*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1ddj_c03 PLASMINOGEN user 1 4 RMSD = 1.47 A TRANSFORM 0.8563 -0.0468 -0.5144 -0.3019 0.7626 -0.5721 0.4190 0.6452 0.6388 -52.370 50.197 21.436 D 603 HIS A 15 HIS~? D 646 ASP A 12 ASP~? D 739 GLY A 157 GLY~? D 741 ALA A 14 ALA~? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 8 3 RMSD = 0.52 A TRANSFORM 0.2246 0.4875 0.8438 0.3008 0.7889 -0.5358 -0.9269 0.3741 0.0305 -49.158 6.342 -46.103 B 8 HIS B 61 HIS.? B 80 GLU A 92 GLU~? B 223 ARG B 17 ARG~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 RMSD = 0.63 A TRANSFORM 0.7247 -0.6355 -0.2662 -0.6604 -0.7509 -0.0053 -0.1965 0.1796 -0.9639 3.624 31.243 -1.030 A 49 ASP A 81 ASP.? A 147 THR A 72 THR~? A 294 ASP A 53 ASP~? ULMNm 3 1bol_c00 RIBONUCLEASE RH user 2 3 RMSD = 0.68 A TRANSFORM 0.2213 0.5281 0.8198 0.9197 -0.3925 0.0046 0.3242 0.7530 -0.5726 18.609 27.346 -9.163 A 46 HIS B 61 HIS.? A 105 GLU A 92 GLU~? A 109 HIS A 88 HIS.? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 RMSD = 0.76 A TRANSFORM -0.5693 -0.0257 0.8217 0.4264 -0.8638 0.2684 0.7029 0.5031 0.5027 -14.304 4.833 10.022 54 ASP A 81 ASP.? 158 THR A 72 THR~? 317 ASP A 53 ASP~? ULMNm 3 2bsq_d00 TRANSCRIPTION user 3 3 RMSD = 0.82 A TRANSFORM -0.9847 -0.1744 0.0062 -0.1393 0.7641 -0.6298 0.1051 -0.6210 -0.7767 26.266 -25.230 40.945 E 3 SER A 156 SER~? E 5 VAL A 160 VAL~? E 7 ARG A 164 ARG~? ULMNm 3 2bsq_d00 TRANSCRIPTION user 6 3 RMSD = 0.82 A TRANSFORM 0.9759 -0.1591 0.1496 0.0296 0.7753 0.6309 -0.2164 -0.6113 0.7613 8.126 -67.800 35.046 E 3 SER B 156 SER~? E 5 VAL B 160 VAL~? E 7 ARG B 164 ARG~? ULMNm 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 RMSD = 0.87 A TRANSFORM 0.0218 -0.7064 0.7074 0.1051 -0.7021 -0.7043 0.9942 0.0897 0.0589 20.911 15.848 13.785 B 145 LYS A 101 LYS~? B 177 GLU A 19 GLU~? B 201 LEU A 22 LEU~? ULMNm 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 4 3 RMSD = 0.90 A TRANSFORM 0.0775 -0.7124 -0.6975 -0.2249 -0.6940 0.6839 -0.9713 0.1038 -0.2140 61.355 14.452 35.486 B 145 LYS B 101 LYS~? B 177 GLU B 19 GLU~? B 201 LEU B 22 LEU~? ULMNm 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 RMSD = 0.91 A TRANSFORM -0.1735 0.4817 -0.8590 -0.8639 -0.4932 -0.1022 -0.4729 0.7243 0.5017 62.056 30.826 46.599 A 145 LYS A 101 LYS~? A 177 GLU A 19 GLU~? A 201 LEU A 22 LEU~? ULMNm 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 5 3 RMSD = 0.92 A TRANSFORM 0.0442 0.4872 0.8722 0.8293 -0.5047 0.2398 0.5570 0.7127 -0.4264 19.292 21.024 32.961 A 145 LYS B 101 LYS~? A 177 GLU B 19 GLU~? A 201 LEU B 22 LEU~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.07 A TRANSFORM -0.9613 -0.1345 0.2405 0.2488 -0.7989 0.5475 0.1185 0.5862 0.8015 29.384 -6.280 -14.054 274 HIS A 47 HIS~? 320 HIS A 87 HIS.? 375 ASP A 85 ASP.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.08 A TRANSFORM -0.2085 0.8808 -0.4251 0.9214 0.3226 0.2165 0.3279 -0.3466 -0.8789 -24.930 -8.929 179.562 C 70 ALA B 23 ALA~? C 126 LEU B 22 LEU~? C 158 GLU B 19 GLU~? ULMNm 3 1ez2_c01 PHOSPHOTRIESTERASE user 1 3 RMSD = 1.10 A TRANSFORM -0.5225 -0.7379 0.4273 -0.0997 -0.4448 -0.8900 0.8468 -0.5076 0.1589 66.324 2.136 15.735 B 233 ASP B 151 ASP~? B 254 HIS B 47 HIS~? B 301 ASP B 85 ASP~? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 1 3 RMSD = 1.11 A TRANSFORM 0.8412 -0.4935 0.2210 -0.1277 0.2157 0.9681 -0.5254 -0.8426 0.1184 26.016 74.148 29.428 313 ASP B 129 ASP.? 315 GLU A 82 GLU.? 390 TYR B 118 TYR~? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.12 A TRANSFORM 0.1128 0.1928 -0.9747 0.6946 -0.7168 -0.0615 -0.7105 -0.6701 -0.2148 58.733 26.056 80.830 C 202 HIS A 87 HIS.? C 295 HIS A 155 HIS~? C 296 HIS A 47 HIS~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.12 A TRANSFORM 0.2813 0.8832 0.3753 -0.9437 0.3255 -0.0585 -0.1738 -0.3378 0.9250 -20.273 22.942 146.133 C 70 ALA A 23 ALA~? C 126 LEU A 22 LEU~? C 158 GLU A 19 GLU~? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.13 A TRANSFORM -0.5854 -0.8085 -0.0593 -0.8105 0.5855 0.0183 0.0200 0.0588 -0.9981 83.810 66.809 55.973 A 202 HIS A 87 HIS.? A 295 HIS A 155 HIS~? A 296 HIS A 47 HIS~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.13 A TRANSFORM -0.6610 -0.7490 -0.0458 -0.6328 0.5892 -0.5024 0.4033 -0.3031 -0.8634 14.751 9.123 177.732 A 70 ALA B 23 ALA~? A 126 LEU B 22 LEU~? A 158 GLU B 19 GLU~? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.13 A TRANSFORM -0.1137 -0.1871 0.9757 0.9015 -0.4322 0.0222 0.4176 0.8822 0.2178 17.381 18.534 39.946 B 202 HIS A 87 HIS.? B 295 HIS A 155 HIS~? B 296 HIS A 47 HIS~? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.14 A TRANSFORM -0.5203 0.6856 -0.5092 0.0944 0.6388 0.7636 0.8488 0.3492 -0.3970 38.852 20.464 53.561 A 223 HIS A 47 HIS~? A 262 HIS A 87 HIS.? A 312 ASP A 85 ASP.? ULMNm 3 1ez2_c00 PHOSPHOTRIESTERASE user 1 3 RMSD = 1.14 A TRANSFORM -0.4826 -0.7723 0.4132 0.1336 0.4013 0.9062 -0.8656 0.4925 -0.0905 66.492 -35.833 19.113 A 233 ASP B 151 ASP~? A 254 HIS B 47 HIS~? A 301 ASP B 85 ASP~? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.14 A TRANSFORM 0.5474 0.7495 0.3722 0.8120 -0.5833 -0.0197 0.2023 0.3130 -0.9279 42.421 112.120 49.230 D 202 HIS A 87 HIS.? D 295 HIS A 155 HIS~? D 296 HIS A 47 HIS~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.14 A TRANSFORM 0.9112 -0.1642 0.3779 -0.2552 -0.9449 0.2048 0.3235 -0.2831 -0.9029 -20.602 33.818 178.512 B 70 ALA B 23 ALA~? B 126 LEU B 22 LEU~? B 158 GLU B 19 GLU~? ULMNm 3 1itx_c00 GLYCOSYL HYDROLASE user 1 3 RMSD = 1.15 A TRANSFORM 0.4889 0.8251 -0.2832 -0.4794 0.5253 0.7030 0.7288 -0.2079 0.6523 0.268 -13.485 11.262 A 202 ASP B 129 ASP.? A 204 GLU A 82 GLU.? A 279 TYR B 118 TYR~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.17 A TRANSFORM 0.6563 -0.7519 -0.0626 0.7120 0.5899 0.3808 -0.2494 -0.2945 0.9225 -17.779 -3.849 147.237 A 70 ALA A 23 ALA~? A 126 LEU A 22 LEU~? A 158 GLU A 19 GLU~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 1 3 RMSD = 1.17 A TRANSFORM 0.0944 0.9060 -0.4127 -0.1823 -0.3918 -0.9018 -0.9787 0.1604 0.1281 17.997 46.121 108.165 B 223 HIS A 47 HIS~? B 262 HIS A 87 HIS.? B 312 ASP A 85 ASP.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.18 A TRANSFORM -0.9632 -0.1626 -0.2139 0.2128 -0.9478 -0.2377 -0.1641 -0.2744 0.9475 3.979 11.870 145.794 B 70 ALA A 23 ALA~? B 126 LEU A 22 LEU~? B 158 GLU A 19 GLU~? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 7 3 RMSD = 1.18 A TRANSFORM 0.0843 0.5021 0.8607 0.0921 0.8561 -0.5085 -0.9922 0.1221 0.0260 -48.239 6.984 -41.261 B 8 HIS B 61 HIS.? B 80 GLU A 92 GLU~? B 223 ARG B 13 ARG~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 2 3 RMSD = 1.20 A TRANSFORM -0.1963 0.9805 -0.0026 -0.9669 -0.1931 0.1666 0.1628 0.0352 0.9860 39.914 17.544 15.456 A 44 HIS A 88 HIS.? A 45 HIS A 47 HIS~? A 261 PHE A 75 PHE~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.20 A TRANSFORM -0.7000 -0.2685 0.6617 0.3864 0.6369 0.6672 -0.6005 0.7227 -0.3421 6.808 -24.373 162.388 C 70 ALA A 58 ALA~? C 126 LEU A 54 LEU~? C 158 GLU A 51 GLU~? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.20 A TRANSFORM 0.0324 -0.6353 -0.7716 0.2108 0.7590 -0.6160 0.9770 -0.1427 0.1585 -42.877 -13.898 -43.208 A 114 HIS A 88 HIS.? A 197 ASP A 85 ASP.? A 223 ALA A 49 ALA~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 16 3 RMSD = 1.20 A TRANSFORM 0.5417 0.7813 -0.3099 -0.2956 -0.1681 -0.9404 -0.7868 0.6011 0.1399 35.218 62.481 -7.368 199 ASP B 151 ASP~? 242 GLU B 124 GLU~? 329 ASP B 85 ASP~? ULMNm 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 RMSD = 1.21 A TRANSFORM 0.6412 0.7271 0.2455 -0.3832 0.0263 0.9233 0.6648 -0.6861 0.2955 -19.142 75.105 39.408 A 123 HIS A 87 HIS.? A 200 ASP A 81 ASP.? A 229 LYS B 133 LYS.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.21 A TRANSFORM 0.6710 0.7015 0.2403 0.3717 -0.0378 -0.9276 -0.6416 0.7117 -0.2861 -50.133 12.989 163.286 B 70 ALA A 58 ALA~? B 126 LEU A 54 LEU~? B 158 GLU A 51 GLU~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.21 A TRANSFORM -0.0193 0.6311 0.7755 -0.3637 -0.7269 0.5825 0.9313 -0.2708 0.2435 -51.228 14.037 -40.865 B 114 HIS A 88 HIS.? B 197 ASP A 85 ASP.? B 223 ALA A 49 ALA~? ULMNm 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 RMSD = 1.21 A TRANSFORM -0.2842 0.9504 -0.1264 0.3882 -0.0065 -0.9215 -0.8767 -0.3109 -0.3671 18.115 67.870 101.906 C 123 HIS A 87 HIS.? C 200 ASP A 81 ASP.? C 229 LYS B 133 LYS.? ULMNm 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 RMSD = 1.21 A TRANSFORM 0.1191 -0.1062 0.9872 -0.2001 -0.9764 -0.0809 0.9725 -0.1879 -0.1375 -18.402 65.571 44.526 D 123 HIS A 87 HIS.? D 200 ASP A 81 ASP.? D 229 LYS B 133 LYS.? ULMNm 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 RMSD = 1.22 A TRANSFORM -0.8000 0.0966 0.5922 0.1913 0.9765 0.0992 -0.5687 0.1926 -0.7997 13.742 77.411 98.909 B 123 HIS A 87 HIS.? B 200 ASP A 81 ASP.? B 229 LYS B 133 LYS.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.23 A TRANSFORM -0.0362 -0.3530 -0.9349 -0.8171 -0.5281 0.2311 -0.5753 0.7723 -0.2693 10.752 43.744 159.746 A 70 ALA A 58 ALA~? A 126 LEU A 54 LEU~? A 158 GLU A 51 GLU~? ULMNm 3 2odj_o01 PORIN D user 5 3 RMSD = 1.24 A TRANSFORM 0.9722 0.1794 -0.1501 -0.1668 0.0816 -0.9826 -0.1641 0.9804 0.1093 -18.562 5.637 63.159 B 156 HIS A 88 HIS.? B 208 ASP A 81 ASP.? B 296 SER B 117 SER~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 16 3 RMSD = 1.24 A TRANSFORM -0.5675 -0.7481 0.3438 -0.3428 0.5943 0.7275 -0.7486 0.2950 -0.5938 71.682 0.598 18.682 199 ASP B 85 ASP~? 218 GLU A 84 GLU.? 329 ASP B 151 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 21 3 RMSD = 1.24 A TRANSFORM -0.5520 0.7928 0.2586 0.2484 -0.1397 0.9585 0.7960 0.5933 -0.1198 -20.049 17.716 66.361 A 241 ASP B 151 ASP~? A 265 GLU B 19 GLU~? A 369 ASP B 85 ASP~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 1.25 A TRANSFORM 0.8073 -0.5746 -0.1345 -0.5299 -0.8061 0.2635 -0.2599 -0.1414 -0.9552 -1.894 103.650 58.862 A 137 ARG A 50 ARG~? A 141 THR A 72 THR~? A 235 ASP A 151 ASP~? ULMNm 3 1b6g_c00 HALOALKANE DEHALOGENASE user 1 3 RMSD = 1.27 A TRANSFORM 0.6885 -0.4350 -0.5802 0.6677 0.6925 0.2732 0.2829 -0.5756 0.7672 58.753 1.236 27.941 124 ASP B 151 ASP~? 260 ASP B 85 ASP~? 289 HIS B 47 HIS~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 5 3 RMSD = 1.27 A TRANSFORM 0.2784 -0.9265 0.2532 -0.8920 -0.1517 0.4259 -0.3562 -0.3444 -0.8686 0.795 19.255 3.584 A 49 ASP A 81 ASP.? A 147 THR A 72 THR~? A 294 ASP A 63 ASP.? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 11 3 RMSD = 1.28 A TRANSFORM -0.6149 0.7880 -0.0324 0.6154 0.4537 -0.6446 -0.4932 -0.4162 -0.7638 -2.607 101.073 60.803 A 137 ARG B 141 ARG~? A 141 THR B 140 THR^? A 235 ASP B 120 ASP~? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 2 3 RMSD = 1.29 A TRANSFORM -0.3279 -0.9431 -0.0544 -0.6933 0.2011 0.6920 -0.6417 0.2646 -0.7199 57.828 19.508 70.174 412 GLU A 51 GLU~? 516 HIS A 155 HIS~? 559 HIS A 47 HIS~? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 9 3 RMSD = 1.29 A TRANSFORM 0.5503 0.8346 0.0240 0.8170 -0.5324 -0.2214 -0.1720 0.1415 -0.9749 -38.302 111.348 109.768 D 137 ARG B 50 ARG~? D 141 THR B 72 THR~? D 235 ASP B 151 ASP~? ULMNm 3 1lci_c00 LUCIFERASE user 2 3 RMSD = 1.30 A TRANSFORM 0.6289 -0.7112 -0.3141 -0.3764 0.0749 -0.9234 0.6803 0.6990 -0.2206 40.132 106.569 27.985 218 ARG B 144 ARG~? 245 HIS B 155 HIS~? 343 THR B 48 THR~? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 9 3 RMSD = 1.30 A TRANSFORM 0.5181 0.4884 -0.7021 -0.2652 0.8722 0.4110 0.8131 -0.0267 0.5814 -12.743 9.211 15.353 54 ASP A 151 ASP~? 158 THR A 48 THR~? 317 ASP A 85 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 RMSD = 1.30 A TRANSFORM 0.1588 0.0407 -0.9865 -0.9568 -0.2400 -0.1639 -0.2434 0.9699 0.0008 70.036 53.807 10.378 199 ASP A 81 ASP.? 218 GLU A 20 GLU~? 329 ASP A 85 ASP.? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 RMSD = 1.30 A TRANSFORM 0.0420 -0.3874 0.9209 0.7982 0.5674 0.2023 -0.6009 0.7266 0.3331 68.892 36.008 122.222 A 50 ASP A 53 ASP~? A 327 GLU B 16 GLU~? A 339 ARG B 13 ARG~? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 1.31 A TRANSFORM -0.7528 0.6532 0.0810 -0.5722 -0.7103 0.4101 0.3254 0.2624 0.9084 -1.018 100.660 76.657 D 137 ARG A 50 ARG~? D 141 THR A 72 THR~? D 235 ASP A 151 ASP~? ULMNm 3 2odj_o01 PORIN D user 16 3 RMSD = 1.31 A TRANSFORM -0.6795 0.5160 -0.5216 0.2379 -0.5175 -0.8219 -0.6940 -0.6826 0.2288 3.310 10.309 88.471 B 156 HIS B 61 HIS.? B 208 ASP B 132 ASP^? B 296 SER A 68 SER~? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 RMSD = 1.32 A TRANSFORM -0.2794 0.7456 0.6050 0.0796 -0.6099 0.7885 0.9569 0.2685 0.1110 -20.337 -4.269 17.660 54 ASP A 81 ASP.? 158 THR A 72 THR~? 317 ASP A 63 ASP.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 10 3 RMSD = 1.32 A TRANSFORM -0.5008 0.3894 0.7730 -0.5900 0.4999 -0.6340 -0.6333 -0.7736 -0.0205 6.888 29.502 -7.565 A 49 ASP A 151 ASP~? A 147 THR A 48 THR~? A 294 ASP A 85 ASP.? ULMNm 3 1b66_c02 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 4 3 RMSD = 1.33 A TRANSFORM -0.0502 -0.0968 0.9940 0.9930 -0.1120 0.0393 0.1075 0.9890 0.1017 37.965 18.903 24.613 A 133 GLU A 125 GLU~? B 88 ASP B 151 ASP~? B 89 HIS B 155 HIS~? ULMNm 3 1b66_c00 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 4 3 RMSD = 1.33 A TRANSFORM -0.0502 -0.0968 0.9940 0.9930 -0.1120 0.0393 0.1075 0.9890 0.1017 37.965 18.903 24.613 A 133 GLU A 125 GLU~? B 88 ASP B 151 ASP~? B 89 HIS B 155 HIS~? ULMNm 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 RMSD = 1.33 A TRANSFORM 0.3506 0.5552 0.7542 -0.0805 -0.7845 0.6149 0.9330 -0.2763 -0.2304 -51.769 97.434 68.602 C 608 ASP B 85 ASP~? C 610 HIS B 47 HIS~? C 661 HIS B 87 HIS~? ULMNm 3 1c54_c00 RIBONUCLEASE SA user 2 3 RMSD = 1.34 A TRANSFORM 0.5669 -0.3975 -0.7215 -0.7493 -0.6127 -0.2512 -0.3422 0.6830 -0.6452 -6.167 23.849 -7.544 A 54 GLU A 51 GLU~? A 65 ARG A 50 ARG~? A 85 HIS A 88 HIS.? ULMNm 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 RMSD = 1.34 A TRANSFORM 0.6636 -0.5150 -0.5425 0.0925 0.7762 -0.6237 0.7423 0.3638 0.5627 101.416 65.103 -23.507 A 608 ASP B 85 ASP~? A 610 HIS B 47 HIS~? A 661 HIS B 87 HIS~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 RMSD = 1.35 A TRANSFORM 0.8844 -0.1694 0.4350 -0.4084 -0.7321 0.5452 0.2261 -0.6598 -0.7166 12.668 105.704 26.453 193 ASP A 85 ASP.? 231 ASP B 53 ASP~? 294 ASP A 81 ASP.? ULMNm 3 2odj_o01 PORIN D user 15 3 RMSD = 1.37 A TRANSFORM -0.9417 0.0308 0.3351 -0.3361 -0.1334 -0.9323 0.0160 -0.9906 0.1359 0.565 10.280 88.068 B 156 HIS B 61 HIS.? B 208 ASP A 78 ASP.? B 296 SER A 156 SER~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 9 3 RMSD = 1.37 A TRANSFORM -0.6333 -0.7738 0.0101 0.7709 -0.6320 -0.0793 0.0678 -0.0425 0.9968 33.687 113.309 23.612 A 137 ARG B 50 ARG~? A 141 THR B 72 THR~? A 235 ASP B 151 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.37 A TRANSFORM 0.8076 -0.1051 -0.5804 -0.3023 0.7712 -0.5603 0.5064 0.6279 0.5910 -49.839 49.977 18.795 D 603 HIS A 15 HIS~? D 646 ASP A 12 ASP~? D 739 GLY A 157 GLY~? ULMNm 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 2 3 RMSD = 1.38 A TRANSFORM -0.8716 0.2275 -0.4343 -0.3560 -0.9027 0.2417 -0.3370 0.3653 0.8677 3.026 40.423 40.266 A 43 ASP B 12 ASP~? A 48 HIS B 15 HIS~? A 77 LYS B 116 LYS~? ULMNm 3 1b66_c00 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 2 3 RMSD = 1.38 A TRANSFORM 0.5667 0.2229 0.7932 0.7876 0.1364 -0.6010 -0.2422 0.9652 -0.0982 34.304 26.206 29.304 A 133 GLU A 124 GLU~? B 88 ASP B 151 ASP~? B 89 HIS B 155 HIS~? ULMNm 3 1b66_c02 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 2 3 RMSD = 1.38 A TRANSFORM 0.5667 0.2229 0.7932 0.7876 0.1364 -0.6010 -0.2422 0.9652 -0.0982 34.304 26.206 29.304 A 133 GLU A 124 GLU~? B 88 ASP B 151 ASP~? B 89 HIS B 155 HIS~? ULMNm 3 1lci_c00 LUCIFERASE user 1 3 RMSD = 1.39 A TRANSFORM -0.5865 -0.7042 0.4002 0.5220 0.0492 0.8515 -0.6193 0.7083 0.3387 22.288 70.613 50.095 218 ARG A 144 ARG~? 245 HIS A 155 HIS~? 343 THR A 48 THR~? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 1.40 A TRANSFORM 0.6452 -0.7527 -0.1311 -0.1056 0.0821 -0.9910 0.7567 0.6532 -0.0266 48.784 73.683 -11.021 A 603 HIS B 15 HIS~? A 646 ASP B 12 ASP~? A 739 GLY B 157 GLY~? ULMNm 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 1 3 RMSD = 1.40 A TRANSFORM 0.9371 0.2130 0.2764 0.2984 -0.8997 -0.3187 0.1808 0.3811 -0.9067 -21.329 19.444 73.737 A 43 ASP A 12 ASP~? A 48 HIS A 15 HIS~? A 77 LYS A 116 LYS~? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.40 A TRANSFORM -0.8967 -0.1127 0.4280 0.1974 0.7637 0.6147 -0.3961 0.6357 -0.6626 -46.016 5.543 32.002 D 603 HIS B 15 HIS~? D 646 ASP B 12 ASP~? D 739 GLY B 157 GLY~? ULMNm 3 2odj_o00 PORIN D user 11 3 RMSD = 1.40 A TRANSFORM 0.6269 0.7696 -0.1212 -0.3102 0.3893 0.8673 0.7146 -0.5061 0.4828 -2.135 1.310 19.239 A 156 HIS B 61 HIS.? A 208 ASP B 132 ASP^? A 296 SER A 68 SER~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.40 A TRANSFORM 0.6687 -0.7397 -0.0749 -0.1021 0.0084 -0.9947 0.7365 0.6728 -0.0699 45.133 74.930 52.189 C 603 HIS B 15 HIS~? C 646 ASP B 12 ASP~? C 739 GLY B 157 GLY~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.41 A TRANSFORM -0.6121 -0.7558 0.2326 0.2779 0.0698 0.9581 -0.7404 0.6511 0.1673 35.967 39.860 18.226 A 603 HIS A 15 HIS~? A 646 ASP A 12 ASP~? A 739 GLY A 157 GLY~? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.41 A TRANSFORM -0.6451 -0.7422 0.1815 0.2751 -0.0040 0.9614 -0.7129 0.6701 0.2068 34.997 39.129 80.100 C 603 HIS A 15 HIS~? C 646 ASP A 12 ASP~? C 739 GLY A 157 GLY~? ULMNm 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 3 3 RMSD = 1.41 A TRANSFORM 0.9078 -0.2094 0.3635 0.3458 0.8640 -0.3659 -0.2374 0.4579 0.8567 28.254 -0.974 -18.232 A 271 GLN B 126 GLN~? A 296 GLU A 82 GLU.? A 383 TYR B 118 TYR~? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 12 3 RMSD = 1.41 A TRANSFORM 0.6211 -0.7824 0.0466 -0.6230 -0.4567 0.6350 -0.4755 -0.4234 -0.7711 2.248 60.352 61.183 C 137 ARG B 141 ARG~? C 141 THR B 140 THR^? C 235 ASP B 120 ASP~? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.42 A TRANSFORM -0.7593 -0.1599 0.6307 0.2274 0.8429 0.4876 -0.6097 0.5137 -0.6037 -44.878 9.042 -32.354 B 603 HIS B 15 HIS~? B 646 ASP B 12 ASP~? B 739 GLY B 157 GLY~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.42 A TRANSFORM 0.9193 -0.0876 -0.3836 -0.3812 -0.4398 -0.8132 -0.0975 0.8938 -0.4377 56.793 56.940 -2.481 199 ASP B 53 ASP~? 242 GLU B 9 GLU~? 329 ASP B 63 ASP.? ULMNm 3 1rhc_c00 F420-DEPENDENT ALCOHOL DEHYDROGENASEuser 2 3 RMSD = 1.42 A TRANSFORM -0.3731 0.9228 0.0959 0.2952 0.0200 0.9552 0.8796 0.3847 -0.2799 19.640 9.040 17.881 A 39 HIS B 61 HIS.? A 43 TRP A 86 TRP.? A 108 GLU A 82 GLU.? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 1.42 A TRANSFORM 0.9869 0.0583 -0.1508 -0.1418 0.7595 -0.6348 0.0775 0.6479 0.7578 -5.941 103.538 31.582 A 137 ARG A 144 ARG~? A 141 THR A 140 THR^? A 235 ASP A 53 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 4 3 RMSD = 1.42 A TRANSFORM -0.2214 -0.0516 -0.9738 -0.4644 0.8837 0.0587 0.8575 0.4652 -0.2196 29.029 -23.429 3.866 A 271 PRO B 64 PRO~? A 272 LEU B 54 LEU~? A 276 ARG B 144 ARG~? ULMNm 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 4 3 RMSD = 1.43 A TRANSFORM 0.2870 -0.5905 0.7543 0.4649 0.7743 0.4294 -0.8376 0.2274 0.4967 63.501 13.596 25.605 A 105 HIS B 61 HIS.? A 169 ASP A 85 ASP.? A 288 GLU A 51 GLU~? ULMNm 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 RMSD = 1.43 A TRANSFORM 0.4602 -0.5412 0.7038 0.8486 0.0351 -0.5279 0.2610 0.8402 0.4754 34.370 75.850 28.552 229 ASP A 85 ASP.? 257 GLU A 51 GLU~? 328 ASP A 151 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 1 3 RMSD = 1.44 A TRANSFORM 0.4374 -0.0236 0.8989 0.3411 0.9293 -0.1416 -0.8320 0.3686 0.4146 -9.702 -4.713 22.841 A 271 PRO A 64 PRO~? A 272 LEU A 54 LEU~? A 276 ARG A 144 ARG~? ULMNm 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 1 3 RMSD = 1.44 A TRANSFORM 0.9507 -0.2547 0.1767 -0.0997 0.2887 0.9522 -0.2935 -0.9229 0.2491 9.613 29.369 18.498 A 156 LYS A 39 LYS.? A 159 HIS A 47 HIS~? A 162 HIS A 155 HIS~? ULMNm 3 2odj_o01 PORIN D user 3 3 RMSD = 1.44 A TRANSFORM -0.7516 -0.1205 0.6485 0.4811 -0.7728 0.4140 0.4512 0.6232 0.6388 -6.434 -28.801 67.307 B 156 HIS A 61 HIS.? B 208 ASP A 132 ASP^? B 296 SER A 8 SER~? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.44 A TRANSFORM 0.6370 -0.1504 -0.7560 -0.3096 0.8483 -0.4295 0.7060 0.5077 0.4938 -40.564 51.689 -50.415 B 603 HIS A 15 HIS~? B 646 ASP A 12 ASP~? B 739 GLY A 157 GLY~? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 7 3 RMSD = 1.44 A TRANSFORM -0.8779 -0.1943 0.4376 -0.3037 0.9326 -0.1951 -0.3701 -0.3042 -0.8778 14.393 32.651 52.506 54 ASP A 120 ASP~? 158 THR A 4 THR~? 317 ASP A 12 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 14 3 RMSD = 1.45 A TRANSFORM -0.7175 -0.6219 0.3136 0.3560 -0.7144 -0.6024 0.5987 -0.3206 0.7340 47.615 106.758 23.088 A 228 ASP B 85 ASP~? A 261 ASP B 132 ASP^? A 329 ASP B 151 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 10 3 RMSD = 1.45 A TRANSFORM 0.8872 -0.3952 -0.2380 -0.1861 0.1656 -0.9685 0.4222 0.9036 0.0734 63.146 43.041 -9.871 199 ASP B 53 ASP~? 218 GLU A 73 GLU~? 329 ASP B 63 ASP.? ULMNm 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 RMSD = 1.45 A TRANSFORM 0.8653 -0.4991 0.0465 0.1757 0.2151 -0.9607 0.4695 0.8394 0.2738 -6.535 9.986 37.612 B 325 ASP A 12 ASP~? B 354 GLU A 9 GLU~? B 421 ASP A 120 ASP~? ULMNm 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 3 3 RMSD = 1.45 A TRANSFORM -0.9144 -0.2430 -0.3237 0.2517 0.2849 -0.9249 0.3169 -0.9273 -0.1993 42.748 49.280 43.687 A 156 LYS B 39 LYS.? A 159 HIS B 47 HIS~? A 162 HIS B 155 HIS~? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 8 3 RMSD = 1.46 A TRANSFORM -0.0944 -0.8575 -0.5058 -0.8019 0.3666 -0.4718 0.5900 0.3610 -0.7222 31.126 62.306 33.638 C 137 ARG B 50 ARG~? C 141 THR B 48 THR~? C 235 ASP B 78 ASP.? ULMNm 3 1cwy_c00 AMYLOMALTASE user 4 3 RMSD = 1.46 A TRANSFORM 0.3425 -0.4424 -0.8288 0.8530 -0.2234 0.4717 -0.3939 -0.8685 0.3008 -12.223 -29.834 25.005 A 293 ASP B 151 ASP~? A 340 GLU B 51 GLU~? A 395 ASP B 85 ASP~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 12 3 RMSD = 1.46 A TRANSFORM -0.9992 0.0155 -0.0357 -0.0119 0.7518 0.6593 0.0371 0.6592 -0.7510 11.798 61.261 39.311 A 137 ARG B 144 ARG~? A 141 THR B 140 THR^? A 235 ASP B 53 ASP~? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 1.47 A TRANSFORM -0.8010 0.5803 0.1472 0.5307 0.8020 -0.2740 -0.2771 -0.1413 -0.9504 1.578 57.692 59.225 C 137 ARG A 50 ARG~? C 141 THR A 72 THR~? C 235 ASP A 151 ASP~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 RMSD = 1.47 A TRANSFORM 0.4317 -0.2343 0.8711 0.8832 0.3059 -0.3555 -0.1832 0.9228 0.3389 -13.334 -18.479 6.798 A 105 ALA A 109 ALA~? A 244 ASP A 12 ASP~? A 271 HIS A 15 HIS~? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 3 3 RMSD = 1.48 A TRANSFORM -0.1071 -0.6526 0.7501 -0.9911 0.1297 -0.0287 -0.0786 -0.7465 -0.6607 41.832 21.978 74.961 412 GLU A 82 GLU.? 516 HIS A 88 HIS.? 559 HIS B 61 HIS.? ULMNm 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 1 3 RMSD = 1.48 A TRANSFORM 0.7711 0.2680 0.5776 -0.6084 0.0423 0.7925 0.1880 -0.9625 0.1957 -30.861 50.601 43.962 13 ASP A 53 ASP~? 41 HIS A 47 HIS~? 224 GLN A 55 GLN~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 7 3 RMSD = 1.48 A TRANSFORM -0.3246 0.5207 -0.7896 0.7551 0.6454 0.1151 0.5695 -0.5589 -0.6027 31.238 12.840 103.515 B 223 HIS B 61 HIS.? B 262 HIS A 87 HIS.? B 312 ASP A 85 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 3 3 RMSD = 1.48 A TRANSFORM -0.5803 0.6941 0.4260 -0.7320 -0.2154 -0.6463 -0.3569 -0.6869 0.6331 34.956 89.911 32.593 A 228 ASP A 151 ASP~? A 260 ASP A 132 ASP^? A 329 ASP A 85 ASP.? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 4 3 RMSD = 1.48 A TRANSFORM 0.6504 -0.6878 -0.3223 -0.0473 -0.4602 0.8866 -0.7581 -0.5614 -0.3318 20.457 -9.544 20.808 274 HIS B 61 HIS.? 320 HIS A 87 HIS.? 375 ASP A 85 ASP.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 RMSD = 1.49 A TRANSFORM 0.8218 0.4791 0.3083 0.2958 -0.8212 0.4880 0.4870 -0.3099 -0.8166 10.534 97.777 21.864 193 ASP A 85 ASP.? 231 ASP B 120 ASP~? 294 ASP A 81 ASP.? ULMNm 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 5 3 RMSD = 1.49 A TRANSFORM -0.6689 0.2576 -0.6973 0.7334 0.0758 -0.6756 -0.1212 -0.9633 -0.2396 -2.091 58.992 79.542 13 ASP B 53 ASP~? 41 HIS B 47 HIS~? 224 GLN B 55 GLN~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 14 3 RMSD = 1.49 A TRANSFORM -0.4949 0.8619 -0.1107 0.2047 0.2395 0.9491 0.8445 0.4470 -0.2949 -22.539 -2.573 -43.805 A 49 ASP B 81 ASP.? A 147 THR B 72 THR~? A 294 ASP B 78 ASP.? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 3 3 RMSD = 1.50 A TRANSFORM -0.2177 0.7882 -0.5756 -0.2005 0.5411 0.8167 0.9552 0.2932 0.0402 -22.577 73.735 16.463 B 197 ARG B 144 ARG~? B 201 HIS B 155 HIS~? B 204 HIS B 47 HIS~?