*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 RMSD = 0.69 A TRANSFORM 0.3227 0.1686 0.9314 -0.9043 0.3455 0.2508 0.2796 0.9231 -0.2639 -51.983 -44.117 -29.488 A 37 ASP A 133 ASP~? A 56 ILE A 162 ILE~? A 82 TYR A 158 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 RMSD = 0.74 A TRANSFORM 0.3284 0.1703 0.9290 -0.9104 0.3190 0.2634 0.2516 0.9323 -0.2598 -48.993 -60.336 -57.924 B 37 ASP A 133 ASP~? B 56 ILE A 162 ILE~? B 82 TYR A 158 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 RMSD = 0.79 A TRANSFORM 0.4775 0.1481 0.8660 -0.5543 0.8156 0.1662 0.6817 0.5594 -0.4715 -46.141 -66.090 7.442 A 37 ASP A 129 ASP~? A 56 ILE A 162 ILE~? A 82 TYR A 158 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 RMSD = 0.80 A TRANSFORM 0.4815 0.1431 0.8647 -0.5711 0.7996 0.1857 0.6649 0.5832 -0.4667 -42.853 -83.478 -22.024 B 37 ASP A 129 ASP~? B 56 ILE A 162 ILE~? B 82 TYR A 158 TYR~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 0.94 A TRANSFORM 0.9855 -0.1451 -0.0879 -0.0566 -0.7696 0.6360 0.1599 0.6218 0.7667 38.112 -125.948 -256.702 A 420 ALA A 163 ALA~? B 182 GLY A 35 GLY.? B 183 GLY A 34 GLY~? ULMNm 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 0.95 A TRANSFORM -0.1503 0.9773 0.1495 0.0709 -0.1402 0.9876 -0.9861 -0.1590 0.0482 -47.492 -32.896 26.512 179 ASP A 142 ASP.? 204 GLU A 141 GLU.? 289 ASP A 140 ASP.? ULMNm 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 RMSD = 0.95 A TRANSFORM 0.1200 0.4728 0.8730 0.9412 0.2255 -0.2515 0.3157 -0.8519 0.4179 -37.328 75.463 61.116 C 95 ASP A 143 ASP.? C 117 GLU A 147 GLU~? C 131 GLU A 141 GLU.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 0.99 A TRANSFORM -0.9692 -0.0018 0.2462 0.2364 -0.2860 0.9286 -0.0687 -0.9582 -0.2776 11.147 -59.074 130.460 A 316 ALA A 127 ALA~? A 317 GLY A 125 GLY~? A 318 ASP A 129 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.00 A TRANSFORM -0.6309 0.2986 0.7161 -0.3057 0.7526 -0.5832 0.7131 0.5868 0.3836 -50.266 -71.677 -216.917 A 420 ALA A 103 ALA~? B 182 GLY A 109 GLY~? B 183 GLY A 30 GLY~? ULMNm 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.01 A TRANSFORM 0.0021 0.3912 -0.9203 0.8210 -0.5261 -0.2218 0.5709 0.7551 0.3223 95.912 80.825 24.624 A 241 ASP A 142 ASP.? A 295 GLU A 141 GLU.? A 369 ASP A 140 ASP.? ULMNm 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.02 A TRANSFORM -0.2640 0.7872 0.5573 0.7101 0.5497 -0.4400 0.6527 -0.2796 0.7042 -34.711 66.699 -47.400 199 ASP A 142 ASP.? 255 GLU A 141 GLU.? 329 ASP A 140 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.10 A TRANSFORM 0.6272 0.7179 -0.3021 -0.6097 0.6939 0.3832 -0.4847 0.0561 -0.8729 125.548 -58.811 89.141 A 316 ALA A 127 ALA~? A 317 GLY A 125 GLY~? A 318 ASP A 129 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.12 A TRANSFORM -0.3313 -0.5866 -0.7390 -0.8362 0.5454 -0.0581 -0.4371 -0.5987 0.6712 133.539 -41.734 -77.742 B 250 ALA A 127 ALA~? B 251 GLY A 125 GLY~? B 252 ASP A 129 ASP~? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.14 A TRANSFORM -0.5703 -0.5206 0.6354 0.4142 -0.8503 -0.3249 -0.7094 -0.0779 -0.7005 -91.399 66.759 92.960 B 603 HIS A 5 HIS~? B 646 ASP A 7 ASP~? B 739 GLY A 18 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.14 A TRANSFORM -0.0431 -0.4168 -0.9080 -0.9968 -0.0431 0.0670 0.0670 -0.9080 0.4136 148.554 -61.386 -112.039 A 183 GLY A 122 GLY~? B 419 GLY A 125 GLY~? B 420 ALA A 127 ALA~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.14 A TRANSFORM 0.8424 -0.4268 -0.3289 0.5200 0.4839 0.7038 0.1413 0.7639 -0.6296 79.280 -125.338 13.878 A 250 ALA A 127 ALA~? A 251 GLY A 125 GLY~? A 252 ASP A 129 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.16 A TRANSFORM -0.6011 -0.4768 0.6414 0.3475 -0.8786 -0.3275 -0.7197 -0.0261 -0.6938 -65.646 69.411 128.582 A 603 HIS A 5 HIS~? A 646 ASP A 7 ASP~? A 739 GLY A 18 GLY.? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.16 A TRANSFORM 0.5073 -0.1156 0.8540 -0.3654 0.8686 0.3347 0.7804 0.4819 -0.3984 -102.002 -75.785 21.851 C 603 HIS A 5 HIS~? C 646 ASP A 7 ASP~? C 739 GLY A 18 GLY.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 21 3 RMSD = 1.17 A TRANSFORM -0.4289 0.1610 -0.8889 -0.7259 0.5243 0.4452 -0.5377 -0.8362 0.1080 98.522 -34.639 99.755 A 241 ASP A 140 ASP.? A 265 GLU A 150 GLU~? A 369 ASP A 142 ASP.? ULMNm 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.19 A TRANSFORM 0.4725 0.3522 0.8079 0.4409 0.6992 -0.5627 0.7631 -0.6221 -0.1751 -66.039 141.257 54.950 193 ASP A 142 ASP.? 219 GLU A 141 GLU.? 294 ASP A 140 ASP.? ULMNm 3 2dbt_c01 CHITINASE C user 4 3 RMSD = 1.21 A TRANSFORM -0.7003 0.1197 0.7038 -0.0258 -0.9894 0.1426 -0.7134 -0.0817 -0.6960 -26.761 88.740 89.170 B 147 GLU A 147 GLU~? B 156 GLU A 141 GLU.? B 194 ASN A 91 ASN~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.24 A TRANSFORM 0.8834 0.2897 0.3683 0.3672 -0.9163 -0.1601 -0.2911 -0.2766 0.9158 -48.019 122.190 -59.450 179 ASP A 140 ASP.? 214 ASP A 51 ASP.? 289 ASP A 97 ASP~? ULMNm 3 2dbt_c02 CHITINASE C user 3 3 RMSD = 1.26 A TRANSFORM 0.0140 0.2777 0.9606 0.1498 0.9492 -0.2766 0.9886 -0.1477 0.0283 -63.531 18.308 14.984 C 147 GLU A 147 GLU~? C 156 GLU A 141 GLU.? C 194 ASN A 91 ASN~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.28 A TRANSFORM 0.6975 0.6703 -0.2533 0.6355 -0.4154 0.6508 -0.3310 0.6149 0.7158 9.280 -26.982 -17.378 A 241 ASP A 89 ASP.? A 265 GLU A 150 GLU~? A 369 ASP A 97 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 14 3 RMSD = 1.30 A TRANSFORM -0.0340 0.8948 -0.4452 0.2392 0.4398 0.8657 -0.9704 0.0770 0.2290 24.185 -78.418 55.109 A 241 ASP A 97 ASP~? A 265 GLU A 150 GLU~? A 369 ASP A 140 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 RMSD = 1.31 A TRANSFORM 0.1175 0.7403 -0.6619 0.2666 0.6185 0.7392 -0.9566 0.2633 0.1247 54.471 -71.834 58.910 A 241 ASP A 97 ASP~? A 265 GLU A 146 GLU~? A 369 ASP A 140 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 23 3 RMSD = 1.32 A TRANSFORM 0.9279 0.0570 0.3684 -0.1484 -0.8501 0.5053 -0.3420 0.5235 0.7804 -26.024 10.561 -19.710 A 241 ASP A 142 ASP.? A 265 GLU A 150 GLU~? A 369 ASP A 140 ASP.? ULMNm 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 RMSD = 1.33 A TRANSFORM -0.4746 0.2565 0.8420 -0.2637 0.8712 -0.4140 0.8398 0.4185 0.3458 -48.834 18.892 -52.966 A 49 GLU A 123 GLU~? A 60 ASP A 129 ASP~? A 175 TYR A 158 TYR~? ULMNm 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.36 A TRANSFORM 0.7899 -0.0134 0.6130 -0.2493 0.9063 0.3411 0.5602 0.4223 -0.7126 -92.600 -70.834 64.438 A 18 SER A 4 SER~? A 20 HIS A 5 HIS~? A 22 LEU A 86 LEU.? ULMNm 3 1mas_c01 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 2 3 RMSD = 1.40 A TRANSFORM -0.1568 -0.3511 0.9231 -0.7148 -0.6046 -0.3514 -0.6815 0.7149 0.1562 -107.535 68.950 5.997 B 10 ASP A 101 ASP~? B 168 ASN A 20 ASN~? B 241 HIS A 25 HIS~? ULMNm 3 1mas_c00 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 2 3 RMSD = 1.40 A TRANSFORM -0.6338 -0.4042 -0.6595 -0.3884 -0.5711 0.7232 0.6690 -0.7145 -0.2049 101.979 -73.278 59.226 A 10 ASP A 101 ASP~? A 168 ASN A 20 ASN~? A 241 HIS A 25 HIS~? ULMNm 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 RMSD = 1.42 A TRANSFORM 0.2654 0.4518 0.8517 0.9211 0.1421 -0.3624 0.2847 -0.8807 0.3785 -105.577 35.313 26.514 A 243 THR A 161 THR~? A 345 PHE A 166 PHE~? A 352 CYH A 33 CYH~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.42 A TRANSFORM -0.0530 -0.7245 0.6872 -0.0981 -0.6811 -0.7256 -0.9938 0.1059 0.0350 -74.619 106.658 145.127 B 70 ALA A 151 ALA~? B 126 LEU A 148 LEU~? B 158 GLU A 145 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.42 A TRANSFORM 0.0404 0.9580 0.2839 -0.0143 -0.2836 0.9588 -0.9991 0.0428 -0.0023 -62.929 -92.778 150.434 C 70 ALA A 151 ALA~? C 126 LEU A 148 LEU~? C 158 GLU A 145 GLU~? ULMNm 3 3pta_d00 TRANSFERASE/DNA user 1 3 RMSD = 1.43 A TRANSFORM 0.1343 -0.4405 -0.8877 0.8185 -0.4557 0.3500 0.5586 0.7735 -0.2993 120.350 -63.200 37.473 A 682 SER A 14 SER~? A 683 LYS A 13 LYS~? A 684 GLN A 10 GLN~? ULMNm 3 2dbt_c00 CHITINASE C user 3 3 RMSD = 1.44 A TRANSFORM 0.3819 -0.2400 -0.8925 0.1188 -0.9449 0.3049 0.9165 0.2225 0.3324 170.278 23.567 -33.987 A 147 GLU A 147 GLU~? A 156 GLU A 141 GLU.? A 194 ASN A 91 ASN~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.44 A TRANSFORM -0.4179 0.8772 -0.2364 0.8116 0.4774 0.3366 -0.4081 0.0512 0.9115 -14.270 -61.503 -92.993 141 ASP A 130 ASP~? 166 GLY A 85 GLY.? 169 GLU A 88 GLU.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.44 A TRANSFORM -0.0987 -0.2262 -0.9691 0.0131 0.9734 -0.2286 -0.9950 0.0352 0.0931 103.403 16.691 139.995 A 70 ALA A 151 ALA~? A 126 LEU A 148 LEU~? A 158 GLU A 145 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 1 3 RMSD = 1.44 A TRANSFORM -0.4868 0.6469 0.5870 -0.7586 -0.6462 0.0830 -0.4330 0.4050 -0.8053 -53.548 90.733 106.809 A 228 ASP A 89 ASP.? A 260 ASP A 142 ASP.? A 329 ASP A 97 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 RMSD = 1.45 A TRANSFORM -0.6015 -0.4868 -0.6334 -0.7770 0.5407 0.3224 -0.1855 -0.6861 0.7035 138.903 34.393 -8.681 229 ASP A 89 ASP.? 264 GLU A 141 GLU.? 328 ASP A 97 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.45 A TRANSFORM 0.4118 0.1570 -0.8977 0.8916 0.1342 0.4325 -0.1883 0.9784 0.0847 119.303 -164.883 -200.423 A 420 ALA A 127 ALA~? B 182 GLY A 122 GLY~? B 183 GLY A 125 GLY~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.46 A TRANSFORM 0.9799 0.0933 -0.1765 -0.1996 0.4485 -0.8712 0.0021 -0.8889 -0.4581 90.012 144.893 238.902 D 141 GLY A 125 GLY~? D 144 GLU A 126 GLU~? D 164 GLU A 123 GLU~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.47 A TRANSFORM 0.4494 -0.3502 0.8218 -0.1375 -0.9361 -0.3237 -0.8827 -0.0325 0.4689 -56.537 31.413 -161.144 A 183 GLY A 35 GLY.? B 419 GLY A 34 GLY~? B 420 ALA A 113 ALA~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.47 A TRANSFORM -0.2605 -0.9584 0.1168 -0.5586 0.0509 -0.8279 -0.7875 0.2809 0.5486 109.560 159.436 86.073 F 141 GLY A 125 GLY~? F 144 GLU A 126 GLU~? F 164 GLU A 123 GLU~? ULMNm 3 1c2t_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.47 A TRANSFORM -0.0963 -0.8519 0.5147 0.1307 -0.5235 -0.8420 -0.9867 0.0139 -0.1617 10.738 154.575 36.298 B 106 ASN A 50 ASN~? B 108 HIS A 53 HIS.? B 144 ASP A 51 ASP.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.48 A TRANSFORM 0.2158 0.8824 -0.4181 -0.9024 0.3438 0.2598 -0.3730 -0.3212 -0.8705 -48.786 -26.074 265.514 B 70 ALA A 163 ALA~? B 126 LEU A 165 LEU~? B 158 GLU A 123 GLU~? ULMNm 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 1 3 RMSD = 1.48 A TRANSFORM 0.7362 0.2715 -0.6199 -0.6646 0.1174 -0.7379 0.1276 -0.9552 -0.2669 47.747 108.509 80.876 65 THR A 161 THR~? 242 CYH A 33 CYH~? 270 PHE A 166 PHE~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.48 A TRANSFORM -0.9044 -0.1557 0.3972 0.2345 -0.9592 0.1580 -0.3564 -0.2360 -0.9040 -19.437 70.598 261.405 A 70 ALA A 163 ALA~? A 126 LEU A 165 LEU~? A 158 GLU A 123 GLU~? ULMNm 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 4 3 RMSD = 1.48 A TRANSFORM -0.9933 -0.1125 0.0257 -0.0603 0.6965 0.7150 0.0984 -0.7087 0.6986 25.160 41.656 -51.426 A 85 GLU A 145 GLU~? A 87 ASP A 143 ASP.? A 89 GLU A 141 GLU.? ULMNm 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 3 3 RMSD = 1.49 A TRANSFORM -0.8887 0.2583 0.3789 0.4338 0.7415 0.5119 0.1487 -0.6193 0.7710 -26.785 100.537 -49.848 B 85 GLU A 145 GLU~? B 87 ASP A 143 ASP.? B 89 GLU A 141 GLU.? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.49 A TRANSFORM -0.9629 -0.2586 0.0776 0.1846 -0.4207 0.8882 0.1970 -0.8696 -0.4528 73.471 36.866 238.377 C 141 GLY A 125 GLY~? C 144 GLU A 126 GLU~? C 164 GLU A 123 GLU~? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.49 A TRANSFORM -0.9068 -0.1506 -0.3938 -0.2663 0.9287 0.2581 -0.3268 -0.3389 0.8822 114.540 -35.809 -50.773 A 55 ASP A 129 ASP~? A 58 ASP A 130 ASP~? A 424 GLU A 123 GLU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.49 A TRANSFORM 0.3371 0.9085 -0.2471 0.7332 -0.0887 0.6743 -0.5907 0.4084 0.6959 34.486 -68.526 -73.783 A 67 ASP A 97 ASP~? A 68 ALA A 96 ALA~? A 72 LEU A 99 LEU~? ULMNm 3 1grc_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 RMSD = 1.49 A TRANSFORM 0.9868 0.1424 0.0770 0.1619 -0.8666 -0.4720 0.0004 -0.4782 0.8783 17.859 162.209 -73.959 A 106 ASN A 50 ASN~? A 108 HIS A 53 HIS.? A 144 ASP A 51 ASP.?