*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 0.74 A TRANSFORM 0.1828 0.9278 0.3253 -0.9212 0.2772 -0.2731 -0.3436 -0.2497 0.9053 5.633 92.225 -44.953 D 465 GLY A 33 GLY.? D 501 ASP A 58 ASP~? E 367 TYR D 90 TYR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 0.75 A TRANSFORM 0.8149 0.3532 0.4596 0.4420 -0.8916 -0.0984 0.3750 0.2833 -0.8827 -30.454 17.990 -22.678 A 465 GLY A 33 GLY.? A 501 ASP A 58 ASP~? B 367 TYR D 90 TYR~? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 RMSD = 0.83 A TRANSFORM -0.9554 -0.1346 -0.2628 0.2725 -0.7445 -0.6094 -0.1136 -0.6539 0.7480 125.436 90.130 -6.918 B 137 GLY A 51 GLY~? B 175 ARG A 49 ARG~? B 242 TYR A 90 TYR~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 8 3 RMSD = 0.92 A TRANSFORM -0.7606 0.4059 -0.5068 -0.6488 -0.5055 0.5689 -0.0253 0.7614 0.6478 68.322 0.517 -69.924 B 250 ALA D 96 ALA.? B 251 GLY D 99 GLY.? B 252 ASP D 100 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 0.93 A TRANSFORM 0.7232 -0.4790 -0.4975 -0.5555 0.0245 -0.8312 0.4103 0.8775 -0.2484 18.712 -3.244 -56.821 B 250 ALA A 96 ALA.? B 251 GLY A 99 GLY.? B 252 ASP A 98 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 7 3 RMSD = 0.93 A TRANSFORM -0.4947 0.8530 0.1662 -0.1243 -0.2587 0.9579 0.8601 0.4533 0.2340 32.577 -40.593 -105.124 B 250 ALA D 96 ALA.? B 251 GLY D 99 GLY.? B 252 ASP D 98 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 7 3 RMSD = 0.94 A TRANSFORM -0.5725 -0.7212 -0.3899 0.2216 -0.5940 0.7734 -0.7894 0.3564 0.4999 191.589 -11.166 22.554 A 316 ALA D 96 ALA.? A 317 GLY D 99 GLY.? A 318 ASP D 98 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 0.94 A TRANSFORM -0.5968 -0.6111 0.5200 -0.7921 0.3451 -0.5035 0.1282 -0.7124 -0.6900 148.776 32.914 10.542 A 316 ALA A 96 ALA.? A 317 GLY A 99 GLY.? A 318 ASP A 98 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 8 3 RMSD = 0.94 A TRANSFORM 0.4423 0.2971 -0.8462 0.8798 -0.3268 0.3451 -0.1740 -0.8972 -0.4060 23.809 -70.869 22.803 A 250 ALA D 96 ALA.? A 251 GLY D 99 GLY.? A 252 ASP D 100 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 8 3 RMSD = 0.94 A TRANSFORM 0.4097 -0.7959 -0.4457 -0.1907 -0.5525 0.8114 -0.8921 -0.2475 -0.3782 139.809 10.290 56.077 A 316 ALA D 96 ALA.? A 317 GLY D 99 GLY.? A 318 ASP D 100 ASP.? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 5 3 RMSD = 0.94 A TRANSFORM 0.8823 0.1335 -0.4513 -0.4006 0.7163 -0.5713 0.2470 0.6848 0.6855 86.573 109.101 -13.352 B 137 GLY B 51 GLY~? B 175 ARG B 49 ARG~? B 242 TYR B 90 TYR~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 6 3 RMSD = 0.95 A TRANSFORM -0.6411 0.1009 0.7608 0.6831 0.5267 0.5058 -0.3497 0.8440 -0.4066 40.506 -30.891 65.547 A 316 ALA D 96 ALA.? A 317 GLY D 99 GLY.? A 318 ASP D 100 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 0.96 A TRANSFORM 0.5292 -0.4167 0.7391 -0.6000 0.4321 0.6732 -0.5999 -0.7998 -0.0214 12.330 -22.479 10.391 A 250 ALA A 96 ALA.? A 251 GLY A 99 GLY.? A 252 ASP A 98 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 7 3 RMSD = 0.97 A TRANSFORM -0.2785 0.2708 -0.9215 0.4823 -0.7903 -0.3780 -0.8306 -0.5497 0.0895 65.679 -26.392 42.944 A 250 ALA D 96 ALA.? A 251 GLY D 99 GLY.? A 252 ASP D 98 ASP.? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 7 3 RMSD = 0.99 A TRANSFORM 0.1967 0.9304 0.3095 0.5745 -0.3651 0.7325 0.7945 0.0337 -0.6063 67.585 52.263 -18.438 B 137 GLY C 51 GLY~? B 175 ARG C 49 ARG~? B 242 TYR C 90 TYR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 28 3 RMSD = 1.08 A TRANSFORM -0.6208 -0.1678 0.7658 -0.1232 0.9856 0.1161 -0.7743 -0.0222 -0.6325 59.147 23.192 59.774 199 ASP C 32 ASP.? 218 GLU B 17 GLU~? 329 ASP A 65 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 16 3 RMSD = 1.09 A TRANSFORM 0.8632 -0.1587 -0.4792 0.3280 0.8979 0.2935 0.3837 -0.4105 0.8272 25.012 -25.652 -8.505 A 67 ASP C 32 ASP.? A 68 ALA C 31 ALA~? A 72 LEU D 111 LEU~? ULMNm 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 5 3 RMSD = 1.10 A TRANSFORM -0.6606 -0.1501 -0.7356 0.1149 -0.9885 0.0984 -0.7419 -0.0195 0.6703 63.513 -12.771 8.900 A 102 ASP B 65 ASP~? A 167 LYS B 23 LYS~? A 201 LYS B 26 LYS~? ULMNm 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 5 3 RMSD = 1.10 A TRANSFORM 0.6632 0.1284 0.7373 0.2850 -0.9543 -0.0903 0.6920 0.2700 -0.6695 -11.306 -4.617 65.838 B1102 ASP B 65 ASP~? B1167 LYS B 23 LYS~? B1201 LYS B 26 LYS~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 RMSD = 1.12 A TRANSFORM 0.7173 -0.6961 0.0311 0.0467 0.0926 0.9946 -0.6952 -0.7120 0.0990 15.671 88.987 26.572 193 ASP A 102 ASP~? 231 ASP C 55 ASP~? 294 ASP A 32 ASP.? ULMNm 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 2 3 RMSD = 1.13 A TRANSFORM 0.1196 0.2578 0.9588 -0.4906 -0.8242 0.2828 0.8632 -0.5042 0.0279 -66.257 62.469 32.110 33 ASP A 102 ASP~? 187 GLU A 39 GLU~? 229 LYS A 36 LYS~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.13 A TRANSFORM -0.2611 -0.6270 -0.7340 0.4507 0.5933 -0.6670 0.8537 -0.5049 0.1276 46.761 24.084 32.605 A 316 ALA A 96 ALA.? A 317 GLY A 99 GLY.? A 318 ASP A 100 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 10 3 RMSD = 1.15 A TRANSFORM -0.7960 -0.6038 -0.0433 0.2344 -0.2414 -0.9417 0.5581 -0.7597 0.3337 74.858 94.905 24.716 A 228 ASP C 98 ASP.? A 261 ASP C 32 ASP.? A 329 ASP A 58 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.15 A TRANSFORM 0.4115 -0.8351 0.3650 -0.7642 -0.5344 -0.3612 0.4967 -0.1303 -0.8581 11.537 -3.458 -39.937 B 250 ALA A 96 ALA.? B 251 GLY A 99 GLY.? B 252 ASP A 100 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.16 A TRANSFORM -0.5285 0.5248 0.6673 -0.8067 -0.0656 -0.5873 -0.2644 -0.8487 0.4580 136.364 37.993 -1.878 A 316 ALA A 96 ALA.? A 317 GLY A 99 GLY.? A 318 ASP A 100 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 26 3 RMSD = 1.16 A TRANSFORM -0.7273 -0.0222 -0.6860 -0.3093 -0.8816 0.3565 -0.6127 0.4714 0.6343 99.481 32.680 25.585 A 67 ASP D 32 ASP.? A 68 ALA D 31 ALA~? A 72 LEU C 111 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.17 A TRANSFORM 0.0983 -0.7228 0.6841 -0.9479 -0.2773 -0.1568 0.3030 -0.6330 -0.7124 34.599 35.639 23.763 A 67 ASP A 32 ASP.? A 68 ALA A 31 ALA~? A 72 LEU B 111 LEU~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.17 A TRANSFORM 0.6242 0.3554 0.6958 -0.2655 0.9340 -0.2389 -0.7348 -0.0356 0.6774 5.378 -16.021 -5.281 A 250 ALA A 96 ALA.? A 251 GLY A 99 GLY.? A 252 ASP A 100 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 1 3 RMSD = 1.18 A TRANSFORM -0.0050 -0.0432 -0.9991 0.1429 0.9888 -0.0435 0.9897 -0.1429 0.0012 59.910 51.566 -4.991 A 228 ASP A 65 ASP~? A 260 ASP C 103 ASP~? A 329 ASP C 32 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 RMSD = 1.18 A TRANSFORM 0.0871 0.8744 0.4774 0.8648 0.1715 -0.4719 -0.4945 0.4540 -0.7412 42.869 -0.607 45.975 A 67 ASP B 32 ASP.? A 68 ALA B 31 ALA~? A 72 LEU A 111 LEU~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 RMSD = 1.18 A TRANSFORM -0.4165 0.7894 0.4509 0.4183 -0.2739 0.8660 0.8072 0.5493 -0.2162 23.123 70.688 -20.759 193 ASP C 32 ASP.? 231 ASP B 103 ASP~? 294 ASP A 65 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 RMSD = 1.21 A TRANSFORM 0.5314 -0.6243 0.5725 0.8240 0.2241 -0.5204 0.1966 0.7483 0.6335 -21.319 -16.719 -33.679 141 ASP D 103 ASP~? 166 GLY C 92 GLY~? 169 GLU C 46 GLU~? ULMNm 3 2dw7_c32 BLL6730 PROTEIN user 10 3 RMSD = 1.25 A TRANSFORM -0.8732 0.4226 -0.2426 0.1881 -0.1669 -0.9679 -0.4495 -0.8908 0.0663 37.688 63.280 3.727 A 182 LYS B 26 LYS~? A 184 LYS B 23 LYS~? A 345 ASP B 58 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 18 3 RMSD = 1.25 A TRANSFORM 0.7558 -0.0485 0.6530 -0.0055 0.9967 0.0804 -0.6547 -0.0644 0.7531 -42.493 15.613 97.460 A 241 ASP D 32 ASP.? A 265 GLU D 46 GLU~? A 369 ASP D 102 ASP~? ULMNm 3 2dw7_c36 BLL6730 PROTEIN user 10 3 RMSD = 1.26 A TRANSFORM -0.9438 -0.2594 0.2048 -0.1796 -0.1174 -0.9767 0.2774 -0.9586 0.0643 -9.615 92.185 100.906 E 182 LYS B 26 LYS~? E 184 LYS B 23 LYS~? E 345 ASP B 58 ASP~? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 8 3 RMSD = 1.27 A TRANSFORM -0.2593 -0.8497 0.4592 -0.8255 0.4417 0.3514 -0.5014 -0.2879 -0.8159 115.844 109.352 48.297 B 137 GLY D 51 GLY~? B 175 ARG D 49 ARG~? B 242 TYR D 90 TYR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 54 3 RMSD = 1.27 A TRANSFORM -0.4150 -0.9008 0.1277 -0.2185 0.2350 0.9471 -0.8832 0.3651 -0.2944 87.243 17.953 60.210 199 ASP D 32 ASP.? 218 GLU D 82 GLU~? 329 ASP D 102 ASP~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 6 3 RMSD = 1.28 A TRANSFORM 0.6469 -0.0213 0.7623 0.2100 -0.9560 -0.2049 0.7331 0.2927 -0.6139 -27.361 60.769 70.450 A 241 ASP A 58 ASP~? A 279 GLU A 17 GLU~? A 369 ASP C 98 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.31 A TRANSFORM -0.9608 -0.2641 0.0849 -0.0408 -0.1681 -0.9849 0.2744 -0.9497 0.1507 75.474 50.819 8.951 199 ASP A 32 ASP.? 218 GLU A 82 GLU~? 329 ASP A 102 ASP~? ULMNm 3 2dw7_c38 BLL6730 PROTEIN user 9 3 RMSD = 1.32 A TRANSFORM -0.8486 0.4385 -0.2961 -0.2340 0.1910 0.9533 0.4746 0.8782 -0.0595 72.556 23.435 79.114 G 182 LYS B 26 LYS~? G 184 LYS B 23 LYS~? G 345 ASP B 58 ASP~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 1 3 RMSD = 1.32 A TRANSFORM 0.5233 -0.3366 0.7828 -0.3250 0.7704 0.5485 -0.7877 -0.5415 0.2937 -46.655 34.721 24.099 A1132 ASP A 103 ASP~? A1134 ALA A 107 ALA~? A1137 ASN A 104 ASN~? ULMNm 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 7 3 RMSD = 1.33 A TRANSFORM 0.2208 -0.4475 -0.8666 0.9672 0.2151 0.1354 0.1258 -0.8680 0.4803 49.294 -28.627 -141.783 A1290 LYS C 85 LYS~? A1294 ASN C 129 ASN~? A1297 GLU C 125 GLU~? ULMNm 3 2dw7_c45 BLL6730 PROTEIN user 7 3 RMSD = 1.33 A TRANSFORM 0.0566 -0.3145 -0.9476 0.5175 0.8209 -0.2415 0.8538 -0.4767 0.2092 43.705 -21.522 56.256 N 182 LYS B 26 LYS~? N 184 LYS B 23 LYS~? N 345 ASP B 58 ASP~? ULMNm 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 5 3 RMSD = 1.34 A TRANSFORM 0.1654 -0.2884 -0.9431 0.8828 0.4696 0.0112 0.4396 -0.8344 0.3323 -25.986 8.614 41.869 33 ASP C 102 ASP~? 187 GLU C 39 GLU~? 229 LYS C 36 LYS~? ULMNm 3 2dw7_c41 BLL6730 PROTEIN user 11 3 RMSD = 1.34 A TRANSFORM 0.0998 0.5838 -0.8057 -0.6848 0.6278 0.3701 0.7219 0.5148 0.4624 36.747 69.894 -31.542 J 182 LYS A 62 LYS~? J 184 LYS C 36 LYS~? J 345 ASP D 103 ASP~? ULMNm 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 4 3 RMSD = 1.34 A TRANSFORM -0.1838 0.1998 0.9625 0.2797 0.9493 -0.1436 -0.9423 0.2428 -0.2303 20.005 20.220 -114.101 A1290 LYS B 85 LYS~? A1294 ASN B 129 ASN~? A1297 GLU B 125 GLU~? ULMNm 3 2dw7_c40 BLL6730 PROTEIN user 10 3 RMSD = 1.35 A TRANSFORM -0.1239 -0.7538 -0.6454 0.4876 0.5202 -0.7012 0.8643 -0.4015 0.3031 70.882 112.872 9.648 I 182 LYS B 26 LYS~? I 184 LYS B 23 LYS~? I 345 ASP B 58 ASP~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 2 3 RMSD = 1.35 A TRANSFORM -0.2992 0.4933 0.8168 0.4727 -0.6669 0.5760 0.8288 0.5585 -0.0337 -25.591 11.707 -5.433 A1132 ASP B 103 ASP~? A1134 ALA B 107 ALA~? A1137 ASN B 104 ASN~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 15 3 RMSD = 1.36 A TRANSFORM 0.4733 0.2242 -0.8519 -0.4589 0.8882 -0.0211 0.7519 0.4009 0.5233 41.830 79.873 -14.222 229 ASP C 103 ASP~? 264 GLU C 125 GLU~? 328 ASP C 100 ASP.? ULMNm 3 2dw7_c35 BLL6730 PROTEIN user 10 3 RMSD = 1.36 A TRANSFORM -0.1327 -0.7335 -0.6666 -0.4563 -0.5518 0.6981 -0.8799 0.3968 -0.2615 40.876 -29.250 72.911 D 182 LYS B 26 LYS~? D 184 LYS B 23 LYS~? D 345 ASP B 58 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 7 3 RMSD = 1.36 A TRANSFORM -0.3172 -0.2558 0.9132 -0.8239 0.5513 -0.1318 -0.4697 -0.7941 -0.3856 38.293 97.731 53.742 229 ASP A 103 ASP~? 264 GLU A 125 GLU~? 328 ASP A 100 ASP.? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 3 3 RMSD = 1.37 A TRANSFORM 0.4770 -0.5265 -0.7038 -0.5713 0.4228 -0.7035 0.6679 0.7376 -0.0992 -16.250 68.334 -28.740 A1132 ASP C 103 ASP~? A1134 ALA C 107 ALA~? A1137 ASN C 104 ASN~? ULMNm 3 2dw7_c42 BLL6730 PROTEIN user 10 3 RMSD = 1.37 A TRANSFORM 0.8653 -0.4258 0.2645 -0.2390 -0.8143 -0.5289 0.4406 0.3944 -0.8064 19.786 60.073 10.915 K 182 LYS B 26 LYS~? K 184 LYS B 23 LYS~? K 345 ASP B 58 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 4 3 RMSD = 1.37 A TRANSFORM -0.0326 -0.0239 -0.9992 0.1698 0.9850 -0.0291 0.9849 -0.1706 -0.0280 60.599 50.256 -3.843 A 228 ASP A 65 ASP~? A 261 ASP D 32 ASP.? A 329 ASP C 32 ASP.? ULMNm 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 10 3 RMSD = 1.38 A TRANSFORM 0.2171 -0.6029 -0.7677 0.8593 -0.2551 0.4434 -0.4632 -0.7559 0.4626 32.395 -39.584 92.152 B1102 ASP D 65 ASP~? B1167 LYS D 23 LYS~? B1201 LYS D 26 LYS~? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 18 3 RMSD = 1.38 A TRANSFORM 0.7456 0.0715 -0.6625 0.6575 -0.2410 0.7139 -0.1086 -0.9679 -0.2267 -5.047 -15.748 37.051 A 10 ASP D 102 ASP~? A 186 ASN C 104 ASN~? A 260 ALA D 31 ALA~? ULMNm 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 RMSD = 1.40 A TRANSFORM -0.3198 -0.0798 0.9441 -0.7731 -0.5541 -0.3087 0.5478 -0.8286 0.1155 40.125 108.162 30.987 229 ASP A 32 ASP.? 257 GLU A 105 GLU~? 328 ASP A 102 ASP~? ULMNm 3 2dw7_c39 BLL6730 PROTEIN user 9 3 RMSD = 1.40 A TRANSFORM 0.9447 0.2564 -0.2046 0.1206 -0.8515 -0.5104 -0.3051 0.4575 -0.8353 59.875 83.347 116.580 H 182 LYS B 26 LYS~? H 184 LYS B 23 LYS~? H 345 ASP B 58 ASP~? ULMNm 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 10 3 RMSD = 1.40 A TRANSFORM -0.2005 0.6017 0.7732 0.9523 -0.0658 0.2981 0.2302 0.7960 -0.5598 19.192 -52.338 -7.702 A 102 ASP D 65 ASP~? A 167 LYS D 23 LYS~? A 201 LYS D 26 LYS~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 RMSD = 1.40 A TRANSFORM -0.2832 -0.9352 0.2127 -0.9284 0.3230 0.1838 -0.2406 -0.1454 -0.9597 33.375 80.557 67.297 179 ASP C 98 ASP.? 214 ASP A 32 ASP.? 289 ASP A 58 ASP~? ULMNm 3 2dw7_c34 BLL6730 PROTEIN user 11 3 RMSD = 1.40 A TRANSFORM 0.0964 0.2680 0.9586 0.3231 -0.9193 0.2246 0.9415 0.2880 -0.1752 -30.836 -13.375 59.231 C 182 LYS B 26 LYS~? C 184 LYS B 23 LYS~? C 345 ASP B 58 ASP~? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 20 3 RMSD = 1.41 A TRANSFORM 0.8042 0.2833 -0.5225 0.5417 0.0126 0.8405 0.2447 -0.9590 -0.1433 -15.743 -17.821 17.210 A 10 ASP D 102 ASP~? A 186 ASN D 104 ASN~? A 260 ALA D 31 ALA~? ULMNm 3 1pow_c03 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 3 3 RMSD = 1.41 A TRANSFORM 0.8413 -0.3248 0.4321 0.3846 -0.2019 -0.9007 0.3798 0.9240 -0.0449 -49.366 81.750 -21.961 B 264 ARG C 83 ARG~? B 479 PHE C 13 PHE.? B 483 GLU C 17 GLU~? ULMNm 3 1qho_c04 ALPHA-AMYLASE user 3 3 RMSD = 1.41 A TRANSFORM 0.9782 0.1790 -0.1052 -0.1997 0.9498 -0.2408 0.0568 0.2565 0.9649 12.544 75.699 14.250 A 228 ASP A 102 ASP~? A 256 GLU A 105 GLU~? A 329 ASP A 32 ASP.? ULMNm 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 10 3 RMSD = 1.41 A TRANSFORM 0.0349 0.2326 -0.9719 -0.9665 -0.2395 -0.0920 -0.2542 0.9426 0.2165 48.455 71.684 -151.008 A1290 LYS D 85 LYS~? A1294 ASN D 129 ASN~? A1297 GLU D 125 GLU~? ULMNm 3 2dw7_c32 BLL6730 PROTEIN user 8 3 RMSD = 1.42 A TRANSFORM -0.0846 0.6983 0.7108 -0.3159 -0.6954 0.6455 0.9450 -0.1699 0.2794 -24.931 44.598 -27.540 A 182 LYS A 62 LYS~? A 184 LYS C 36 LYS~? A 345 ASP D 103 ASP~? ULMNm 3 1pow_c02 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 3 3 RMSD = 1.42 A TRANSFORM -0.8565 0.3220 -0.4034 -0.5157 -0.5666 0.6427 -0.0217 0.7585 0.6514 40.748 90.790 -17.486 A 264 ARG C 83 ARG~? A 479 PHE C 13 PHE.? A 483 GLU C 17 GLU~? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 RMSD = 1.42 A TRANSFORM -0.6968 0.1372 -0.7040 -0.3391 -0.9279 0.1547 -0.6320 0.3465 0.6932 33.978 75.764 134.734 B 109 ASP A 102 ASP~? B 182 GLU A 39 GLU~? B 286 ASN A 104 ASN~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 53 3 RMSD = 1.43 A TRANSFORM -0.6086 -0.6061 0.5121 0.7741 -0.3119 0.5508 -0.1741 0.7317 0.6591 81.228 -11.084 -6.278 199 ASP D 32 ASP.? 218 GLU A 39 GLU~? 329 ASP D 102 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.43 A TRANSFORM -0.2892 -0.8226 0.4896 0.8170 -0.4787 -0.3217 0.4990 0.3070 0.8104 -3.816 -19.360 -48.600 141 ASP B 80 ASP~? 166 GLY D 99 GLY.? 169 GLU D 105 GLU~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 10 3 RMSD = 1.43 A TRANSFORM -0.8944 -0.1753 -0.4115 -0.3992 -0.1024 0.9111 -0.2019 0.9792 0.0216 73.437 94.550 -11.245 193 ASP C 98 ASP.? 231 ASP D 32 ASP.? 294 ASP A 58 ASP~? ULMNm 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.45 A TRANSFORM 0.9220 0.3747 0.0978 0.1688 -0.6162 0.7693 0.3486 -0.6927 -0.6314 31.563 23.550 17.010 199 ASP A 102 ASP~? 255 GLU A 105 GLU~? 329 ASP A 32 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 13 3 RMSD = 1.46 A TRANSFORM -0.3617 -0.9301 -0.0633 -0.6520 0.2038 0.7303 -0.6664 0.3055 -0.6802 42.779 61.087 59.714 179 ASP C 98 ASP.? 227 GLU C 46 GLU~? 289 ASP A 58 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 19 3 RMSD = 1.46 A TRANSFORM 0.9772 0.0627 0.2028 -0.0969 0.9818 0.1633 -0.1889 -0.1792 0.9655 1.757 -7.527 6.840 A 67 ASP C 32 ASP.? A 68 ALA D 107 ALA~? A 72 LEU D 108 LEU~? ULMNm 3 1kim_c00 THYMIDINE KINASE user 8 3 RMSD = 1.46 A TRANSFORM -0.7552 0.6073 -0.2466 0.0492 0.4277 0.9026 0.6536 0.6695 -0.3529 66.139 72.191 7.461 A 83 GLU C 17 GLU~? A 163 ARG C 78 ARG~? A 222 ARG C 83 ARG~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 22 3 RMSD = 1.46 A TRANSFORM -0.3673 0.7280 -0.5789 0.3092 0.6826 0.6622 0.8772 0.0642 -0.4758 62.666 -38.888 -16.662 A 67 ASP D 32 ASP.? A 68 ALA C 107 ALA~? A 72 LEU C 106 LEU~? ULMNm 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.46 A TRANSFORM 0.2554 -0.6025 -0.7562 -0.6878 -0.6628 0.2959 -0.6795 0.4446 -0.5837 34.642 65.452 95.467 A 151 SER B 89 SER~? A 164 TYR B 86 TYR~? A 168 LYS B 85 LYS~? ULMNm 3 2dw7_c41 BLL6730 PROTEIN user 13 3 RMSD = 1.47 A TRANSFORM 0.0766 0.2920 0.9533 -0.3685 0.8967 -0.2451 -0.9265 -0.3326 0.1763 0.785 97.468 24.897 J 182 LYS B 26 LYS~? J 184 LYS B 23 LYS~? J 345 ASP B 58 ASP~? ULMNm 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.47 A TRANSFORM 0.1504 -0.5255 -0.8374 0.6874 0.6643 -0.2935 0.7105 -0.5315 0.4612 38.414 19.817 47.329 D 151 SER B 89 SER~? D 164 TYR B 86 TYR~? D 168 LYS B 85 LYS~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 26 3 RMSD = 1.47 A TRANSFORM -0.2519 -0.4513 -0.8561 -0.9281 -0.1379 0.3458 -0.2741 0.8817 -0.3841 54.230 74.046 92.150 A 241 ASP D 102 ASP~? A 265 GLU D 46 GLU~? A 369 ASP D 32 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 18 3 RMSD = 1.48 A TRANSFORM 0.4622 -0.8455 -0.2673 -0.4836 -0.4930 0.7233 -0.7433 -0.2051 -0.6367 46.040 16.641 64.520 A 67 ASP C 32 ASP.? A 68 ALA D 107 ALA~? A 72 LEU D 106 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 RMSD = 1.48 A TRANSFORM 0.8132 -0.4468 0.3728 0.5139 0.2508 -0.8204 0.2731 0.8588 0.4336 19.293 4.792 1.648 A 67 ASP A 32 ASP.? A 68 ALA B 107 ALA~? A 72 LEU B 106 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 RMSD = 1.49 A TRANSFORM -0.7044 0.5438 0.4562 -0.6989 -0.4189 -0.5797 -0.1241 -0.7271 0.6752 56.204 27.521 2.527 A 67 ASP B 32 ASP.? A 68 ALA A 107 ALA~? A 72 LEU A 106 LEU~? ULMNm 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 RMSD = 1.49 A TRANSFORM -0.5649 0.5050 0.6526 -0.7621 -0.6225 -0.1780 0.3163 -0.5979 0.7365 31.370 104.306 48.204 A 151 SER C 89 SER~? A 164 TYR C 86 TYR~? A 168 LYS C 85 LYS~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 65 3 RMSD = 1.50 A TRANSFORM 0.5446 0.5450 -0.6376 -0.3061 0.8369 0.4538 0.7809 -0.0520 0.6225 34.721 24.578 -39.356 199 ASP D 102 ASP~? 218 GLU D 17 GLU~? 329 ASP D 32 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 15 3 RMSD = 1.50 A TRANSFORM 0.6526 0.6744 0.3454 -0.6836 0.3275 0.6523 0.3268 -0.6617 0.6747 -40.266 31.925 73.056 A 241 ASP C 98 ASP.? A 265 GLU C 125 GLU~? A 369 ASP C 102 ASP~? ULMNm 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 RMSD = 1.50 A TRANSFORM -0.5077 0.4093 0.7581 0.7634 0.6215 0.1757 -0.3992 0.6679 -0.6281 27.848 -19.006 93.549 D 151 SER C 89 SER~? D 164 TYR C 86 TYR~? D 168 LYS C 85 LYS~? ULMNm 3 1bf2_c00 ISOAMYLASE user 1 3 RMSD = 1.50 A TRANSFORM -0.5311 0.7814 -0.3278 0.3842 0.5668 0.7288 0.7552 0.2611 -0.6012 101.589 54.070 34.658 375 ASP A 102 ASP~? 435 GLU A 105 GLU~? 510 ASP A 32 ASP.?