*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 RMSD = 1.08 A TRANSFORM -0.7264 -0.3114 0.6127 0.0886 0.8416 0.5328 -0.6816 0.4413 -0.5837 86.770 18.465 57.829 C 95 ASP A 63 ASP^? C 117 GLU A 82 GLU^? C 131 GLU A 54 GLU^? ULMNm 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 RMSD = 1.27 A TRANSFORM 0.0768 -0.0287 0.9966 0.7153 0.6979 -0.0350 -0.6945 0.7156 0.0742 25.539 105.189 -32.636 A 85 GLU A 54 GLU^? A 87 ASP A 63 ASP^? A 89 GLU A 73 GLU^? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 RMSD = 1.27 A TRANSFORM 0.3668 -0.0745 0.9273 0.5829 0.7953 -0.1667 -0.7251 0.6017 0.3351 9.820 65.047 -11.366 193 ASP A 121 ASP^? 219 GLU A 123 GLU^? 294 ASP A 142 ASP^? ULMNm 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 RMSD = 1.27 A TRANSFORM -0.6274 0.2497 -0.7376 -0.7433 -0.4744 0.4717 -0.2321 0.8442 0.4832 34.480 50.430 -202.097 A1290 LYS A 71 LYS^? A1294 ASN A 84 ASN^? A1297 GLU A 116 GLU.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.28 A TRANSFORM 0.9854 -0.0289 0.1679 -0.0291 0.9425 0.3330 -0.1679 -0.3330 0.9279 6.971 -22.671 -12.127 A 465 GLY A 78 GLY.? A 501 ASP A 21 ASP.? B 367 TYR A 102 TYR~? ULMNm 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 RMSD = 1.29 A TRANSFORM 0.4211 0.3148 0.8506 0.6855 0.5037 -0.5257 -0.5940 0.8045 -0.0037 5.889 153.013 -24.944 B 85 GLU A 54 GLU^? B 87 ASP A 63 ASP^? B 89 GLU A 73 GLU^? ULMNm 3 1cwy_c00 AMYLOMALTASE user 3 3 RMSD = 1.29 A TRANSFORM 0.7138 -0.3593 -0.6012 -0.2468 -0.9323 0.2642 -0.6554 -0.0403 -0.7542 -28.147 11.834 29.858 A 293 ASP A 121 ASP^? A 340 GLU A 123 GLU^? A 395 ASP A 142 ASP^? ULMNm 3 2ayh_c00 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROuser 1 3 RMSD = 1.29 A TRANSFORM -0.2963 0.9525 0.0707 0.4081 0.0593 0.9110 0.8636 0.2988 -0.4062 -20.211 10.500 -7.422 105 GLU A 54 GLU^? 107 ASP A 63 ASP^? 109 GLU A 73 GLU^? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.30 A TRANSFORM -0.6727 -0.7210 -0.1660 0.7399 -0.6547 -0.1547 0.0029 -0.2269 0.9739 70.877 60.030 36.189 B 1 SER A 127 SER.? B 69 ALA A 110 ALA.? B 241 ASN A 128 ASN.? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 RMSD = 1.32 A TRANSFORM 0.5860 0.7707 -0.2501 0.3530 0.0349 0.9350 0.7293 -0.6362 -0.2516 18.205 81.648 62.603 229 ASP A 22 ASP.? 264 GLU A 82 GLU^? 328 ASP A 56 ASP^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.34 A TRANSFORM 0.6322 -0.7665 -0.1131 -0.7443 -0.5602 -0.3635 0.2153 0.3140 -0.9247 61.187 88.340 -52.955 D 465 GLY A 78 GLY.? D 501 ASP A 21 ASP.? E 367 TYR A 102 TYR~? ULMNm 3 1kqc_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 4 3 RMSD = 1.34 A TRANSFORM -0.4017 -0.6729 -0.6212 -0.5164 0.7266 -0.4531 0.7563 0.1388 -0.6393 63.934 -23.744 42.029 A 14 LYS A 71 LYS^? A 74 LYS A 86 LYS.? A 165 GLU A 123 GLU^? ULMNm 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 2 3 RMSD = 1.35 A TRANSFORM -0.4294 -0.7590 -0.4895 -0.6446 0.6372 -0.4225 0.6325 0.1341 -0.7628 58.718 155.987 -3.640 B 85 GLU A 73 GLU^? B 87 ASP A 63 ASP^? B 89 GLU A 54 GLU^? ULMNm 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 2 3 RMSD = 1.38 A TRANSFORM -0.1079 -0.9804 -0.1647 -0.6736 0.1939 -0.7132 0.7312 0.0340 -0.6813 68.577 136.568 -12.174 A 85 GLU A 73 GLU^? A 87 ASP A 63 ASP^? A 89 GLU A 54 GLU^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 RMSD = 1.38 A TRANSFORM 0.2413 0.8547 0.4596 0.9646 -0.2633 -0.0167 0.1067 0.4474 -0.8880 -25.449 21.507 -42.539 A 49 ASP A 22 ASP.? A 147 THR A 55 THR^? A 294 ASP A 63 ASP^? ULMNm 3 1ga8_c00 GALACTOSYL TRANSFERASE LGTC user 1 3 RMSD = 1.38 A TRANSFORM 0.7311 0.6727 0.1141 0.6820 -0.7154 -0.1518 -0.0205 0.1887 -0.9818 -13.936 83.658 88.173 A 130 ASP A 135 ASP^? A 153 ASN A 139 ASN.? A 189 GLN A 137 GLN.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.38 A TRANSFORM -0.7871 0.1274 -0.6035 0.3429 0.9037 -0.2565 0.5127 -0.4089 -0.7550 27.967 -7.076 50.019 A 316 ALA A 20 ALA.? A 317 GLY A 0 GLY.? A 318 ASP A 22 ASP.? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.39 A TRANSFORM -0.5753 -0.2787 -0.7690 0.7513 0.1915 -0.6315 0.3233 -0.9411 0.0992 66.730 33.031 48.573 A 55 ASP A 21 ASP.? A 58 ASP A 22 ASP.? A 424 GLU A 54 GLU^? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 RMSD = 1.41 A TRANSFORM 0.2796 -0.7524 0.5964 0.3637 0.6579 0.6595 -0.8886 0.0326 0.4576 38.605 9.588 106.592 A 270 ASN A 139 ASN.? A 384 ASN A 84 ASN^? A 385 GLU A 82 GLU^? ULMNm 3 1mas_c00 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 1 3 RMSD = 1.44 A TRANSFORM 0.9682 0.1381 0.2084 0.2038 0.0467 -0.9779 -0.1448 0.9893 0.0171 -20.830 -23.883 -42.850 A 10 ASP A 70 ASP.? A 168 ASN A 46 ASN.? A 241 HIS A 42 HIS~? ULMNm 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 RMSD = 1.44 A TRANSFORM 0.9964 -0.0789 0.0311 -0.0708 -0.5712 0.8178 -0.0468 -0.8170 -0.5747 -7.660 76.184 77.642 179 ASP A 121 ASP^? 204 GLU A 123 GLU^? 289 ASP A 142 ASP^? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.45 A TRANSFORM 0.6010 -0.6905 -0.4026 -0.0286 -0.5219 0.8525 -0.7988 -0.5008 -0.3334 28.480 82.225 175.894 A 1 ALA A 110 ALA.? A 74 ASN A 128 ASN.? A 75 GLY A 129 GLY.? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.45 A TRANSFORM -0.3308 0.7015 -0.6313 0.6121 -0.3496 -0.7093 -0.7182 -0.6211 -0.3138 -7.719 29.467 94.404 C 1 ALA A 110 ALA.? C 74 ASN A 128 ASN.? C 75 GLY A 129 GLY.? ULMNm 3 2ayh_c00 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROuser 2 3 RMSD = 1.45 A TRANSFORM 0.3563 0.0911 -0.9299 -0.4357 -0.8642 -0.2516 -0.8266 0.4948 -0.2682 13.277 56.689 -4.771 105 GLU A 73 GLU^? 107 ASP A 63 ASP^? 109 GLU A 54 GLU^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.45 A TRANSFORM 0.0974 -0.1358 0.9859 -0.8989 0.4132 0.1457 -0.4271 -0.9005 -0.0818 148.787 11.521 26.453 A 316 ALA A 20 ALA.? A 317 GLY A 0 GLY.? A 318 ASP A 22 ASP.? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 RMSD = 1.46 A TRANSFORM -0.4169 -0.5134 0.7501 -0.5253 0.8095 0.2621 -0.7418 -0.2848 -0.6072 48.649 77.843 23.487 193 ASP A 22 ASP.? 219 GLU A 54 GLU^? 294 ASP A 56 ASP^? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.46 A TRANSFORM 0.0252 -0.9924 0.1206 -0.9993 -0.0217 0.0302 -0.0274 -0.1213 -0.9922 94.149 40.622 48.326 B 1 ALA A 110 ALA.? B 74 ASN A 128 ASN.? B 75 GLY A 129 GLY.? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.47 A TRANSFORM -0.8962 0.4223 -0.1359 0.4419 0.8763 -0.1916 0.0382 -0.2318 -0.9720 -13.577 -17.043 141.750 D 1 ALA A 110 ALA.? D 74 ASN A 128 ASN.? D 75 GLY A 129 GLY.? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.47 A TRANSFORM -0.5698 0.4231 0.7045 -0.8218 -0.3025 -0.4829 0.0088 -0.8541 0.5201 106.717 73.810 49.693 B 55 ASP A 21 ASP.? B 58 ASP A 22 ASP.? B 424 GLU A 54 GLU^? ULMNm 3 1m53_c03 ISOMALTULOSE SYNTHASE user 5 3 RMSD = 1.47 A TRANSFORM 0.3175 0.6138 -0.7228 -0.6271 0.7077 0.3254 0.7113 0.3499 0.6096 -4.671 6.918 45.843 A 241 ASP A 121 ASP^? A 295 GLU A 123 GLU^? A 369 ASP A 142 ASP^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 RMSD = 1.47 A TRANSFORM 0.1846 0.4260 0.8857 -0.3952 -0.7929 0.4638 0.8999 -0.4356 0.0220 -12.089 94.275 42.434 179 ASP A 22 ASP.? 214 ASP A 144 ASP^? 289 ASP A 56 ASP^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.48 A TRANSFORM 0.0763 -0.8352 -0.5446 -0.9970 -0.0719 -0.0294 -0.0145 0.5452 -0.8382 41.065 -13.791 -65.944 B 250 ALA A 20 ALA.? B 251 GLY A 0 GLY.? B 252 ASP A 22 ASP.? ULMNm 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.48 A TRANSFORM 0.8522 -0.4380 0.2862 0.4303 0.8979 0.0927 -0.2976 0.0441 0.9537 54.698 -10.370 -1.951 199 ASP A 121 ASP^? 255 GLU A 123 GLU^? 329 ASP A 142 ASP^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.48 A TRANSFORM 0.9348 -0.3012 0.1880 0.1447 0.8068 0.5729 -0.3243 -0.5083 0.7978 30.073 -41.551 14.745 A 250 ALA A 20 ALA.? A 251 GLY A 0 GLY.? A 252 ASP A 22 ASP.? ULMNm 3 1mas_c01 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 1 3 RMSD = 1.50 A TRANSFORM -0.1684 -0.0660 -0.9835 0.9669 0.1830 -0.1778 0.1917 -0.9809 0.0330 -11.104 -30.202 101.180 B 10 ASP A 70 ASP.? B 168 ASN A 46 ASN.? B 241 HIS A 42 HIS~?