP~? ULMNm 3 1qrz_c23 PLASMINOGEN user 2 3 RMSD = 1.15 A TRANSFORM -0.0549 0.7837 0.6187 -0.7851 0.3490 -0.5116 0.6169 0.5139 -0.5962 -71.295 31.377 13.693 D 603 HIS A 66 HIS^? D 646 ASP A 69 ASP.? D 739 GLY A 130 GLY.? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.17 A TRANSFORM -0.6951 -0.6148 0.3726 0.6029 -0.2162 0.7680 0.3916 -0.7584 -0.5210 -19.919 -6.330 22.381 E 49 ASP A 49 ASP~? E 86 HIS A 83 HIS^? E 250 ALA A 102 ALA~? ULMNm 3 1uk7_c00 3.07.01.0009 user 1 3 RMSD = 1.21 A TRANSFORM -0.5304 0.7671 0.3609 -0.7433 -0.2162 -0.6330 0.4075 0.6040 -0.6849 10.515 84.718 -10.481 A 103 ALA A 102 ALA~? A 224 ASP A 49 ASP~? A 252 HIS A 83 HIS^? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 RMSD = 1.22 A TRANSFORM -0.3918 0.5822 0.7124 -0.6242 0.4006 -0.6707 0.6759 0.7075 -0.2065 14.631 38.053 22.808 A 14 ASP B 49 ASP~? A 16 HIS B 83 HIS^? A 67 GLY B 45 GLY.? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 RMSD = 1.22 A TRANSFORM -0.2444 0.7151 0.6549 0.6241 -0.4009 0.6707 -0.7422 -0.5726 0.3483 2.365 -6.827 142.458 C 14 ASP B 49 ASP~? C 16 HIS B 83 HIS^? C 67 GLY B 45 GLY.? ULMNm 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 RMSD = 1.23 A TRANSFORM -0.2044 0.8413 -0.5005 0.9021 -0.0366 -0.4299 0.3800 0.5394 0.7515 38.154 -34.496 65.961 B1082 HIS A 66 HIS^? B1168 ARG A 113 ARG^? B1187 LYS A 135 LYS^? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.24 A TRANSFORM 0.9305 0.1409 -0.3383 0.2509 -0.9177 0.3080 0.2671 0.3714 0.8892 -10.991 0.344 -27.107 A 105 ALA A 102 ALA~? A 244 ASP A 49 ASP~? A 271 HIS A 83 HIS^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.27 A TRANSFORM 0.2053 0.8717 0.4449 0.4149 0.3342 -0.8463 0.8864 -0.3584 0.2930 -1.057 18.568 -40.161 A 229 ALA B 132 ALA^? A 257 ALA B 131 ALA.? A 328 ASP A 69 ASP.? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 RMSD = 1.28 A TRANSFORM -0.0240 0.7782 -0.6275 -0.3818 -0.5873 -0.7137 0.9239 -0.2224 -0.3113 16.625 74.052 69.107 C 14 ASP A 49 ASP~? C 16 HIS A 83 HIS^? C 67 GLY A 45 GLY.? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 RMSD = 1.29 A TRANSFORM 0.1666 0.7155 -0.6784 0.3824 0.5873 0.7133 -0.9088 0.3783 0.1758 13.509 -42.854 97.491 A 14 ASP A 49 ASP~? A 16 HIS A 83 HIS^? A 67 GLY A 45 GLY.? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 2 3 RMSD = 1.33 A TRANSFORM -0.5772 0.3786 0.7235 0.2983 -0.7270 0.6184 -0.7602 -0.5728 -0.3067 -17.227 21.287 77.435 A1132 ASP A 69 ASP.? A1134 ALA B 131 ALA.? A1137 ASN B 127 ASN.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 RMSD = 1.34 A TRANSFORM -0.3599 -0.1898 -0.9135 0.9082 -0.2954 -0.2964 0.2136 0.9363 -0.2787 42.826 -23.468 -52.269 A 49 ASP A 69 ASP.? A 147 THR A 67 THR.? A 294 ASP A 19 ASP~? ULMNm 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 RMSD = 1.35 A TRANSFORM -0.0511 0.8624 0.5036 -0.7898 -0.3435 0.5082 -0.6113 0.3718 -0.6987 9.642 33.364 147.242 B1082 HIS B 66 HIS^? B1168 ARG B 113 ARG^? B1187 LYS B 135 LYS^? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 5 3 RMSD = 1.35 A TRANSFORM 0.3347 0.9396 0.0715 0.1389 0.0258 -0.9900 0.9320 -0.3413 0.1219 -37.150 22.339 -38.444 A 101 VAL B 124 VAL.? A 102 PHE B 125 PHE.? A 169 CYH B 40 CYH^? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 RMSD = 1.36 A TRANSFORM -0.8158 -0.5750 -0.0622 0.4108 -0.5004 -0.7621 -0.4071 0.6473 -0.6444 46.940 18.261 19.360 A 14 GLU A 73 GLU^? A 61 GLU A 18 GLU~? A 162 HIS B 99 HIS^? ULMNm 3 3nwu_o00 SERINE PROTEASE HTRA1 user 2 3 RMSD = 1.37 A TRANSFORM -0.2302 -0.6706 0.7052 0.5430 0.5128 0.6650 0.8075 -0.5360 -0.2461 -16.156 -12.077 -51.224 A 220 HIS B 83 HIS^? A 250 ASP B 49 ASP~? A 328 SER B 104 SER.? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 RMSD = 1.37 A TRANSFORM -0.6646 0.7398 -0.1044 -0.2240 -0.0640 0.9725 -0.7128 -0.6697 -0.2083 18.122 0.438 54.506 A 101 VAL A 124 VAL.? A 102 PHE A 125 PHE.? A 169 CYH A 40 CYH^? ULMNm 3 1qx3_c00 APOPAIN user 1 3 RMSD = 1.38 A TRANSFORM -0.9399 0.3416 -0.0012 -0.3043 -0.8357 0.4573 -0.1552 -0.4301 -0.8893 25.472 50.157 40.302 A 121 HIS A 107 HIS^? A 122 GLY A 45 GLY.? A 163 CYH A 105 CYH~? ULMNm 3 1qx3_c00 APOPAIN user 2 3 RMSD = 1.38 A TRANSFORM 0.7480 0.6613 -0.0566 0.5401 -0.6560 -0.5273 0.3858 -0.3638 0.8478 -61.063 26.660 -23.564 A 121 HIS B 107 HIS^? A 122 GLY B 45 GLY.? A 163 CYH B 105 CYH.? ULMNm 3 3nwu_o01 SERINE PROTEASE HTRA1 user 2 3 RMSD = 1.39 A TRANSFORM -0.7452 0.5614 0.3597 -0.1550 -0.6706 0.7254 -0.6485 -0.4849 -0.5868 -25.110 74.865 42.576 B 220 HIS B 83 HIS^? B 250 ASP B 49 ASP~? B 328 SER B 104 SER.? ULMNm 3 2dbt_c00 CHITINASE C user 1 3 RMSD = 1.40 A TRANSFORM -0.8581 -0.2667 0.4387 0.3129 0.4057 0.8588 0.4070 -0.8742 0.2647 108.779 -10.394 -16.033 A 147 GLU A 60 GLU.? A 156 GLU A 73 GLU^? A 194 ASN B 94 ASN.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 1 3 RMSD = 1.40 A TRANSFORM 0.1668 -0.6793 -0.7147 -0.6696 0.4541 -0.5878 -0.7238 -0.5766 0.3791 49.968 120.655 82.907 A 228 ASP B 46 ASP.? A 260 ASP A 69 ASP.? A 329 ASP B 49 ASP~? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.40 A TRANSFORM -0.7082 -0.3467 0.6150 -0.4395 0.8983 0.0003 0.5525 0.2701 0.7885 77.292 126.489 103.765 C 141 GLY A 59 GLY.? C 144 GLU A 77 GLU.? C 164 GLU A 60 GLU.? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.40 A TRANSFORM 0.8090 0.3728 -0.4544 0.4118 -0.9112 -0.0143 0.4194 0.1756 0.8907 59.029 60.020 104.762 D 141 GLY A 59 GLY.? D 144 GLU A 77 GLU.? D 164 GLU A 60 GLU.? ULMNm 3 3nwu_o02 SERINE PROTEASE HTRA1 user 2 3 RMSD = 1.40 A TRANSFORM 0.5642 0.4364 0.7009 -0.8065 0.4729 0.3549 0.1766 0.7655 -0.6188 -107.106 77.922 -55.183 C 220 HIS B 83 HIS^? C 250 ASP B 49 ASP~? C 328 SER B 104 SER.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.41 A TRANSFORM 0.7454 -0.6184 -0.2488 -0.2414 0.0975 -0.9655 -0.6214 -0.7798 0.0766 8.967 39.623 90.400 A 316 ALA A 21 ALA~? A 317 GLY A 22 GLY~? A 318 ASP A 19 ASP~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 RMSD = 1.41 A TRANSFORM 0.9416 -0.2902 0.1707 -0.3197 -0.6118 0.7235 0.1055 0.7359 0.6689 -50.140 25.269 -34.726 A 14 GLU B 73 GLU^? A 61 GLU B 18 GLU~? A 162 HIS A 99 HIS^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.41 A TRANSFORM -0.8138 0.0764 -0.5760 -0.0903 -0.9959 -0.0045 0.5740 -0.0484 -0.8174 131.929 81.207 156.155 E 141 GLY A 59 GLY.? E 144 GLU A 77 GLU.? E 164 GLU A 60 GLU.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.42 A TRANSFORM -0.5149 -0.8250 0.2328 0.2787 0.0957 0.9556 0.8107 -0.5569 -0.1807 64.739 -25.317 22.908 A 316 ALA B 21 ALA~? A 317 GLY B 22 GLY~? A 318 ASP B 19 ASP~? ULMNm 3 3nwu_o00 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.43 A TRANSFORM 0.5753 -0.4611 -0.6755 -0.6564 0.2324 -0.7177 -0.4880 -0.8564 0.1690 -28.808 79.153 9.890 A 220 HIS A 83 HIS^? A 250 ASP A 49 ASP~? A 328 SER A 104 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 RMSD = 1.43 A TRANSFORM -0.3196 -0.8799 0.3516 0.1641 -0.4168 -0.8941 -0.9332 0.2281 -0.2776 68.053 49.783 59.259 A 229 ALA B 131 ALA.? A 257 ALA B 132 ALA^? A 328 ASP A 69 ASP.? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.43 A TRANSFORM 0.4141 -0.7410 0.5286 -0.7839 -0.5855 -0.2066 -0.4625 0.3288 0.8234 -40.897 37.185 25.728 A 603 HIS A 83 HIS^? A 646 ASP A 53 ASP~? A 739 GLY A 98 GLY^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.43 A TRANSFORM 0.6740 -0.6494 -0.3521 -0.0067 -0.4820 0.8762 0.7387 0.5882 0.3292 30.535 22.664 -41.585 A 229 ALA A 131 ALA.? A 257 ALA A 132 ALA^? A 328 ASP B 69 ASP.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.44 A TRANSFORM 0.5084 0.8353 0.2094 0.2918 -0.3958 0.8707 -0.8102 0.3815 0.4450 -10.297 -15.135 51.944 B 1 ALA B 132 ALA^? B 74 ASN B 127 ASN.? B 75 GLY B 130 GLY.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.45 A TRANSFORM -0.8575 -0.5125 -0.0463 -0.4554 0.7977 -0.3954 -0.2395 0.3179 0.9174 115.044 8.192 -4.006 A 37 ASP A 19 ASP~? A 56 ILE A 71 ILE^? A 82 TYR B 87 TYR^? ULMNm 3 2dbt_c01 CHITINASE C user 1 3 RMSD = 1.45 A TRANSFORM 0.6470 0.5816 -0.4931 0.1394 0.5455 0.8264 -0.7496 0.6034 -0.2719 22.483 45.947 57.693 B 147 GLU A 60 GLU.? B 156 GLU A 73 GLU^? B 194 ASN B 94 ASN.? ULMNm 3 3nwu_o01 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.45 A TRANSFORM 0.4314 0.8548 -0.2884 0.5105 -0.4948 -0.7032 0.7438 -0.1561 0.6499 -75.141 70.623 -55.895 B 220 HIS A 83 HIS^? B 250 ASP A 49 ASP~? B 328 SER A 104 SER~? ULMNm 3 2dbt_c02 CHITINASE C user 1 3 RMSD = 1.46 A TRANSFORM 0.9590 -0.0889 -0.2690 -0.2622 -0.6384 -0.7237 0.1074 -0.7645 0.6356 -1.106 50.896 -1.974 C 147 GLU A 60 GLU.? C 156 GLU A 73 GLU^? C 194 ASN B 94 ASN.? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.46 A TRANSFORM -0.2255 0.9606 -0.1626 0.9638 0.1956 -0.1809 0.1420 0.1975 0.9700 -4.736 11.656 86.267 A 1 ALA B 132 ALA^? A 74 ASN B 127 ASN.? A 75 GLY B 130 GLY.? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.46 A TRANSFORM -0.1216 0.6650 0.7369 -0.0799 -0.7465 0.6605 -0.9894 -0.0215 -0.1439 18.937 36.308 92.081 A 194 SER A 65 SER^? A 292 ASP A 14 ASP.? A 322 HIS A 99 HIS^? ULMNm 3 1qrz_c14 PLASMINOGEN user 1 3 RMSD = 1.47 A TRANSFORM 0.0476 0.3694 0.9280 -0.9508 -0.2678 0.1554 -0.3060 0.8898 -0.3385 -19.469 42.102 13.459 C 603 HIS A 66 HIS^? C 646 ASP A 69 ASP.? C 741 SER A 65 SER^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.47 A TRANSFORM -0.8554 -0.5162 -0.0423 -0.4528 0.7851 -0.4227 -0.2514 0.3424 0.9053 117.856 -7.906 -31.411 B 37 ASP A 19 ASP~? B 56 ILE A 71 ILE^? B 82 TYR B 87 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.47 A TRANSFORM -0.0481 0.9985 0.0266 0.9638 0.0394 0.2638 -0.2623 -0.0384 0.9642 -1.001 -23.768 -37.462 A 465 GLY A 98 GLY^? A 501 ASP A 46 ASP.? B 367 TYR B 24 TYR~? ULMNm 3 3nwu_o02 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.47 A TRANSFORM -0.6369 0.1566 -0.7548 0.5259 0.8042 -0.2769 -0.5637 0.5733 0.5946 -14.121 19.480 -42.703 C 220 HIS A 83 HIS^? C 250 ASP A 49 ASP~? C 328 SER A 104 SER~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.48 A TRANSFORM -0.7920 0.5928 -0.1461 -0.5605 -0.8008 -0.2110 0.2421 0.0853 -0.9665 55.930 95.884 -28.013 D 465 GLY A 98 GLY^? D 501 ASP A 46 ASP.? E 367 TYR B 24 TYR~? ULMNm 3 1vom_c00 MYOSIN user 4 3 RMSD = 1.48 A TRANSFORM 0.6790 0.7246 -0.1180 -0.5802 0.4311 -0.6910 0.4499 -0.5376 -0.7132 23.633 90.971 -39.111 233 ASN B 94 ASN.? 457 GLY B 59 GLY.? 459 GLU B 60 GLU^? ULMNm 3 1qrz_c13 PLASMINOGEN user 1 3 RMSD = 1.48 A TRANSFORM 0.3003 -0.7195 0.6263 0.9490 0.2913 -0.1204 0.0958 -0.6305 -0.7703 -59.696 -49.148 11.992 B 603 HIS A 66 HIS^? B 646 ASP A 69 ASP.? B 741 SER A 65 SER^? ULMNm 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 1 3 RMSD = 1.49 A TRANSFORM -0.3003 0.9284 0.2191 -0.4786 0.0520 -0.8765 0.8251 0.3680 -0.4287 -20.497 65.413 7.837 A 317 HIS A 107 HIS^? A 318 GLY A 45 GLY.? A 360 CYH A 105 CYH~? ULMNm 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 2 3 RMSD = 1.50 A TRANSFORM -0.2073 -0.1516 0.9665 0.8095 0.5281 0.2565 0.5493 -0.8355 -0.0132 11.545 -54.972 -3.762 232 HIS B 66 HIS^? 254 LYS B 135 LYS^? 333 ARG B 113 ARG^? ULMNm 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 1 3 RMSD = 1.50 A TRANSFORM 0.3318 -0.0514 -0.9420 -0.9146 0.2272 -0.3345 -0.2312 -0.9725 -0.0284 23.363 46.123 37.079 232 HIS A 66 HIS^? 254 LYS A 135 LYS^? 333 ARG A 113 ARG^? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.50 A TRANSFORM -0.8857 -0.1647 0.4340 -0.3586 0.8366 -0.4142 0.2949 0.5225 0.8000 74.353 83.204 -14.418 B 194 SER A 65 SER^? B 292 ASP A 14 ASP.? B 322 HIS A 99 HIS^?