*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2odj_o00 PORIN D user 12 3 RMSD = 0.81 A TRANSFORM -0.0813 0.5578 0.8260 -0.9691 0.1495 -0.1963 0.2330 0.8164 -0.5284 -36.625 77.855 23.794 A 156 HIS B 28 HIS~? A 208 ASP B 35 ASP.? A 296 SER B 118 SER~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 1 3 RMSD = 0.83 A TRANSFORM -0.1684 -0.0099 -0.9857 -0.6600 -0.7416 0.1202 0.7322 -0.6707 -0.1184 90.119 48.946 26.776 A 44 HIS A 4 HIS^? A 45 HIS B 139 HIS~? A 261 PHE B 116 PHE~? ULMNm 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 7 3 RMSD = 0.83 A TRANSFORM 0.8252 -0.5353 0.1802 0.5588 0.8202 -0.1222 0.0823 -0.2015 -0.9760 -38.297 -30.324 81.097 A 197 ARG A 201 ARG^? A 201 HIS B 143 HIS.? A 204 HIS B 139 HIS~? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 6 3 RMSD = 0.85 A TRANSFORM 0.5308 -0.8216 0.2081 0.8401 0.5424 -0.0016 0.1115 -0.1757 -0.9781 -22.120 89.214 29.662 A 197 ARG A 201 ARG^? A 201 HIS B 143 HIS.? A 204 HIS B 139 HIS~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 0.88 A TRANSFORM 0.8711 0.4103 -0.2700 -0.1670 -0.2695 -0.9484 0.4619 -0.8712 0.1662 -23.897 102.089 77.066 A 241 ASP B 35 ASP.? A 279 GLU A 7 GLU^? A 369 ASP A 35 ASP.? ULMNm 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 15 3 RMSD = 0.89 A TRANSFORM -0.5750 0.7774 -0.2550 0.8177 0.5355 -0.2114 0.0278 0.3301 0.9435 13.068 -31.169 -36.332 A 197 ARG B 201 ARG^? A 201 HIS A 143 HIS~? A 204 HIS A 139 HIS~? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 8 3 RMSD = 0.89 A TRANSFORM 0.0931 0.9828 -0.1595 -0.9906 0.0754 -0.1140 0.1001 -0.1687 -0.9806 -9.767 48.171 56.628 C 197 ARG A 201 ARG^? C 201 HIS B 143 HIS.? C 204 HIS B 139 HIS~? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 9 3 RMSD = 0.95 A TRANSFORM 0.9587 -0.2371 0.1568 -0.2554 -0.9607 0.1090 -0.1248 0.1445 0.9816 -46.104 151.796 -11.552 B 197 ARG A 201 ARG^? B 201 HIS B 143 HIS.? B 204 HIS B 139 HIS~? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 13 3 RMSD = 0.96 A TRANSFORM -0.8550 0.4987 -0.1424 0.5160 0.7907 -0.3294 0.0517 0.3551 0.9334 24.459 113.374 -87.130 A 197 ARG B 201 ARG^? A 201 HIS A 143 HIS~? A 204 HIS A 139 HIS~? ULMNm 3 1vom_c00 MYOSIN user 2 3 RMSD = 1.00 A TRANSFORM -0.8328 0.0914 -0.5459 0.3914 -0.6001 -0.6977 0.3914 0.7947 -0.4640 162.807 52.551 -22.980 233 ASN B 78 ASN.? 457 GLY B 81 GLY.? 459 GLU B 80 GLU.? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 4 3 RMSD = 1.01 A TRANSFORM 0.5855 -0.3414 -0.7352 0.0624 0.9233 -0.3791 -0.8082 -0.1761 -0.5619 56.042 25.001 92.455 B 46 ASP A 48 ASP~? B 100 ARG B 44 ARG~? B 116 GLN B 40 GLN~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.01 A TRANSFORM 0.9743 -0.1889 0.1225 0.1353 0.9261 0.3522 0.1800 0.3266 -0.9279 -7.048 -165.804 -105.851 A 420 ALA A 45 ALA~? B 182 GLY B 128 GLY.? B 183 GLY B 129 GLY.? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 15 3 RMSD = 1.02 A TRANSFORM 0.9919 0.0868 -0.0930 0.1133 -0.9354 0.3350 0.0579 0.3428 0.9376 -31.243 2.145 -60.794 C 197 ARG B 201 ARG^? C 201 HIS A 143 HIS~? C 204 HIS A 139 HIS~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.05 A TRANSFORM -0.6228 0.4113 0.6656 -0.5838 0.3220 -0.7453 0.5208 0.8527 -0.0396 -9.831 63.050 -43.327 A 105 ALA A 30 ALA~? A 244 ASP B 35 ASP.? A 271 HIS B 37 HIS~? ULMNm 3 2odj_o01 PORIN D user 12 3 RMSD = 1.05 A TRANSFORM -0.1992 -0.8039 0.5605 0.9770 -0.2075 0.0496 -0.0764 -0.5574 -0.8267 -5.156 -59.720 133.912 B 156 HIS B 28 HIS~? B 208 ASP B 35 ASP.? B 296 SER B 118 SER~? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 14 3 RMSD = 1.06 A TRANSFORM -0.1520 0.9782 0.1418 -0.9718 -0.1741 0.1593 -0.1805 0.1135 -0.9770 -37.437 162.351 100.715 B 197 ARG B 175 ARG~? B 201 HIS A 143 HIS~? B 204 HIS A 139 HIS~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.07 A TRANSFORM 0.2958 -0.3792 -0.8768 0.2519 -0.8544 0.4545 0.9214 0.3553 0.1572 66.409 13.506 -32.679 A 156 HIS A 28 HIS~? A 208 ASP A 35 ASP.? A 296 SER A 118 SER~? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 16 3 RMSD = 1.08 A TRANSFORM -0.2794 0.9017 -0.3301 -0.9568 -0.2329 0.1738 -0.0799 -0.3644 -0.9278 4.844 161.889 105.250 B 197 ARG B 201 ARG^? B 201 HIS A 143 HIS~? B 204 HIS A 139 HIS~? ULMNm 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 7 3 RMSD = 1.09 A TRANSFORM -0.9407 -0.0252 0.3382 0.2229 0.7057 0.6726 0.2556 -0.7081 0.6582 46.754 -64.412 42.711 B 59 GLU B 21 GLU~? B 128 HIS A 139 HIS~? C 263 HIS B 203 HIS^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 12 3 RMSD = 1.11 A TRANSFORM -0.8870 -0.4613 0.0225 0.3859 -0.7135 0.5849 0.2538 -0.5274 -0.8108 114.495 11.846 43.699 199 ASP B 114 ASP~? 218 GLU A 241 GLU^? 329 ASP B 152 ASP~? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 13 3 RMSD = 1.11 A TRANSFORM 0.9876 0.0036 -0.1572 -0.0177 -0.9909 -0.1335 0.1562 -0.1346 0.9785 -24.432 43.838 -55.557 C 197 ARG B 175 ARG~? C 201 HIS A 143 HIS~? C 204 HIS A 139 HIS~? ULMNm 3 1vom_c00 MYOSIN user 1 3 RMSD = 1.12 A TRANSFORM 0.3130 -0.8079 0.4993 -0.4139 0.3571 0.8374 0.8548 0.4688 0.2226 82.601 -14.175 -73.240 233 ASN A 78 ASN.? 457 GLY A 81 GLY.? 459 GLU A 80 GLU.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.12 A TRANSFORM -0.2808 0.7316 -0.6212 -0.7668 0.2183 0.6036 -0.5772 -0.6458 -0.4997 47.968 65.513 100.131 B 194 SER A 22 SER~? B 292 ASP A 114 ASP~? B 322 HIS A 8 HIS^? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.13 A TRANSFORM 0.4381 0.8763 -0.2003 0.0739 0.1869 0.9796 -0.8959 0.4440 -0.0171 -20.865 -28.218 113.107 A 241 ASP A 35 ASP.? A 279 GLU B 7 GLU^? A 369 ASP B 35 ASP.? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 3 3 RMSD = 1.13 A TRANSFORM -0.0639 -0.6541 0.7537 0.3023 0.7071 0.6392 0.9511 -0.2687 -0.1526 15.480 -41.163 -2.378 A 194 SER B 22 SER~? A 292 ASP B 114 ASP~? A 322 HIS B 8 HIS^? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.14 A TRANSFORM -0.8396 -0.2737 -0.4693 0.4669 0.0780 -0.8808 -0.2777 0.9586 -0.0623 108.202 52.547 14.899 A 194 SER A 22 SER~? A 292 ASP A 114 ASP~? A 322 HIS A 8 HIS^? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 5 3 RMSD = 1.14 A TRANSFORM 0.9003 -0.0984 0.4240 0.0835 -0.9170 -0.3902 -0.4272 -0.3867 0.8173 -40.841 112.731 13.172 B 194 SER B 22 SER~? B 292 ASP B 114 ASP~? B 322 HIS B 8 HIS^? ULMNm 3 2odj_o01 PORIN D user 2 3 RMSD = 1.17 A TRANSFORM -0.9209 -0.3348 -0.1995 -0.2655 0.9137 -0.3076 -0.2853 0.2303 0.9304 56.738 -13.897 24.264 B 156 HIS A 28 HIS~? B 208 ASP A 35 ASP.? B 296 SER A 118 SER~? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 11 3 RMSD = 1.19 A TRANSFORM -0.7725 0.6046 0.1938 0.6169 0.7871 0.0034 0.1505 -0.1222 0.9810 -6.472 84.362 -82.391 A 197 ARG B 175 ARG~? A 201 HIS A 143 HIS~? A 204 HIS A 139 HIS~? ULMNm 3 1uk7_c00 3.07.01.0009 user 1 3 RMSD = 1.21 A TRANSFORM 0.9960 0.0499 0.0743 0.0636 -0.9788 -0.1947 -0.0630 -0.1987 0.9780 -40.774 84.026 -51.814 A 103 ALA A 30 ALA~? A 224 ASP B 35 ASP.? A 252 HIS B 37 HIS~? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 6 3 RMSD = 1.21 A TRANSFORM 0.9089 -0.2481 -0.3351 -0.2131 -0.9672 0.1382 0.3584 0.0542 0.9320 -24.805 149.448 -26.758 B 197 ARG A 175 ARG~? B 201 HIS B 143 HIS.? B 204 HIS B 139 HIS~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.22 A TRANSFORM -0.3609 -0.8249 0.4350 -0.7586 -0.0116 -0.6515 -0.5425 0.5651 0.6216 76.767 119.483 -26.365 199 ASP A 114 ASP~? 218 GLU B 239 GLU^? 329 ASP A 152 ASP~? ULMNm 3 1ig8_c00 HEXOKINASE PII user 2 3 RMSD = 1.24 A TRANSFORM 0.1108 0.9173 -0.3825 -0.9860 0.0533 -0.1579 0.1244 -0.3946 -0.9104 -18.918 114.901 37.689 A 158 SER A 192 SER^? A 173 ARG A 186 ARG.? A 211 ASP A 193 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.25 A TRANSFORM 0.5943 0.6574 0.4633 -0.3772 -0.2810 0.8825 -0.7103 0.6992 -0.0809 -72.931 -5.105 25.572 141 ASP B 48 ASP~? 166 GLY B 32 GLY.? 169 GLU B 147 GLU~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 RMSD = 1.25 A TRANSFORM -0.8915 -0.4481 -0.0670 0.2055 -0.5317 0.8217 0.4038 -0.7187 -0.5660 117.784 8.564 31.400 199 ASP B 114 ASP~? 218 GLU A 239 GLU^? 329 ASP B 152 ASP~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.26 A TRANSFORM -0.5468 -0.7774 -0.3109 0.8301 -0.4551 -0.3222 -0.1090 0.4342 -0.8942 97.909 55.895 -33.837 D 465 GLY A 216 GLY^? D 501 ASP A 237 ASP.? E 367 TYR A 73 TYR~? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 5 3 RMSD = 1.26 A TRANSFORM 0.0480 0.9936 -0.1021 -0.9240 0.0830 0.3733 -0.3793 -0.0764 -0.9221 -10.764 26.519 71.277 C 197 ARG A 175 ARG~? C 201 HIS B 143 HIS.? C 204 HIS B 139 HIS~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.27 A TRANSFORM -0.9936 -0.1119 0.0133 -0.0932 0.8828 0.4605 0.0633 -0.4563 0.8876 56.129 -31.251 -28.757 A 465 GLY A 216 GLY^? A 501 ASP A 237 ASP.? B 367 TYR A 73 TYR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 RMSD = 1.30 A TRANSFORM -0.3953 -0.8428 0.3654 -0.8733 0.2215 -0.4340 -0.2848 0.4906 0.8235 83.924 99.974 -49.945 199 ASP A 114 ASP~? 218 GLU B 241 GLU^? 329 ASP A 152 ASP~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 RMSD = 1.30 A TRANSFORM -0.1450 0.2616 0.9542 -0.2639 0.9192 -0.2921 0.9536 0.2942 0.0643 -76.806 -6.874 -10.340 B 49 ASP B 35 ASP.? B 86 HIS B 37 HIS~? B 250 ALA A 30 ALA~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.30 A TRANSFORM 0.1025 -0.1454 0.9840 -0.0338 0.9882 0.1496 0.9942 0.0486 -0.0964 -5.089 -43.011 -29.772 A 67 ASP A 48 ASP~? A 68 ALA A 45 ALA~? A 72 LEU A 46 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 RMSD = 1.30 A TRANSFORM -0.4407 -0.2016 -0.8747 0.8976 -0.1012 -0.4289 0.0021 0.9742 -0.2256 124.088 -23.430 -2.733 A 67 ASP B 48 ASP~? A 68 ALA B 45 ALA~? A 72 LEU B 46 LEU~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 RMSD = 1.31 A TRANSFORM -0.1089 0.5071 -0.8550 -0.3534 0.7842 0.5101 -0.9291 -0.3577 -0.0938 54.431 -61.323 79.762 A 49 ASP B 35 ASP.? A 86 HIS B 37 HIS~? A 250 ALA A 30 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 RMSD = 1.31 A TRANSFORM -0.1089 0.5071 -0.8550 -0.3534 0.7842 0.5101 -0.9291 -0.3577 -0.0938 54.431 -61.323 79.762 A 49 ASP B 35 ASP.? A 86 HIS B 37 HIS~? A 250 ALA A 30 ALA~? ULMNm 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 6 3 RMSD = 1.31 A TRANSFORM 0.7361 0.6718 0.0828 -0.6767 0.7332 0.0673 0.0156 0.1056 -0.9943 -64.836 11.425 29.704 A 157 PHE A 116 PHE~? A 245 ASP A 152 ASP~? A 273 LYS A 158 LYS~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 RMSD = 1.32 A TRANSFORM -0.2285 0.9338 -0.2752 0.2032 -0.2308 -0.9516 0.9521 0.2734 0.1370 50.745 38.848 -48.879 C 49 ASP B 35 ASP.? C 86 HIS B 37 HIS~? C 250 ALA A 30 ALA~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 4 3 RMSD = 1.34 A TRANSFORM -0.7520 -0.0993 0.6516 0.6562 -0.0204 0.7543 0.0616 -0.9948 -0.0805 37.578 -2.814 127.797 A 270 ASN B 154 ASN~? A 384 ASN A 230 ASN.? A 385 GLU A 229 GLU.? ULMNm 3 1ig8_c00 HEXOKINASE PII user 1 3 RMSD = 1.34 A TRANSFORM -0.7790 -0.6095 -0.1475 0.1550 -0.4151 0.8965 0.6076 -0.6755 -0.4178 105.825 27.863 26.617 A 158 SER A 118 SER~? A 173 ARG A 123 ARG~? A 211 ASP A 114 ASP~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 11 3 RMSD = 1.35 A TRANSFORM 0.5498 0.1756 0.8166 -0.7313 -0.3711 0.5722 -0.4035 0.9118 0.0756 -48.475 9.941 21.065 A 44 HIS B 4 HIS^? A 45 HIS A 143 HIS~? A 261 PHE A 116 PHE~? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 5 3 RMSD = 1.35 A TRANSFORM 0.5316 -0.8360 -0.1361 0.7628 0.5424 -0.3521 -0.3682 -0.0834 -0.9260 -8.268 105.637 44.570 A 197 ARG A 175 ARG~? A 201 HIS B 143 HIS.? A 204 HIS B 139 HIS~? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.35 A TRANSFORM 0.0352 0.9261 0.3756 0.7207 -0.2839 0.6325 -0.6924 -0.2484 0.6774 7.370 -9.935 70.012 C 202 HIS A 203 HIS^? C 295 HIS B 139 HIS~? C 296 HIS B 143 HIS.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 2 3 RMSD = 1.35 A TRANSFORM 0.1357 0.2679 -0.9538 -0.9784 0.1880 -0.0864 -0.1562 -0.9449 -0.2877 83.696 62.817 52.125 B 56 GLU B 176 GLU~? B 67 ARG B 201 ARG^? B 86 HIS B 179 HIS.? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.36 A TRANSFORM -0.5508 -0.4403 0.7091 -0.8331 0.2379 -0.4994 -0.0512 0.8658 0.4978 75.236 100.092 2.353 A 202 HIS A 203 HIS^? A 295 HIS B 139 HIS~? A 296 HIS B 143 HIS.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.36 A TRANSFORM -0.3708 -0.9065 0.2020 -0.4026 -0.0391 -0.9146 -0.8369 0.4204 0.3504 37.932 79.190 9.447 141 ASP A 35 ASP.? 166 GLY B 129 GLY.? 169 GLU A 51 GLU~? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 3 3 RMSD = 1.37 A TRANSFORM -0.4181 -0.8664 -0.2729 0.8905 -0.4503 0.0652 0.1794 0.2158 -0.9598 113.213 10.282 79.607 C 202 HIS A 203 HIS^? C 295 HIS B 143 HIS.? C 296 HIS B 139 HIS~? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 3 3 RMSD = 1.37 A TRANSFORM 0.4147 0.8691 0.2696 0.7704 -0.4930 0.4043 -0.4843 -0.0400 0.8740 -36.891 3.924 46.623 B 202 HIS A 203 HIS^? B 295 HIS B 143 HIS.? B 296 HIS B 139 HIS~? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.37 A TRANSFORM -0.0394 -0.9257 -0.3761 0.9197 -0.1807 0.3486 0.3907 0.3322 -0.8585 68.958 -11.049 62.897 B 202 HIS A 203 HIS^? B 295 HIS B 139 HIS~? B 296 HIS B 143 HIS.? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.37 A TRANSFORM 0.5370 0.1445 -0.8311 0.8345 -0.2352 0.4983 0.1235 0.9611 0.2469 67.576 78.764 1.164 D 202 HIS A 203 HIS^? D 295 HIS B 139 HIS~? D 296 HIS B 143 HIS.? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 3 3 RMSD = 1.37 A TRANSFORM 0.3960 0.2580 -0.8813 -0.8449 0.4782 -0.2397 -0.3596 -0.8395 -0.4074 71.778 82.380 108.858 A 202 HIS A 203 HIS^? A 295 HIS B 143 HIS.? A 296 HIS B 139 HIS~? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 3 3 RMSD = 1.37 A TRANSFORM -0.2644 0.0208 0.9642 0.8430 -0.4807 0.2415 -0.4685 -0.8766 -0.1095 37.208 96.687 103.290 D 202 HIS A 203 HIS^? D 295 HIS B 143 HIS.? D 296 HIS B 139 HIS~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 RMSD = 1.38 A TRANSFORM 0.9477 -0.1251 -0.2935 -0.2501 0.2797 -0.9269 -0.1981 -0.9519 -0.2338 0.044 65.652 56.591 A 67 ASP B 165 ASP~? A 68 ALA B 166 ALA~? A 72 LEU B 101 LEU~? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 5 3 RMSD = 1.38 A TRANSFORM -0.7454 -0.3535 0.5652 -0.5345 0.8236 -0.1898 0.3984 0.4436 0.8028 69.314 54.805 -33.573 C 202 HIS B 203 HIS^? C 295 HIS A 143 HIS~? C 296 HIS A 139 HIS~? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 5 3 RMSD = 1.38 A TRANSFORM 0.7491 0.3513 -0.5617 -0.6374 0.6134 -0.4664 -0.1807 -0.7073 -0.6834 6.436 86.077 136.575 B 202 HIS B 203 HIS^? B 295 HIS A 143 HIS~? B 296 HIS A 139 HIS~? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 5 3 RMSD = 1.38 A TRANSFORM 0.4016 0.6312 0.6635 0.5948 -0.7307 0.3351 -0.6964 -0.2601 0.6689 -23.794 17.828 50.486 A 202 HIS B 203 HIS^? A 295 HIS A 143 HIS~? A 296 HIS A 139 HIS~? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 5 3 RMSD = 1.38 A TRANSFORM -0.1612 -0.5190 -0.8394 -0.5973 0.7284 -0.3356 -0.7857 -0.4472 0.4274 146.198 161.387 77.755 D 202 HIS B 203 HIS^? D 295 HIS A 143 HIS~? D 296 HIS A 139 HIS~? ULMNm 3 1rtu_c00 RIBONUCLEASE U2 user 2 3 RMSD = 1.39 A TRANSFORM -0.3668 0.3855 -0.8467 0.8078 -0.3195 -0.4954 0.4614 0.8657 0.1942 92.927 19.972 -49.224 41 HIS B 203 HIS^? 62 GLU B 241 GLU^? 101 HIS B 179 HIS.? ULMNm 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 13 3 RMSD = 1.39 A TRANSFORM -0.4644 0.8661 0.1851 0.8745 0.4814 -0.0585 0.1398 -0.1347 0.9810 -26.299 -43.765 -32.009 A 197 ARG B 175 ARG~? A 201 HIS A 143 HIS~? A 204 HIS A 139 HIS~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 RMSD = 1.40 A TRANSFORM -0.1179 0.9925 0.0336 0.5134 0.0320 0.8575 -0.8500 -0.1184 0.5133 -0.681 -61.591 22.526 A 67 ASP A 165 ASP~? A 68 ALA A 166 ALA~? A 72 LEU A 101 LEU~? ULMNm 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 1 3 RMSD = 1.40 A TRANSFORM 0.4994 -0.0255 -0.8660 0.2962 0.9443 0.1431 -0.8142 0.3280 -0.4791 -2.769 -33.845 81.153 A 197 ARG A 25 ARG~? A 201 HIS B 143 HIS.? A 204 HIS B 139 HIS~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 RMSD = 1.41 A TRANSFORM -0.3379 0.8276 0.4482 0.0648 -0.4547 0.8883 -0.9389 -0.3292 -0.1001 1.504 -91.286 45.818 D 49 ASP B 35 ASP.? D 86 HIS B 37 HIS~? D 250 ALA A 30 ALA~? ULMNm 3 1knp_c00 L-ASPARTATE OXIDASE user 5 3 RMSD = 1.41 A TRANSFORM 0.2272 0.2467 -0.9421 0.0570 0.9623 0.2658 -0.9722 0.1141 -0.2046 92.992 14.434 195.113 A 290 ARG B 25 ARG~? A 351 HIS B 28 HIS~? A 386 LEU B 24 LEU~? ULMNm 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.42 A TRANSFORM -0.7954 0.5926 0.1267 -0.6055 -0.7862 -0.1237 -0.0263 0.1751 -0.9842 33.264 65.447 65.052 A 21 GLN A 38 GLN~? A 41 TYR A 39 TYR~? A 43 ASN A 36 ASN.? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 RMSD = 1.42 A TRANSFORM 0.5977 -0.7803 0.1842 0.7304 0.4353 -0.5263 -0.3305 -0.4491 -0.8301 25.389 52.458 102.785 229 ASP B 152 ASP~? 264 GLU B 105 GLU.? 328 ASP B 114 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 RMSD = 1.43 A TRANSFORM 0.4196 0.7266 -0.5441 -0.1722 0.6522 0.7382 -0.8912 0.2160 -0.3988 40.659 -35.057 77.549 199 ASP A 152 ASP~? 218 GLU B 51 GLU~? 329 ASP A 114 ASP~? ULMNm 3 1opm_c00 1.14.17.0003 user 5 3 RMSD = 1.43 A TRANSFORM 0.0733 0.1041 0.9919 0.9951 -0.0735 -0.0659 -0.0661 -0.9918 0.1090 -23.109 -4.493 70.185 A 108 HIS B 37 HIS~? A 170 GLN A 38 GLN~? A 242 HIS A 28 HIS~? ULMNm 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.43 A TRANSFORM -0.0100 0.5949 0.8038 -0.5371 -0.6812 0.4975 -0.8435 0.4267 -0.3263 -57.363 51.425 113.510 C 107 ASP B 35 ASP.? C 246 ASP A 48 ASP~? C 275 HIS B 37 HIS~? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 RMSD = 1.44 A TRANSFORM 0.4510 -0.8021 -0.3915 0.8902 0.4358 0.1325 -0.0644 0.4083 -0.9106 34.604 -69.773 115.888 A 14 ASP B 35 ASP.? A 16 HIS B 37 HIS~? A 67 GLY B 32 GLY.? ULMNm 3 2dbt_c01 CHITINASE C user 4 3 RMSD = 1.44 A TRANSFORM 0.4987 0.2212 -0.8381 0.1467 -0.9745 -0.1699 0.8543 0.0383 0.5184 52.738 123.828 -46.502 B 147 GLU A 61 GLU~? B 156 GLU A 12 GLU~? B 194 ASN A 198 ASN.? ULMNm 3 1pyl_c00 RIBONUCLEASE user 3 3 RMSD = 1.44 A TRANSFORM -0.7099 0.0327 0.7036 -0.4516 0.7454 -0.4903 0.5405 0.6658 0.5144 18.984 56.140 -59.484 A 56 GLU B 176 GLU~? A 67 ARG B 201 ARG^? A 86 HIS B 179 HIS.? ULMNm 3 1kim_c00 THYMIDINE KINASE user 1 3 RMSD = 1.45 A TRANSFORM 0.2189 0.3336 0.9169 0.9358 -0.3378 -0.1005 -0.2762 -0.8801 0.3862 -24.511 34.936 63.815 A 83 GLU B 21 GLU~? A 163 ARG B 25 ARG~? A 222 ARG B 175 ARG~? ULMNm 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 1 3 RMSD = 1.45 A TRANSFORM -0.5348 0.6444 0.5466 0.3035 -0.4572 0.8360 -0.7886 -0.6129 -0.0490 -5.365 -42.777 99.582 B 41 HIS A 143 HIS~? B 43 HIS A 139 HIS~? B 65 GLU B 7 GLU^? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 RMSD = 1.45 A TRANSFORM 0.4280 -0.6994 -0.5724 -0.8894 -0.4384 -0.1294 0.1604 -0.5645 0.8097 41.120 100.857 55.293 C 14 ASP B 35 ASP.? C 16 HIS B 37 HIS~? C 67 GLY B 32 GLY.? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 4 3 RMSD = 1.46 A TRANSFORM 0.8187 -0.0370 -0.5730 -0.4787 0.5071 -0.7167 -0.3171 -0.8611 -0.3975 48.780 97.353 128.986 C 202 HIS B 203 HIS^? C 295 HIS A 139 HIS~? C 296 HIS A 143 HIS~? ULMNm 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 4 3 RMSD = 1.47 A TRANSFORM -0.7475 0.3330 -0.5748 0.4129 -0.4449 -0.7947 0.5204 0.8314 -0.1950 104.108 58.013 20.377 A 87 ARG B 15 ARG~? A 89 HIS B 8 HIS^? A 119 ASN B 11 ASN~? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 4 3 RMSD = 1.47 A TRANSFORM -0.5252 -0.7406 -0.4191 0.4172 -0.6534 0.6317 0.7417 -0.1570 -0.6521 144.758 5.252 56.119 A 202 HIS B 203 HIS^? A 295 HIS A 139 HIS~? A 296 HIS A 143 HIS~? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 4 3 RMSD = 1.48 A TRANSFORM -0.8177 0.0334 0.5746 -0.3379 0.7804 -0.5261 0.4660 0.6244 0.6269 27.305 68.078 -30.429 B 202 HIS B 203 HIS^? B 295 HIS A 139 HIS~? B 296 HIS A 143 HIS~? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 4 3 RMSD = 1.48 A TRANSFORM 0.2653 0.7511 0.6045 -0.4146 0.6549 -0.6318 0.8705 0.0830 -0.4851 -15.577 173.528 30.024 D 202 HIS B 203 HIS^? D 295 HIS A 139 HIS~? D 296 HIS A 143 HIS~? ULMNm 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 6 3 RMSD = 1.49 A TRANSFORM -0.0461 -0.2780 0.9595 -0.2351 0.9365 0.2601 0.9709 0.2136 0.1086 -41.328 -15.730 9.501 B 59 GLU B 21 GLU~? B 128 HIS A 139 HIS~? C 263 HIS B 8 HIS^? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 1 3 RMSD = 1.49 A TRANSFORM 0.3365 -0.4016 -0.8518 0.4965 0.8442 -0.2019 -0.8002 0.3550 -0.4834 11.607 100.560 30.402 A 197 ARG A 25 ARG~? A 201 HIS B 143 HIS.? A 204 HIS B 139 HIS~? ULMNm 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 4 3 RMSD = 1.49 A TRANSFORM 0.7368 -0.3342 0.5877 0.4265 -0.4446 -0.7876 -0.5246 -0.8310 0.1851 -105.681 56.376 83.958 B 87 ARG B 15 ARG~? B 89 HIS B 8 HIS^? B 119 ASN B 11 ASN~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 9 3 RMSD = 1.49 A TRANSFORM 0.6128 0.7863 0.0787 0.6953 -0.5839 0.4190 -0.3754 0.2021 0.9046 2.417 -69.972 -13.731 A 67 ASP B 83 ASP~? A 68 ALA B 86 ALA~? A 72 LEU B 87 LEU~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 14 3 RMSD = 1.49 A TRANSFORM -0.0552 -0.9526 0.2993 0.7084 -0.2486 -0.6606 -0.7037 -0.1756 -0.6885 20.769 25.338 85.600 A 465 GLY B 216 GLY^? A 501 ASP B 237 ASP.? B 367 TYR B 73 TYR~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 14 3 RMSD = 1.49 A TRANSFORM -0.6171 -0.4106 0.6712 -0.3834 0.9018 0.1993 0.6871 0.1343 0.7140 36.778 44.961 -150.771 D 465 GLY B 216 GLY^? D 501 ASP B 237 ASP.? E 367 TYR B 73 TYR~? ULMNm 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 RMSD = 1.49 A TRANSFORM 0.3756 0.0937 -0.9221 -0.8266 -0.4161 -0.3789 0.4192 -0.9045 0.0788 41.257 78.467 61.103 A 263 HIS B 8 HIS^? D 59 GLU B 21 GLU~? D 128 HIS A 139 HIS~?