*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1cns_c01 CHITINASE user 5 3 RMSD = 0.94 A TRANSFORM 0.7401 -0.5146 0.4330 -0.4228 0.1447 0.8946 -0.5230 -0.8452 -0.1105 -2.722 -51.199 79.737 B 67 GLU A 124 GLU~? B 89 GLU A 93 GLU~? B 120 SER A 130 SER~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 RMSD = 0.98 A TRANSFORM -0.8666 -0.4503 0.2150 -0.1991 0.7071 0.6785 -0.4576 0.5452 -0.7024 74.939 59.395 55.299 229 ASP A 14 ASP~? 264 GLU A 191 GLU~? 328 ASP A 104 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 15 3 RMSD = 1.05 A TRANSFORM 0.8479 -0.5122 -0.1366 0.3752 0.3978 0.8373 -0.3745 -0.7612 0.5295 29.534 37.307 49.311 A 228 ASP A 109 ASP~? A 260 ASP A 119 ASP~? A 329 ASP A 14 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.07 A TRANSFORM 0.0550 0.8725 -0.4854 0.9777 -0.1458 -0.1513 -0.2028 -0.4663 -0.8611 7.032 4.897 58.166 141 ASP A 131 ASP~? 166 GLY A 39 GLY~? 169 GLU A 47 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 21 3 RMSD = 1.18 A TRANSFORM 0.7803 -0.2777 0.5604 0.4492 0.8723 -0.1931 -0.4352 0.4024 0.8054 3.640 53.781 10.736 A 228 ASP A 196 ASP~? A 260 ASP A 119 ASP~? A 329 ASP A 26 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.18 A TRANSFORM -0.3776 -0.2731 -0.8848 0.2070 0.9064 -0.3681 0.9025 -0.3222 -0.2858 91.570 29.469 7.087 199 ASP A 26 ASP~? 242 GLU A 86 GLU~? 329 ASP A 196 ASP~? ULMNm 3 1sll_c00 SIALIDASE L user 1 3 RMSD = 1.20 A TRANSFORM 0.8722 0.3882 -0.2975 -0.1799 0.8204 0.5428 0.4548 -0.4199 0.7854 7.239 -35.064 -10.001 318 ASP A 46 ASP~? 595 GLU A 143 GLU~? 713 TYR A 171 TYR~? ULMNm 3 1cns_c01 CHITINASE user 3 3 RMSD = 1.22 A TRANSFORM -0.5719 -0.6072 0.5516 -0.7655 0.6368 -0.0927 -0.2950 -0.4752 -0.8289 16.890 -12.002 100.538 B 67 GLU A 93 GLU~? B 89 GLU A 86 GLU~? B 120 SER A 130 SER~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 RMSD = 1.23 A TRANSFORM 0.1656 -0.7005 0.6942 0.9848 0.0804 -0.1538 0.0520 0.7091 0.7032 42.700 -43.215 -77.104 B 37 ASP A 95 ASP~? B 56 ILE A 89 ILE~? B 82 TYR A 126 TYR~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.25 A TRANSFORM 0.3616 0.3530 -0.8629 -0.6693 0.7426 0.0233 0.6491 0.5691 0.5048 26.349 16.194 -41.652 141 ASP A 30 ASP~? 166 GLY A 39 GLY~? 169 GLU A 44 GLU~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.26 A TRANSFORM 0.6474 -0.7540 0.1111 0.0734 0.2068 0.9756 -0.7586 -0.6235 0.1892 29.814 -18.251 -40.214 D 465 GLY A 159 GLY~? D 501 ASP A 60 ASP~? E 367 TYR A 132 TYR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.27 A TRANSFORM 0.3120 -0.6629 -0.6807 -0.5362 0.4686 -0.7021 0.7843 0.5840 -0.2092 70.891 68.396 -23.486 A 465 GLY A 159 GLY~? A 501 ASP A 60 ASP~? B 367 TYR A 132 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 RMSD = 1.27 A TRANSFORM 0.1734 -0.6974 0.6954 0.9846 0.1078 -0.1375 0.0209 0.7086 0.7053 39.485 -28.062 -48.658 A 37 ASP A 95 ASP~? A 56 ILE A 89 ILE~? A 82 TYR A 126 TYR~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.28 A TRANSFORM -0.2027 0.9373 -0.2834 -0.5342 -0.3484 -0.7702 -0.8207 -0.0047 0.5714 63.757 73.129 -16.045 A 67 ASP A 55 ASP~? A 68 ALA A 67 ALA~? A 72 LEU A 71 LEU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 RMSD = 1.32 A TRANSFORM 0.4065 0.3768 -0.8323 0.5382 -0.8349 -0.1152 -0.7384 -0.4011 -0.5422 57.066 48.666 58.768 199 ASP A 119 ASP~? 242 GLU A 86 GLU~? 329 ASP A 104 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 3 3 RMSD = 1.32 A TRANSFORM -0.0064 0.8552 0.5182 -0.9912 0.0630 -0.1161 -0.1319 -0.5144 0.8473 1.780 96.629 28.016 A 228 ASP A 14 ASP~? A 260 ASP A 194 ASP~? A 329 ASP A 104 ASP.? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 RMSD = 1.34 A TRANSFORM -0.2443 0.5520 0.7973 0.6549 -0.5125 0.5554 0.7152 0.6578 -0.2363 19.015 44.761 98.202 A 40 LYS A 15 LYS~? A 41 LYS A 16 LYS~? A 42 ILE A 18 ILE~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.34 A TRANSFORM 0.8620 0.4998 0.0844 -0.3121 0.6547 -0.6884 -0.3993 0.5671 0.7204 -7.445 89.700 26.908 A 241 ASP A 55 ASP~? A 279 GLU A 44 GLU~? A 369 ASP A 60 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 1 3 RMSD = 1.35 A TRANSFORM -0.7199 0.5958 -0.3560 -0.6912 -0.5688 0.4458 0.0632 0.5670 0.8213 39.984 94.112 -1.052 A 228 ASP A 14 ASP~? A 261 ASP A 120 ASP~? A 329 ASP A 109 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.36 A TRANSFORM -0.2358 0.4206 0.8760 -0.9656 0.0006 -0.2602 -0.1100 -0.9072 0.4060 -54.054 44.634 -6.219 141 ASP A 76 ASP~? 166 GLY A 39 GLY~? 169 GLU A 33 GLU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.36 A TRANSFORM -0.0822 -0.3232 0.9428 -0.0453 0.9462 0.3204 -0.9956 -0.0164 -0.0924 -18.539 5.662 33.328 199 ASP A 55 ASP~? 242 GLU A 81 GLU~? 329 ASP A 60 ASP~? ULMNm 3 1euu_c00 SIALIDASE user 1 3 RMSD = 1.36 A TRANSFORM 0.4287 -0.2057 -0.8797 0.3847 0.9226 -0.0283 0.8175 -0.3263 0.4746 56.626 -31.409 -7.962 92 ASP A 46 ASP~? 260 GLU A 143 GLU~? 370 TYR A 171 TYR~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 3 3 RMSD = 1.39 A TRANSFORM 0.8190 0.5615 0.1180 0.4138 -0.4358 -0.7993 -0.3974 0.7035 -0.5893 -15.547 98.530 58.468 B 1 SER A 142 SER~? B 69 ALA A 166 ALA~? B 241 ASN A 170 ASN~? ULMNm 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.39 A TRANSFORM -0.8727 0.3628 -0.3269 -0.4304 -0.8876 0.1640 -0.2307 0.2838 0.9307 65.018 17.015 -16.168 B 169 TYR A 132 TYR~? B 172 HIS A 129 HIS~? B 174 TYR A 181 TYR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.40 A TRANSFORM -0.1074 0.3779 0.9196 0.2290 0.9095 -0.3470 -0.9675 0.1733 -0.1842 28.816 14.482 39.801 199 ASP A 14 ASP~? 218 GLU A 33 GLU~? 329 ASP A 104 ASP.? ULMNm 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.40 A TRANSFORM 0.7284 -0.5186 0.4477 -0.6243 -0.2334 0.7455 -0.2821 -0.8225 -0.4938 5.505 -4.321 44.868 A 169 TYR A 132 TYR~? A 172 HIS A 129 HIS~? A 174 TYR A 181 TYR~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 5 3 RMSD = 1.41 A TRANSFORM -0.8273 -0.0886 -0.5548 -0.2086 0.9653 0.1568 0.5216 0.2455 -0.8171 68.821 57.203 36.347 A 228 ASP A 26 ASP~? A 260 ASP A 104 ASP.? A 329 ASP A 196 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 4 3 RMSD = 1.41 A TRANSFORM -0.5726 0.6684 -0.4748 -0.7484 -0.6625 -0.0302 -0.3347 0.3381 0.8796 36.545 105.418 13.564 A 228 ASP A 14 ASP~? A 260 ASP A 194 ASP~? A 329 ASP A 109 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.41 A TRANSFORM -0.5553 0.6289 -0.5442 0.7945 0.5946 -0.1235 0.2459 -0.5010 -0.8298 23.972 -2.358 47.929 141 ASP A 179 ASP~? 166 GLY A 39 GLY~? 169 GLU A 44 GLU~? ULMNm 3 1cns_c00 CHITINASE user 2 3 RMSD = 1.41 A TRANSFORM -0.3823 -0.0817 -0.9204 -0.2779 0.9601 0.0302 0.8813 0.2674 -0.3897 19.118 -13.905 64.035 A 67 GLU A 124 GLU~? A 89 GLU A 93 GLU~? A 120 SER A 130 SER~? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 RMSD = 1.42 A TRANSFORM -0.8126 0.0105 -0.5827 -0.1244 -0.9799 0.1558 -0.5694 0.1991 0.7976 63.926 128.696 4.579 193 ASP A 104 ASP.? 219 GLU A 17 GLU~? 294 ASP A 14 ASP~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 RMSD = 1.43 A TRANSFORM -0.6568 -0.3810 0.6507 -0.3746 0.9138 0.1569 -0.6544 -0.1407 -0.7430 -13.614 12.775 90.693 B 1 SER A 142 SER~? B 69 ALA A 139 ALA~? B 241 ASN A 170 ASN~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 RMSD = 1.46 A TRANSFORM 0.6203 -0.7224 0.3056 0.1551 -0.2689 -0.9506 0.7688 0.6371 -0.0548 54.500 54.310 -19.144 199 ASP A 109 ASP~? 218 GLU A 32 GLU~? 329 ASP A 14 ASP~? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 10 3 RMSD = 1.46 A TRANSFORM 0.0759 -0.4454 -0.8921 -0.8874 -0.4382 0.1432 -0.4547 0.7808 -0.4285 108.010 67.928 136.565 A 40 LYS A 163 LYS~? A 41 LYS A 165 LYS~? A 42 ILE A 167 ILE~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 17 3 RMSD = 1.46 A TRANSFORM 0.8343 -0.4590 0.3055 -0.3943 -0.1095 0.9124 -0.3854 -0.8816 -0.2724 21.433 67.518 65.461 A 228 ASP A 109 ASP~? A 260 ASP A 194 ASP~? A 329 ASP A 14 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 4 3 RMSD = 1.46 A TRANSFORM -0.5053 -0.0706 0.8601 -0.1495 -0.9744 -0.1678 0.8499 -0.2134 0.4818 5.708 62.217 -32.890 199 ASP A 77 ASP~? 242 GLU A 32 GLU~? 329 ASP A 70 ASP~? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 RMSD = 1.46 A TRANSFORM 0.1063 0.1372 0.9848 0.9503 0.2774 -0.1412 -0.2925 0.9509 -0.1009 70.684 36.669 20.322 B 55 ASP A 30 ASP~? B 58 ASP A 31 ASP~? B 424 GLU A 33 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 11 3 RMSD = 1.47 A TRANSFORM 0.3298 -0.7096 -0.6226 -0.4623 -0.6965 0.5489 -0.8231 0.1068 -0.5577 55.135 88.387 58.878 A 228 ASP A 104 ASP.? A 260 ASP A 194 ASP~? A 329 ASP A 14 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 12 3 RMSD = 1.47 A TRANSFORM -0.7547 -0.5982 -0.2694 -0.1844 0.5875 -0.7880 0.6296 -0.5450 -0.5537 49.288 35.501 92.127 A 241 ASP A 109 ASP~? A 265 GLU A 191 GLU~? A 369 ASP A 14 ASP~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 RMSD = 1.48 A TRANSFORM 0.1100 0.4721 -0.8746 0.6994 -0.6620 -0.2694 -0.7062 -0.5821 -0.4031 57.215 80.213 79.057 179 ASP A 70 ASP~? 214 ASP A 179 ASP~? 289 ASP A 77 ASP~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.48 A TRANSFORM -0.5615 -0.1317 -0.8169 0.7916 -0.3729 -0.4840 -0.2409 -0.9185 0.3136 81.351 62.370 70.811 A 241 ASP A 70 ASP~? A 279 GLU A 83 GLU~? A 369 ASP A 55 ASP~?