*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.69 A TRANSFORM -0.1694 -0.4496 0.8770 0.4045 0.7797 0.4779 0.8987 -0.4357 -0.0498 -1.386 -32.423 1.868 B 99 ARG A 126 ARG~? B 101 ASP B 68 ASP~? B 132 ASP A 56 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.71 A TRANSFORM 0.1688 0.4379 -0.8830 -0.3202 -0.8229 -0.4693 0.9322 -0.3620 -0.0013 24.748 56.411 -2.475 A 99 ARG A 126 ARG~? A 101 ASP B 68 ASP~? A 132 ASP A 56 ASP.? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 0.72 A TRANSFORM 0.2205 0.6388 0.7371 -0.3666 -0.6460 0.6695 -0.9039 0.4179 -0.0917 -30.433 9.990 14.861 B 99 ARG B 126 ARG~? B 101 ASP A 68 ASP~? B 132 ASP B 56 ASP.? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 RMSD = 0.73 A TRANSFORM -0.1377 -0.4552 0.8797 0.4183 0.7783 0.4682 0.8978 -0.4324 -0.0832 -2.120 -32.255 2.724 B 99 ARG A 126 ARG~? B 101 ASP B 68 ASP~? B 132 ASP A 56 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 0.74 A TRANSFORM -0.2203 -0.6288 -0.7457 0.2826 0.6905 -0.6658 -0.9336 0.3574 -0.0256 53.336 15.046 14.352 A 99 ARG B 126 ARG~? A 101 ASP A 68 ASP~? A 132 ASP B 56 ASP.? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 RMSD = 0.76 A TRANSFORM 0.1625 0.4336 -0.8863 -0.2984 -0.8346 -0.4630 0.9405 -0.3397 0.0062 25.201 55.947 -3.398 A 99 ARG A 126 ARG~? A 101 ASP B 68 ASP~? A 132 ASP A 56 ASP.? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 RMSD = 0.77 A TRANSFORM 0.1892 0.6448 0.7405 -0.3806 -0.6471 0.6607 -0.9052 0.4068 -0.1230 -30.338 10.629 16.010 B 99 ARG B 126 ARG~? B 101 ASP A 68 ASP~? B 132 ASP B 56 ASP.? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 0.80 A TRANSFORM -0.2144 -0.6252 -0.7504 0.2608 0.7037 -0.6609 -0.9413 0.3374 -0.0122 53.419 14.801 14.565 A 99 ARG B 126 ARG~? A 101 ASP A 68 ASP~? A 132 ASP B 56 ASP.? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 12 3 RMSD = 0.88 A TRANSFORM 0.0945 0.2966 -0.9503 -0.5722 0.7974 0.1919 -0.8147 -0.5256 -0.2451 62.773 -44.963 -18.103 B 37 ASP B 112 ASP^? B 56 ILE B 5 ILE~? B 82 TYR B 9 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 12 3 RMSD = 0.89 A TRANSFORM 0.0982 0.3042 -0.9475 -0.5966 0.7801 0.1886 -0.7965 -0.5468 -0.2581 59.684 -28.150 10.303 A 37 ASP B 112 ASP^? A 56 ILE B 5 ILE~? A 82 TYR B 9 TYR~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 RMSD = 0.98 A TRANSFORM 0.7212 0.4225 0.5489 0.1178 -0.8557 0.5038 -0.6826 0.2987 0.6669 -26.060 6.939 27.755 B 16 TYR A 143 TYR~? B 40 ASP B 68 ASP~? B 103 LEU A 127 LEU~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 RMSD = 0.98 A TRANSFORM 0.8401 0.3359 0.4259 -0.1009 0.8682 -0.4858 0.5330 -0.3651 -0.7633 -26.024 28.247 27.753 A 16 TYR A 143 TYR~? A 40 ASP B 68 ASP~? A 103 LEU A 127 LEU~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.00 A TRANSFORM -0.8572 0.4376 -0.2713 0.2152 0.7832 0.5834 -0.4678 -0.4417 0.7656 31.415 0.121 82.863 A 241 ASP A 56 ASP.? A 265 GLU A 33 GLU^? A 369 ASP B 68 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 RMSD = 1.01 A TRANSFORM -0.8173 -0.5567 0.1489 0.5422 -0.8303 -0.1285 -0.1952 0.0243 -0.9805 80.238 41.205 44.570 199 ASP A 56 ASP.? 218 GLU B 52 GLU.? 329 ASP B 68 ASP~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 9 3 RMSD = 1.01 A TRANSFORM -0.6604 -0.2526 0.7071 -0.0436 0.9530 0.2997 0.7496 -0.1671 0.6404 10.298 -27.467 14.222 B 16 TYR B 143 TYR~? B 40 ASP A 68 ASP~? B 103 LEU B 127 LEU~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 9 3 RMSD = 1.01 A TRANSFORM -0.7909 -0.1914 0.5812 0.0286 -0.9603 -0.2774 -0.6112 0.2028 -0.7650 11.312 63.576 34.499 A 16 TYR B 143 TYR~? A 40 ASP A 68 ASP~? A 103 LEU B 127 LEU~? ULMNm 3 3hde_o00 LYSOZYME user 4 3 RMSD = 1.02 A TRANSFORM 0.9983 -0.0409 -0.0421 0.0109 0.8337 -0.5521 -0.0577 -0.5507 -0.8327 -15.916 -41.062 8.692 A 35 GLU A 76 GLU~? A 44 ASP B 121 ASP~? A 50 THR B 122 THR~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 26 3 RMSD = 1.02 A TRANSFORM 0.8182 0.5732 -0.0448 -0.5614 0.7798 -0.2770 0.1238 -0.2518 -0.9598 29.544 26.447 44.807 199 ASP B 56 ASP.? 218 GLU A 52 GLU.? 329 ASP A 68 ASP~? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 5 3 RMSD = 1.03 A TRANSFORM 0.5835 0.2175 0.7825 -0.0880 0.9747 -0.2053 0.8074 -0.0510 -0.5879 -25.983 -36.322 87.940 A 16 TYR B 74 TYR~? A 40 ASP A 68 ASP~? A 103 ASP B 56 ASP.? ULMNm 3 3hde_o00 LYSOZYME user 8 3 RMSD = 1.04 A TRANSFORM -0.9984 0.0393 0.0408 -0.0507 -0.9419 -0.3319 -0.0254 0.3335 -0.9424 15.646 -3.571 -10.006 A 35 GLU B 76 GLU~? A 44 ASP A 121 ASP~? A 50 THR A 122 THR~? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 RMSD = 1.04 A TRANSFORM 0.6588 0.2063 0.7234 0.0883 -0.9762 0.1980 -0.7471 0.0665 0.6614 -24.369 -0.706 53.574 B 16 TYR B 74 TYR~? B 40 ASP A 68 ASP~? B 103 ASP B 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 21 3 RMSD = 1.04 A TRANSFORM 0.8395 -0.4934 -0.2276 -0.1657 -0.6315 0.7575 0.5175 0.5982 0.6119 22.114 35.827 44.762 A 241 ASP B 56 ASP.? A 265 GLU B 33 GLU^? A 369 ASP A 68 ASP~? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.05 A TRANSFORM -0.5274 -0.0291 0.8491 0.0818 -0.9965 0.0166 -0.8457 -0.0782 -0.5280 -2.134 1.524 116.398 A 16 TYR A 74 TYR~? A 40 ASP B 68 ASP~? A 103 ASP A 56 ASP.? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.06 A TRANSFORM -0.6068 -0.0312 0.7943 -0.0829 0.9963 -0.0242 0.7905 0.0805 0.6071 1.906 -38.549 27.336 B 16 TYR A 74 TYR~? B 40 ASP B 68 ASP~? B 103 ASP A 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 RMSD = 1.13 A TRANSFORM -0.4336 0.3781 0.8179 0.8988 0.1159 0.4229 -0.0651 -0.9185 0.3901 -14.983 10.159 101.414 A 241 ASP A 68 ASP~? A 265 GLU B 132 GLU~? A 369 ASP B 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 29 3 RMSD = 1.14 A TRANSFORM 0.5082 -0.1976 0.8383 -0.8568 -0.0173 0.5154 0.0873 0.9801 0.1781 -18.859 42.045 59.323 A 241 ASP B 68 ASP~? A 265 GLU A 132 GLU~? A 369 ASP A 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 24 3 RMSD = 1.16 A TRANSFORM 0.0926 -0.3258 -0.9409 -0.7091 -0.6850 0.1674 0.6990 -0.6517 0.2944 51.592 58.232 76.100 A 241 ASP B 61 ASP~? A 265 GLU A 69 GLU~? A 369 ASP A 61 ASP~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.18 A TRANSFORM 0.9804 0.1238 0.1530 -0.0758 0.9549 -0.2872 0.1817 -0.2700 -0.9456 -68.775 -0.051 -2.213 B 114 HIS A 44 HIS^? B 197 ASP A 56 ASP.? B 223 ALA A 31 ALA^? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.18 A TRANSFORM -0.9777 -0.1290 -0.1659 0.0451 -0.8999 0.4338 0.2053 -0.4167 -0.8856 -24.774 -6.157 -3.060 A 114 HIS A 44 HIS^? A 197 ASP A 56 ASP.? A 223 ALA A 31 ALA^? ULMNm 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 3 3 RMSD = 1.19 A TRANSFORM -0.7804 0.1031 0.6167 -0.3821 0.7021 -0.6009 0.4949 0.7046 0.5085 15.671 23.858 -8.343 A 68 ASP B 68 ASP~? A 74 ASP A 121 ASP~? A 98 GLU B 72 GLU~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 RMSD = 1.20 A TRANSFORM -0.9645 -0.0867 0.2495 0.0690 -0.9945 -0.0787 -0.2550 0.0586 -0.9652 -31.687 38.006 -1.770 B 114 HIS B 44 HIS^? B 197 ASP B 56 ASP.? B 223 ALA B 31 ALA^? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 RMSD = 1.21 A TRANSFORM 0.9607 0.0889 -0.2630 -0.0268 0.9726 0.2310 -0.2763 0.2148 -0.9367 -61.906 -43.831 -8.151 A 114 HIS B 44 HIS^? A 197 ASP B 56 ASP.? A 223 ALA B 31 ALA^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.21 A TRANSFORM 0.2281 0.7999 -0.5552 0.2111 -0.5973 -0.7738 0.9505 -0.0593 0.3051 -19.486 25.582 -15.093 141 ASP B 36 ASP.? 166 GLY A 37 GLY.? 169 GLU B 76 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 13 3 RMSD = 1.21 A TRANSFORM 0.6627 0.1289 -0.7377 0.5793 0.5360 0.6141 -0.4746 0.8343 -0.2805 42.623 29.656 17.434 A 228 ASP B 58 ASP~? A 260 ASP B 140 ASP~? A 329 ASP A 68 ASP~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 6 3 RMSD = 1.22 A TRANSFORM -0.1800 0.4948 -0.8501 -0.7229 0.5196 0.4555 -0.6671 -0.6966 -0.2642 52.755 -26.020 59.615 A 44 HIS B 133 HIS~? A 45 HIS B 44 HIS^? A 261 PHE B 103 PHE^? ULMNm 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 RMSD = 1.23 A TRANSFORM 0.8217 0.0468 0.5680 0.3549 -0.8217 -0.4459 -0.4459 -0.5680 0.6918 -10.329 42.780 33.885 A 68 ASP A 68 ASP~? A 74 ASP B 121 ASP~? A 98 GLU A 72 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 3 3 RMSD = 1.23 A TRANSFORM -0.5725 -0.7406 -0.3518 -0.8043 0.5907 0.0653 -0.1595 -0.3203 0.9338 69.675 76.794 13.966 A 228 ASP A 56 ASP.? A 260 ASP B 61 ASP~? A 329 ASP B 68 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 28 3 RMSD = 1.23 A TRANSFORM 0.7565 -0.4628 -0.4620 0.0224 -0.6878 0.7256 0.6536 0.5592 0.5100 13.461 27.440 44.446 A 241 ASP B 68 ASP~? A 265 GLU A 33 GLU^? A 369 ASP A 56 ASP.? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 3 3 RMSD = 1.24 A TRANSFORM 0.0987 -0.6522 -0.7516 0.7667 -0.4317 0.4753 0.6344 0.6232 -0.4574 72.602 -30.862 10.389 A 44 HIS A 133 HIS~? A 45 HIS A 44 HIS^? A 261 PHE A 103 PHE^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 RMSD = 1.24 A TRANSFORM -0.7926 0.3522 -0.4977 0.0225 0.8326 0.5534 -0.6093 -0.4274 0.6679 22.660 -4.028 86.148 A 241 ASP A 68 ASP~? A 265 GLU B 33 GLU^? A 369 ASP B 56 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.25 A TRANSFORM -0.7377 -0.6749 -0.0193 0.6403 -0.7084 0.2971 0.2142 -0.2068 -0.9546 84.500 25.943 38.271 199 ASP A 56 ASP.? 218 GLU B 26 GLU^? 329 ASP B 68 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 24 3 RMSD = 1.27 A TRANSFORM 0.7301 0.6450 -0.2258 -0.6200 0.7641 0.1782 -0.2874 -0.0099 -0.9577 32.561 16.690 42.541 199 ASP B 56 ASP.? 218 GLU A 26 GLU^? 329 ASP A 68 ASP~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.27 A TRANSFORM -0.2732 -0.7935 0.5439 0.8321 0.0887 0.5474 0.4826 -0.6021 -0.6360 31.758 -3.024 -20.526 B 60 HIS A 35 HIS.? B 84 ASP A 34 ASP.? B 140 GLY A 93 GLY~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 RMSD = 1.28 A TRANSFORM -0.0015 -0.3273 -0.9449 -0.0896 0.9412 -0.3259 -0.9960 -0.0842 0.0308 41.788 28.292 108.109 A 241 ASP A 56 ASP.? A 265 GLU A 132 GLU~? A 369 ASP B 68 ASP~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 2 3 RMSD = 1.28 A TRANSFORM 0.2343 0.9040 0.3575 -0.7835 -0.0421 0.6199 -0.5755 0.4254 -0.6985 -12.410 27.849 -24.014 B 60 HIS B 35 HIS.? B 84 ASP B 34 ASP.? B 140 GLY B 93 GLY~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 9 3 RMSD = 1.28 A TRANSFORM -0.9631 -0.1773 0.2023 -0.2668 0.7261 -0.6337 0.0346 0.6643 0.7467 68.676 45.855 -28.974 199 ASP A 61 ASP~? 242 GLU A 26 GLU^? 329 ASP B 61 ASP~? ULMNm 3 1m53_c03 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.29 A TRANSFORM -0.3142 0.5271 -0.7896 0.5475 -0.5789 -0.6043 0.7756 0.6221 0.1067 31.561 44.228 58.391 A 241 ASP A 121 ASP~? A 295 GLU B 72 GLU~? A 369 ASP B 68 ASP~? ULMNm 3 2hos_d00 TRANSCRIPTION/DNA user 5 3 RMSD = 1.30 A TRANSFORM 0.4405 -0.1547 0.8843 0.8432 0.4095 -0.3484 0.3083 -0.8991 -0.3108 0.051 10.785 66.591 A 5 ARG B 60 ARG~? A 50 LYS B 39 LYS^? A 51 ASN A 75 ASN~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 8 3 RMSD = 1.30 A TRANSFORM -0.0158 0.8881 0.4594 0.6452 -0.3420 0.6833 -0.7639 -0.3072 0.5676 -26.530 6.513 84.585 A 241 ASP A 61 ASP~? A 265 GLU A 69 GLU~? A 369 ASP B 61 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 4 3 RMSD = 1.30 A TRANSFORM -0.7334 -0.2814 -0.6187 -0.5104 -0.3732 0.7747 0.4490 -0.8840 -0.1301 74.292 66.296 37.783 A 228 ASP A 58 ASP~? A 260 ASP A 140 ASP~? A 329 ASP B 68 ASP~? ULMNm 3 1m53_c03 ISOMALTULOSE SYNTHASE user 5 3 RMSD = 1.31 A TRANSFORM 0.2714 -0.6982 -0.6625 -0.5978 0.4172 -0.6846 -0.7543 -0.5818 0.3041 46.869 43.156 109.137 A 241 ASP B 121 ASP~? A 295 GLU A 72 GLU~? A 369 ASP A 68 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 23 3 RMSD = 1.31 A TRANSFORM -0.0851 0.1178 -0.9894 0.0661 -0.9901 -0.1235 0.9942 0.0759 -0.0765 33.709 65.810 71.687 A 241 ASP B 56 ASP.? A 265 GLU B 132 GLU~? A 369 ASP A 68 ASP~? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.31 A TRANSFORM -0.2760 -0.4774 -0.8342 -0.5899 0.7694 -0.2452 -0.7588 -0.4244 0.4940 50.938 2.033 35.984 A 317 GLU A 72 GLU~? A 319 ASP A 68 ASP~? A 359 ARG B 126 ARG~? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.32 A TRANSFORM 0.2244 0.2555 -0.9404 0.5599 -0.8237 -0.0901 0.7976 0.5063 0.3279 27.302 15.179 -9.617 A 317 GLU B 72 GLU~? A 319 ASP B 68 ASP~? A 359 ARG A 126 ARG~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 17 3 RMSD = 1.33 A TRANSFORM -0.6219 0.6016 0.5014 -0.7705 -0.3558 -0.5289 0.1398 0.7152 -0.6848 -11.599 67.019 78.075 A 241 ASP B 56 ASP.? A 279 GLU B 23 GLU.? A 369 ASP A 68 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 14 3 RMSD = 1.33 A TRANSFORM 0.8518 0.5230 -0.0304 0.0910 -0.2049 -0.9746 0.5159 -0.8273 0.2221 5.849 108.460 31.633 A 228 ASP B 61 ASP~? A 260 ASP B 68 ASP~? A 329 ASP A 61 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 9 3 RMSD = 1.34 A TRANSFORM -0.1202 0.1113 -0.9865 0.7395 0.6731 -0.0142 -0.6624 0.7312 0.1632 46.422 4.815 71.493 A 241 ASP A 61 ASP~? A 265 GLU B 69 GLU~? A 369 ASP B 61 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 13 3 RMSD = 1.34 A TRANSFORM -0.2728 -0.4809 -0.8332 0.4274 -0.8365 0.3429 0.8619 0.2625 -0.4338 50.910 51.069 71.139 A 241 ASP A 68 ASP~? A 265 GLU B 164 GLU~? A 369 ASP B 121 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 RMSD = 1.34 A TRANSFORM 0.5203 -0.8391 0.1587 0.8428 0.4746 -0.2537 -0.1376 -0.2658 -0.9542 17.291 37.337 45.432 179 ASP B 36 ASP.? 227 GLU B 90 GLU~? 289 ASP A 83 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 32 3 RMSD = 1.36 A TRANSFORM 0.1807 0.2703 -0.9457 -0.3954 0.9003 0.1818 -0.9005 -0.3411 -0.2696 28.048 28.773 112.702 A 241 ASP B 68 ASP~? A 265 GLU A 164 GLU~? A 369 ASP A 121 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 19 3 RMSD = 1.36 A TRANSFORM 0.9722 0.2139 0.0950 0.2322 -0.8307 -0.5059 0.0293 -0.5139 0.8573 27.618 70.482 -3.894 199 ASP B 61 ASP~? 242 GLU B 26 GLU^? 329 ASP A 61 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.36 A TRANSFORM 0.6792 0.5754 0.4556 0.1333 -0.7072 0.6944 -0.7218 0.4109 0.5570 -8.290 36.857 83.705 A 241 ASP A 36 ASP.? A 265 GLU A 90 GLU~? A 369 ASP B 83 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.37 A TRANSFORM -0.4821 0.8755 0.0338 -0.8741 -0.4780 -0.0869 0.0600 0.0714 -0.9956 -1.233 86.300 35.297 179 ASP A 36 ASP.? 227 GLU A 90 GLU~? 289 ASP B 83 ASP~? ULMNm 3 1bf2_c00 ISOAMYLASE user 2 3 RMSD = 1.37 A TRANSFORM 0.9233 0.3808 0.0503 0.3621 -0.9065 0.2173 -0.1283 0.1824 0.9748 58.594 96.104 18.493 375 ASP B 121 ASP~? 435 GLU A 72 GLU~? 510 ASP A 68 ASP~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.37 A TRANSFORM 0.7187 0.5411 -0.4365 -0.6843 0.4397 -0.5816 0.1228 -0.7168 -0.6864 -13.590 22.219 75.655 B 317 GLU A 72 GLU~? B 319 ASP A 68 ASP~? B 359 ARG B 126 ARG~? ULMNm 3 1kqf_c03 FORMATE DEHYDROGENASE, NITRATE-INDUCuser 6 3 RMSD = 1.38 A TRANSFORM 0.6992 0.1110 0.7062 0.1659 0.9357 -0.3114 0.6954 -0.3349 -0.6358 -15.105 22.478 135.997 A 94 LYS B 154 LYS~? A 197 HIS B 44 HIS^? A 446 ARG B 126 ARG~? ULMNm 3 1ro7_c03 ALPHA-2,3/8-SIALYLTRANSFERASE user 4 3 RMSD = 1.38 A TRANSFORM 0.3973 0.6035 -0.6914 0.3910 0.5703 0.7225 -0.8303 0.5573 0.0094 -25.959 -79.412 19.115 D 129 ARG B 126 ARG~? D 156 TYR B 45 TYR^? D 188 HIS B 44 HIS^? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 RMSD = 1.38 A TRANSFORM -0.6161 -0.7874 0.0188 0.4803 -0.3567 0.8013 0.6242 -0.5027 -0.5980 33.505 52.765 52.461 179 ASP A 68 ASP~? 227 GLU B 33 GLU^? 289 ASP B 56 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 26 3 RMSD = 1.39 A TRANSFORM 0.0059 -0.7635 0.6458 -0.6021 0.5129 0.6119 0.7984 0.3925 0.4567 7.078 10.663 42.755 A 241 ASP B 61 ASP~? A 265 GLU B 69 GLU~? A 369 ASP A 61 ASP~? ULMNm 3 1opm_c00 1.14.17.0003 user 2 3 RMSD = 1.39 A TRANSFORM 0.9028 -0.0176 -0.4297 -0.2776 0.7392 -0.6136 -0.3284 -0.6732 -0.6625 48.735 22.000 76.211 A 108 HIS B 133 HIS~? A 170 GLN B 100 GLN^? A 242 HIS B 44 HIS^? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 1.39 A TRANSFORM 0.7044 -0.5022 0.5016 0.6801 0.2751 -0.6795 -0.2033 -0.8198 -0.5353 -9.527 30.921 116.847 A 241 ASP A 56 ASP.? A 279 GLU A 23 GLU.? A 369 ASP B 68 ASP~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.39 A TRANSFORM -0.7553 -0.6069 -0.2474 0.6363 -0.5887 -0.4986 -0.1569 0.5340 -0.8308 35.094 20.749 54.684 B 317 GLU B 72 GLU~? B 319 ASP B 68 ASP~? B 359 ARG A 126 ARG~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 16 3 RMSD = 1.40 A TRANSFORM 0.4721 0.7915 0.3882 0.7177 -0.0893 -0.6906 0.5119 -0.6046 0.6102 15.937 47.703 11.679 199 ASP B 56 ASP.? 242 GLU B 6 GLU~? 329 ASP A 68 ASP~? ULMNm 3 1euu_c00 SIALIDASE user 7 3 RMSD = 1.40 A TRANSFORM -0.6848 -0.4430 -0.5786 -0.1204 0.8519 -0.5097 -0.7187 0.2793 0.6367 54.813 -16.678 19.222 92 ASP A 58 ASP~? 260 GLU A 22 GLU.? 370 TYR A 45 TYR^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 28 3 RMSD = 1.41 A TRANSFORM 0.1848 0.6490 0.7380 0.9822 -0.1478 -0.1159 -0.0339 -0.7463 0.6648 -4.029 86.049 7.916 193 ASP B 68 ASP~? 231 ASP B 83 ASP~? 294 ASP A 56 ASP.? ULMNm 3 1ro7_c03 ALPHA-2,3/8-SIALYLTRANSFERASE user 2 3 RMSD = 1.41 A TRANSFORM -0.4425 -0.7464 -0.4971 -0.3292 -0.3805 0.8642 0.8342 -0.5461 0.0774 15.720 -47.886 13.761 D 129 ARG A 126 ARG~? D 156 TYR A 45 TYR^? D 188 HIS A 44 HIS^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 11 3 RMSD = 1.42 A TRANSFORM -0.1298 -0.4630 0.8768 -0.9890 0.1233 -0.0813 0.0705 0.8778 0.4739 24.312 113.840 -27.337 193 ASP A 68 ASP~? 231 ASP A 83 ASP~? 294 ASP B 56 ASP.? ULMNm 3 1euu_c00 SIALIDASE user 15 3 RMSD = 1.42 A TRANSFORM 0.6346 0.2584 -0.7284 0.0662 -0.9572 -0.2819 0.7700 -0.1307 0.6245 18.774 16.287 2.709 92 ASP B 58 ASP~? 260 GLU B 22 GLU.? 370 TYR B 45 TYR^? ULMNm 3 1vom_c00 MYOSIN user 1 3 RMSD = 1.42 A TRANSFORM -0.9765 -0.0020 -0.2155 -0.0861 0.9202 0.3818 -0.1976 -0.3914 0.8988 81.672 20.654 -30.896 233 ASN B 75 ASN~? 457 GLY A 37 GLY.? 459 GLU A 33 GLU^? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 12 3 RMSD = 1.43 A TRANSFORM 0.9745 0.2082 0.0838 0.2213 -0.8288 -0.5139 0.0376 -0.5194 0.8537 -58.313 72.009 48.819 D 130 SER A 82 SER~? D 166 PHE A 99 PHE^? D 182 PHE A 29 PHE^? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 26 3 RMSD = 1.43 A TRANSFORM -0.9682 -0.1821 0.1715 -0.2501 0.6957 -0.6734 -0.0033 0.6949 0.7191 -17.292 48.561 24.141 D 130 SER B 82 SER~? D 166 PHE B 99 PHE^? D 182 PHE B 29 PHE^? ULMNm 3 1opm_c00 1.14.17.0003 user 1 3 RMSD = 1.43 A TRANSFORM -0.9421 -0.1237 -0.3115 0.2613 -0.8532 -0.4513 0.2100 0.5066 -0.8362 80.771 45.303 44.111 A 108 HIS A 133 HIS~? A 170 GLN A 100 GLN^? A 242 HIS A 44 HIS^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 RMSD = 1.44 A TRANSFORM -0.3333 -0.9051 -0.2639 -0.4176 -0.1093 0.9020 0.8453 -0.4108 0.3416 91.110 21.597 8.864 199 ASP A 68 ASP~? 218 GLU B 90 GLU~? 329 ASP B 56 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 21 3 RMSD = 1.44 A TRANSFORM 0.6113 0.7652 -0.2018 -0.4229 0.5314 0.7340 -0.6690 0.3634 -0.6484 -19.307 49.561 56.311 179 ASP B 68 ASP~? 227 GLU A 33 GLU^? 289 ASP A 56 ASP.? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 11 3 RMSD = 1.46 A TRANSFORM -0.7704 0.1787 -0.6120 -0.2145 0.8313 0.5128 -0.6004 -0.5264 0.6021 -1.862 29.351 116.393 B 130 SER A 82 SER~? B 166 PHE A 99 PHE^? B 182 PHE A 29 PHE^? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.46 A TRANSFORM 0.7112 0.0654 -0.6999 -0.3538 -0.8271 -0.4368 0.6075 -0.5583 0.5651 8.987 38.386 -4.800 B 99 ARG A 126 ARG~? B 101 ASP A 56 ASP.? B 132 ASP B 68 ASP~? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.46 A TRANSFORM -0.5145 0.8238 -0.2381 -0.8209 -0.5534 -0.1410 0.2479 -0.1229 -0.9610 23.328 79.964 75.743 D 203 GLN A 130 GLN~? D 207 HIS A 44 HIS^? D 385 TYR A 30 TYR^? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 25 3 RMSD = 1.46 A TRANSFORM 0.7437 -0.3113 -0.5917 0.2431 -0.6985 0.6731 0.6228 0.6443 0.4438 -17.241 53.143 71.237 B 130 SER B 82 SER~? B 166 PHE B 99 PHE^? B 182 PHE B 29 PHE^? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 6 3 RMSD = 1.46 A TRANSFORM -0.8358 -0.5373 0.1128 -0.1377 0.0062 -0.9904 -0.5314 0.8434 0.0792 57.560 107.929 14.698 A 228 ASP A 61 ASP~? A 260 ASP A 68 ASP~? A 329 ASP B 61 ASP~? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.46 A TRANSFORM 0.4157 -0.9025 -0.1130 0.8395 0.4285 -0.3342 -0.3500 -0.0440 -0.9357 43.355 33.272 83.090 D 203 GLN B 130 GLN~? D 207 HIS B 44 HIS^? D 385 TYR B 30 TYR^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 32 3 RMSD = 1.47 A TRANSFORM 0.3045 0.8237 -0.4784 0.4661 0.3091 0.8290 -0.8307 0.4754 0.2898 44.509 -2.030 19.058 199 ASP B 68 ASP~? 218 GLU A 90 GLU~? 329 ASP A 56 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 RMSD = 1.47 A TRANSFORM -0.9926 0.1044 -0.0618 -0.0294 0.2868 0.9575 -0.1177 -0.9523 0.2816 21.631 26.791 45.464 179 ASP A 61 ASP~? 227 GLU B 69 GLU~? 289 ASP B 61 ASP~? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.47 A TRANSFORM -0.4831 0.8542 -0.1923 -0.2104 0.1000 0.9725 -0.8499 -0.5103 -0.1314 32.112 15.494 42.728 A 203 GLN A 130 GLN~? A 207 HIS A 44 HIS^? A 385 TYR A 30 TYR^? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.47 A TRANSFORM 0.2889 -0.9456 -0.1495 0.6202 0.0659 0.7817 0.7294 0.3185 -0.6055 52.691 44.831 9.614 B 194 SER A 78 SER~? B 292 ASP B 58 ASP~? B 322 HIS A 35 HIS.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 24 3 RMSD = 1.47 A TRANSFORM 0.3565 0.9343 -0.0043 0.3042 -0.1118 0.9460 -0.8834 0.3386 0.3241 1.356 67.096 7.069 193 ASP B 61 ASP~? 231 ASP A 121 ASP~? 294 ASP A 61 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 3 3 RMSD = 1.47 A TRANSFORM -0.8746 -0.4211 -0.2403 -0.3789 0.2843 0.8807 0.3025 -0.8613 0.4082 67.975 51.547 26.446 A 228 ASP A 56 ASP.? A 261 ASP A 140 ASP~? A 329 ASP B 68 ASP~? ULMNm 3 1cwy_c00 AMYLOMALTASE user 2 3 RMSD = 1.47 A TRANSFORM -0.6725 0.7053 0.2242 -0.1835 -0.4524 0.8727 -0.7170 -0.5458 -0.4337 -44.454 -38.819 34.409 A 293 ASP A 121 ASP~? A 340 GLU B 72 GLU~? A 395 ASP B 68 ASP~? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.47 A TRANSFORM 0.3875 -0.9200 -0.0590 0.3161 0.0724 0.9460 0.8660 0.3852 -0.3189 54.097 8.256 -3.091 A 203 GLN B 130 GLN~? A 207 HIS B 44 HIS^? A 385 TYR B 30 TYR^? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.48 A TRANSFORM 0.4835 -0.8497 0.2105 0.8507 0.5127 0.1159 0.2064 -0.1230 -0.9707 62.738 -11.398 16.771 B 203 GLN A 130 GLN~? B 207 HIS A 44 HIS^? B 385 TYR A 30 TYR^? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.48 A TRANSFORM 0.4713 -0.8707 0.1406 0.1565 -0.0744 -0.9849 -0.8680 -0.4862 -0.1012 53.621 52.593 101.827 C 203 GLN A 130 GLN~? C 207 HIS A 44 HIS^? C 385 TYR A 30 TYR^? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.48 A TRANSFORM -0.3860 0.9192 0.0776 -0.8688 -0.3906 0.3044 -0.3101 -0.0500 -0.9494 40.855 34.627 22.927 B 203 GLN B 130 GLN~? B 207 HIS B 44 HIS^? B 385 TYR B 30 TYR^? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.48 A TRANSFORM -0.6916 -0.0719 0.7187 0.4396 0.7476 0.4978 0.5731 -0.6602 0.4854 13.295 -14.901 -1.216 A 99 ARG A 126 ARG~? A 101 ASP A 56 ASP.? A 132 ASP B 68 ASP~? ULMNm 3 3hde_o00 LYSOZYME user 2 3 RMSD = 1.48 A TRANSFORM 0.1385 0.7196 0.6805 -0.9421 0.3076 -0.1336 0.3054 0.6226 -0.7205 -44.778 4.095 -27.622 A 35 GLU A 22 GLU.? A 44 ASP A 58 ASP~? A 50 THR A 54 THR^? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 2 3 RMSD = 1.48 A TRANSFORM -0.3804 0.9248 0.0041 -0.2662 -0.1053 -0.9582 0.8857 0.3656 -0.2862 30.867 59.345 56.315 C 203 GLN B 130 GLN~? C 207 HIS B 44 HIS^? C 385 TYR B 30 TYR^? ULMNm 3 1cwy_c00 AMYLOMALTASE user 4 3 RMSD = 1.49 A TRANSFORM 0.7013 -0.6288 0.3358 0.2325 0.6471 0.7261 0.6739 0.4311 -0.6001 -40.272 -68.530 -9.293 A 293 ASP B 121 ASP~? A 340 GLU A 72 GLU~? A 395 ASP A 68 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.49 A TRANSFORM -0.7565 -0.2189 -0.6163 0.3141 0.7050 -0.6359 -0.5737 0.6746 0.4646 39.635 -4.559 -10.288 B 99 ARG B 126 ARG~? B 101 ASP B 56 ASP.? B 132 ASP A 68 ASP~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.49 A TRANSFORM 0.5477 -0.8363 -0.0248 -0.2562 -0.1959 0.9465 0.7965 0.5121 0.3216 55.873 39.976 -71.380 D 465 GLY B 135 GLY~? D 501 ASP B 61 ASP~? E 367 TYR B 115 TYR.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 21 3 RMSD = 1.49 A TRANSFORM 0.8456 0.3400 -0.4116 0.4619 -0.0792 0.8834 -0.2677 0.9371 0.2240 23.792 45.231 -1.123 A 228 ASP B 56 ASP.? A 261 ASP B 140 ASP~? A 329 ASP A 68 ASP~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 6 3 RMSD = 1.49 A TRANSFORM -0.6831 0.0901 -0.7247 -0.1622 0.9489 0.2708 -0.7121 -0.3026 0.6336 20.343 40.974 63.876 C 130 SER A 78 SER~? C 166 PHE A 29 PHE^? C 182 PHE A 99 PHE^?