*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.05 A TRANSFORM -0.9928 0.1117 0.0423 0.0469 0.6906 -0.7217 -0.1098 -0.7145 -0.6909 -8.817 23.591 61.701 A 99 ARG A 70 ARG~? A 101 ASP A 157 ASP~? A 132 ASP A 153 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.06 A TRANSFORM 0.9901 -0.1215 -0.0706 -0.0508 -0.7779 0.6263 -0.1310 -0.6165 -0.7764 33.250 8.585 61.977 B 99 ARG A 70 ARG~? B 101 ASP A 157 ASP~? B 132 ASP A 153 ASP~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.07 A TRANSFORM -0.9942 0.0986 0.0431 0.0393 0.7055 -0.7076 -0.1001 -0.7018 -0.7053 -8.540 22.402 62.050 A 99 ARG A 70 ARG~? A 101 ASP A 157 ASP~? A 132 ASP A 153 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.10 A TRANSFORM 0.7113 0.0883 -0.6973 -0.3564 -0.8098 -0.4661 -0.6058 0.5801 -0.5445 52.742 20.498 -56.918 B 250 ALA A 155 ALA~? B 251 GLY A 152 GLY~? B 252 ASP A 153 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.11 A TRANSFORM -0.5335 -0.2986 -0.7913 -0.6917 0.6925 0.2051 0.4868 0.6568 -0.5760 62.115 -21.230 48.622 A 316 ALA A 155 ALA~? A 317 GLY A 152 GLY~? A 318 ASP A 153 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 1.12 A TRANSFORM 0.2944 -0.4630 0.8360 -0.7261 -0.6772 -0.1193 0.6214 -0.5719 -0.5355 131.721 36.435 48.488 A 316 ALA A 155 ALA~? A 317 GLY A 152 GLY~? A 318 ASP A 153 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.13 A TRANSFORM 0.6823 0.5682 0.4600 -0.5903 0.0570 0.8051 0.4313 -0.8209 0.3743 -2.088 -60.506 17.680 A 250 ALA A 155 ALA~? A 251 GLY A 152 GLY~? A 252 ASP A 153 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 3 3 RMSD = 1.21 A TRANSFORM -0.6904 0.5573 -0.4612 -0.2209 0.4446 0.8680 0.6888 0.7012 -0.1838 15.142 -32.400 33.528 A 316 ALA A 155 ALA~? A 317 GLY A 152 GLY~? A 318 ASP A 154 ASP~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.24 A TRANSFORM -0.2421 -0.7163 0.6545 -0.8643 -0.1474 -0.4810 0.4410 -0.6821 -0.5834 7.466 62.740 62.535 B 317 GLU A 125 GLU.? B 319 ASP A 126 ASP.? B 359 ARG A 128 ARG.? ULMNm 3 1knp_c00 L-ASPARTATE OXIDASE user 2 3 RMSD = 1.24 A TRANSFORM -0.8511 -0.3390 0.4009 -0.3111 0.9407 0.1349 -0.4229 -0.0099 -0.9061 63.860 14.426 156.372 A 290 ARG A 171 ARG~? A 351 HIS A 66 HIS.? A 386 LEU A 167 LEU~? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.26 A TRANSFORM -0.6022 0.7732 -0.1988 -0.7857 -0.5299 0.3193 0.1415 0.3484 0.9266 27.245 39.317 -23.711 A 55 ASP A 153 ASP~? A 58 ASP A 157 ASP~? A 424 GLU A 74 GLU~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.27 A TRANSFORM -0.8913 0.3418 0.2978 -0.4509 -0.6000 -0.6608 -0.0472 -0.7233 0.6889 -11.357 124.346 132.092 A 1 ALA A 109 ALA~? A 74 ASN A 113 ASN~? A 75 GLY A 114 GLY.? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.27 A TRANSFORM -0.6871 0.6772 0.2632 -0.5889 -0.3068 -0.7477 -0.4256 -0.6688 0.6096 -28.788 115.705 137.136 A 1 ALA A 110 ALA~? A 74 ASN A 113 ASN~? A 75 GLY A 114 GLY.? ULMNm 3 1cns_c00 CHITINASE user 1 3 RMSD = 1.28 A TRANSFORM -0.0716 0.4629 -0.8835 -0.0732 0.8810 0.4675 0.9947 0.0982 -0.0291 -18.840 -47.520 38.866 A 67 GLU A 183 GLU~? A 89 GLU A 186 GLU.? A 120 SER A 105 SER~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.29 A TRANSFORM -0.9990 -0.0391 -0.0202 0.0311 -0.9511 0.3072 -0.0312 0.3063 0.9514 60.367 44.725 -21.583 B 1 ALA A 110 ALA~? B 74 ASN A 113 ASN~? B 75 GLY A 114 GLY.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.30 A TRANSFORM 0.0899 -0.5511 0.8296 0.6747 -0.5790 -0.4577 0.7326 0.6009 0.3198 0.303 18.350 91.848 C 70 ALA A 109 ALA~? C 126 LEU A 184 LEU~? C 158 GLU A 183 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.31 A TRANSFORM 0.5511 -0.2164 -0.8059 -0.3627 0.8076 -0.4649 0.7515 0.5485 0.3666 -11.088 -7.681 93.294 B 70 ALA A 109 ALA~? B 126 LEU A 184 LEU~? B 158 GLU A 183 GLU~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.32 A TRANSFORM 0.7728 -0.0970 0.6272 -0.3241 0.7894 0.5214 -0.5457 -0.6062 0.5786 -17.855 -33.496 51.659 C 1 ALA A 110 ALA~? C 74 ASN A 113 ASN~? C 75 GLY A 114 GLY.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.32 A TRANSFORM -0.5619 0.8272 0.0093 -0.2341 -0.1697 0.9573 0.7934 0.5357 0.2890 -29.058 14.569 93.333 A 70 ALA A 109 ALA~? A 126 LEU A 184 LEU~? A 158 GLU A 183 GLU~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.32 A TRANSFORM -0.8802 -0.4654 0.0931 0.4664 -0.8118 0.3513 -0.0879 0.3526 0.9316 74.877 30.902 -21.965 B 1 ALA A 109 ALA~? B 74 ASN A 113 ASN~? B 75 GLY A 114 GLY.? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.32 A TRANSFORM 0.4207 -0.5893 -0.6897 -0.8854 -0.1012 -0.4536 0.1976 0.8015 -0.5644 38.822 60.865 15.520 A 317 GLU A 125 GLU.? A 319 ASP A 126 ASP.? A 359 ARG A 128 ARG.? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.32 A TRANSFORM 0.4771 -0.8009 0.3619 0.8672 0.4959 -0.0459 -0.1427 0.3357 0.9311 -0.601 5.526 68.965 D 1 ALA A 110 ALA~? D 74 ASN A 113 ASN~? D 75 GLY A 114 GLY.? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.36 A TRANSFORM 0.7802 0.3018 0.5480 -0.5955 0.6268 0.5026 -0.1918 -0.7184 0.6687 -33.741 -21.321 49.293 C 1 ALA A 109 ALA~? C 74 ASN A 113 ASN~? C 75 GLY A 114 GLY.? ULMNm 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.36 A TRANSFORM -0.2470 -0.7863 0.5663 0.5850 0.3449 0.7340 -0.7725 0.5126 0.3748 102.889 3.950 24.970 G 386 ARG A 96 ARG^? G 387 HIS A 94 HIS^? G 390 SER A 38 SER^? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.37 A TRANSFORM 0.7364 -0.0047 -0.6765 -0.2908 0.9007 -0.3229 0.6108 0.4345 0.6619 151.808 36.479 -8.526 B 55 ASP A 153 ASP~? B 58 ASP A 157 ASP~? B 424 GLU A 74 GLU~? ULMNm 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 RMSD = 1.39 A TRANSFORM -0.8413 -0.4591 -0.2854 0.5354 -0.6345 -0.5575 0.0748 -0.6218 0.7796 34.186 76.734 -22.354 A 396 ARG A 149 ARG^? A 581 ARG A 78 ARG~? A 713 ARG A 70 ARG~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.41 A TRANSFORM 0.8013 -0.4815 0.3552 0.5613 0.8105 -0.1675 -0.2073 0.3336 0.9197 -19.629 -0.967 70.695 D 1 ALA A 109 ALA~? D 74 ASN A 113 ASN~? D 75 GLY A 114 GLY.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.41 A TRANSFORM 0.0801 -0.9836 0.1619 -0.9809 -0.1066 -0.1624 0.1770 -0.1458 -0.9734 175.294 13.947 44.259 A 316 ALA A 155 ALA~? A 317 GLY A 152 GLY~? A 318 ASP A 154 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.44 A TRANSFORM -0.5199 0.1242 -0.8452 -0.0068 0.9887 0.1495 0.8542 0.0835 -0.5132 35.669 -24.804 11.774 A 99 ARG A 27 ARG~? A 101 ASP A 175 ASP~? A 132 ASP A 18 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.46 A TRANSFORM 0.5851 0.3347 -0.7387 -0.7729 -0.0458 -0.6329 -0.2456 0.9412 0.2319 43.339 -6.461 -96.614 B 250 ALA A 155 ALA~? B 251 GLY A 152 GLY~? B 252 ASP A 154 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.47 A TRANSFORM 0.5417 -0.1079 0.8336 0.1210 -0.9714 -0.2043 0.8318 0.2116 -0.5132 -13.242 49.702 7.587 B 99 ARG A 27 ARG~? B 101 ASP A 175 ASP~? B 132 ASP A 18 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 2 3 RMSD = 1.48 A TRANSFORM 0.7252 -0.1584 0.6701 0.6239 -0.2607 -0.7368 0.2914 0.9523 -0.0902 -5.559 43.997 -5.396 A 271 PRO A 142 PRO^? A 272 LEU A 143 LEU^? A 276 ARG A 149 ARG^? ULMNm 3 1bbs_c07 RENIN user 1 3 RMSD = 1.50 A TRANSFORM 0.8405 -0.4793 -0.2525 0.5120 0.8552 0.0808 0.1772 -0.1972 0.9642 79.817 -1.505 58.891 32 ASP A 175 ASP~? 35 SER A 178 SER~? 215 ASP A 18 ASP~? ULMNm 3 1bbs_c06 RENIN user 1 3 RMSD = 1.50 A TRANSFORM 0.8405 -0.4793 -0.2525 0.5120 0.8552 0.0808 0.1772 -0.1972 0.9642 79.817 -1.505 58.891 32 ASP A 175 ASP~? 35 SER A 178 SER~? 215 ASP A 18 ASP~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.50 A TRANSFORM -0.8228 0.5345 -0.1931 0.2645 0.0594 -0.9626 -0.5030 -0.8431 -0.1903 -3.832 92.649 175.895 A 1 ALA A 110 ALA~? A 74 ASN A 113 ASN~? A 75 GLY A 173 GLY~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.50 A TRANSFORM 0.9169 -0.1989 0.3461 -0.3965 -0.3542 0.8469 -0.0459 -0.9138 -0.4036 33.781 -44.167 46.010 A 250 ALA A 155 ALA~? A 251 GLY A 152 GLY~? A 252 ASP A 154 ASP~?