*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 0.84 A TRANSFORM -0.6624 0.7491 -0.0085 -0.7275 -0.6405 0.2459 0.1788 0.1691 0.9692 11.909 37.757 -23.342 141 ASP A 26 ASP~? 166 GLY A 46 GLY~? 169 GLU A 43 GLU^? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 0.85 A TRANSFORM 0.9810 0.0791 -0.1774 0.1058 0.5484 0.8295 0.1629 -0.8325 0.5296 -28.500 25.400 100.765 B 137 ARG A 18 ARG.? B 141 THR A 59 THR~? B 235 ASP B 12 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 21 3 RMSD = 0.91 A TRANSFORM -0.9099 -0.3683 -0.1909 0.4118 -0.7473 -0.5215 0.0494 -0.5531 0.8316 65.673 106.496 -4.778 193 ASP A 48 ASP~? 231 ASP A 15 ASP~? 294 ASP A 33 ASP^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 15 3 RMSD = 0.92 A TRANSFORM -0.3330 -0.6746 -0.6588 0.5960 0.3909 -0.7014 0.7307 -0.6262 0.2719 56.318 -14.243 -57.336 A 49 ASP B 99 ASP^? A 147 THR A 97 THR^? A 294 ASP A 120 ASP.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 7 3 RMSD = 0.94 A TRANSFORM 0.3230 0.6714 0.6670 0.0669 -0.7192 0.6916 0.9440 -0.1788 -0.2772 -43.535 15.945 -69.716 A 49 ASP A 99 ASP^? A 147 THR B 97 THR^? A 294 ASP B 120 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 0.94 A TRANSFORM -0.9992 0.0405 -0.0065 0.0406 0.9540 -0.2969 -0.0059 -0.2969 -0.9549 50.214 -35.957 40.474 141 ASP B 26 ASP~? 166 GLY B 46 GLY~? 169 GLU B 43 GLU^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 61 3 RMSD = 0.95 A TRANSFORM -0.0348 -0.8073 -0.5890 -0.5934 -0.4576 0.6622 -0.8042 0.3726 -0.4631 68.419 102.343 75.261 A 228 ASP B 99 ASP^? A 261 ASP A 15 ASP~? A 329 ASP A 99 ASP^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 28 3 RMSD = 0.97 A TRANSFORM 0.6199 0.5248 0.5834 -0.0130 0.7503 -0.6610 -0.7846 0.4022 0.4719 -27.776 65.209 54.071 A 228 ASP A 99 ASP^? A 261 ASP B 15 ASP~? A 329 ASP B 99 ASP^? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 RMSD = 0.98 A TRANSFORM 0.5402 -0.8065 0.2403 -0.3093 -0.4559 -0.8345 0.7826 0.3765 -0.4958 11.269 110.541 55.702 B 137 ARG B 18 ARG.? B 141 THR B 59 THR~? B 235 ASP A 12 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 6 3 RMSD = 1.11 A TRANSFORM -0.5857 -0.3246 -0.7427 -0.7251 0.6193 0.3011 0.3623 0.7149 -0.5981 69.185 82.974 25.937 A 228 ASP A 48 ASP~? A 260 ASP A 25 ASP~? A 329 ASP A 33 ASP^? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.11 A TRANSFORM -0.5506 0.7875 0.2769 0.2604 -0.1531 0.9533 0.7931 0.5970 -0.1208 -36.612 5.589 -17.857 D 603 HIS B 66 HIS^? D 646 ASP B 15 ASP~? D 739 GLY B 70 GLY.? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.12 A TRANSFORM -0.9573 -0.0496 -0.2847 0.2886 -0.1135 -0.9507 0.0149 -0.9923 0.1230 19.941 42.500 62.702 D 603 HIS A 66 HIS^? D 646 ASP A 15 ASP~? D 739 GLY A 70 GLY.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.13 A TRANSFORM 0.4682 0.8540 0.2271 0.2776 -0.3861 0.8797 0.8389 -0.3488 -0.4178 -15.940 57.495 9.841 A 228 ASP A 12 ASP~? A 261 ASP A 99 ASP^? A 329 ASP B 63 ASP^? ULMNm 3 1ddj_c12 PLASMINOGEN user 3 3 RMSD = 1.13 A TRANSFORM -0.0946 0.1444 -0.9850 0.7778 0.6283 0.0174 0.6214 -0.7645 -0.1717 38.256 -4.111 -3.564 A 603 HIS B 66 HIS^? A 646 ASP B 15 ASP~? A 739 GLY A 88 GLY.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 39 3 RMSD = 1.14 A TRANSFORM -0.3802 -0.9015 -0.2066 0.4689 0.0046 -0.8832 0.7972 -0.4327 0.4210 86.961 72.960 -2.960 A 228 ASP B 12 ASP~? A 261 ASP B 99 ASP^? A 329 ASP A 63 ASP^? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 1.14 A TRANSFORM -0.1768 -0.0147 0.9841 -0.0238 -0.9995 -0.0192 0.9840 -0.0268 0.1763 6.209 84.507 -50.575 A 603 HIS A 66 HIS^? A 646 ASP A 15 ASP~? A 739 GLY B 88 GLY.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.14 A TRANSFORM -0.8666 0.3282 0.3759 0.3074 0.9445 -0.1159 -0.3931 0.0151 -0.9194 21.152 -21.881 27.693 141 ASP A 26 ASP~? 166 GLY A 70 GLY.? 169 GLU A 81 GLU.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 23 3 RMSD = 1.15 A TRANSFORM -0.2958 0.9337 0.2019 0.5525 -0.0053 0.8335 0.7793 0.3581 -0.5143 8.871 23.487 -3.927 A 228 ASP A 63 ASP^? A 261 ASP B 102 ASP^? A 329 ASP B 12 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.15 A TRANSFORM -0.7884 0.4883 -0.3741 -0.5687 -0.8104 0.1407 -0.2345 0.3236 0.9167 27.892 67.867 -27.532 141 ASP B 26 ASP~? 166 GLY B 70 GLY.? 169 GLU B 81 GLU.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.16 A TRANSFORM 0.4044 0.8460 0.3475 0.3599 0.2021 -0.9108 -0.8408 0.4934 -0.2228 20.180 4.728 52.985 B 1 ALA A 108 ALA.? B 74 ASN A 107 ASN.? B 75 GLY A 110 GLY.? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.17 A TRANSFORM 0.0701 -0.1618 -0.9843 -0.5853 -0.8057 0.0907 -0.8078 0.5698 -0.1512 -11.795 65.338 140.281 D 1 ALA A 108 ALA.? D 74 ASN A 107 ASN.? D 75 GLY A 110 GLY.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 55 3 RMSD = 1.19 A TRANSFORM -0.9128 -0.3382 -0.2288 0.3670 -0.4338 -0.8229 0.1791 -0.8351 0.5201 85.926 79.799 39.637 A 228 ASP B 63 ASP^? A 261 ASP A 102 ASP^? A 329 ASP A 12 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.21 A TRANSFORM -0.9400 -0.0117 0.3410 0.1809 -0.8645 0.4690 0.2893 0.5026 0.8147 54.801 11.296 8.083 A 316 ALA A 49 ALA~? A 317 GLY A 46 GLY~? A 318 ASP A 48 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 2 3 RMSD = 1.22 A TRANSFORM 0.3733 0.9109 -0.1760 -0.3572 0.3162 0.8789 0.8562 -0.2652 0.4434 -7.913 63.333 -5.626 A 228 ASP A 12 ASP~? A 260 ASP A 63 ASP^? A 329 ASP B 63 ASP^? ULMNm 3 1ddj_c12 PLASMINOGEN user 4 3 RMSD = 1.23 A TRANSFORM -0.3479 -0.7368 -0.5797 0.6434 0.2621 -0.7192 0.6819 -0.6232 0.3829 75.845 32.641 -24.408 A 603 HIS B 66 HIS^? A 646 ASP B 15 ASP~? A 739 GLY B 70 GLY.? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM 0.3631 0.7282 0.5813 0.1825 -0.6673 0.7221 0.9137 -0.1561 -0.3752 -26.814 53.119 -33.979 A 603 HIS A 66 HIS^? A 646 ASP A 15 ASP~? A 739 GLY A 70 GLY.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 3 3 RMSD = 1.23 A TRANSFORM 0.2994 0.9378 -0.1756 0.8477 -0.1770 0.5000 0.4378 -0.2986 -0.8480 -4.823 29.637 33.138 A 228 ASP A 15 ASP~? A 260 ASP A 99 ASP^? A 329 ASP B 63 ASP^? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM -0.9029 0.1503 -0.4027 0.3669 -0.2185 -0.9042 -0.2239 -0.9642 0.1422 16.811 43.496 8.579 B 603 HIS A 66 HIS^? B 646 ASP A 15 ASP~? B 739 GLY A 70 GLY.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 21 3 RMSD = 1.24 A TRANSFORM -0.4889 -0.8535 0.1800 -0.4568 0.0747 -0.8864 0.7431 -0.5156 -0.4265 79.640 112.046 25.439 A 228 ASP B 12 ASP~? A 260 ASP B 63 ASP^? A 329 ASP A 63 ASP^? ULMNm 3 1ddj_c13 PLASMINOGEN user 4 3 RMSD = 1.24 A TRANSFORM -0.6759 0.6222 0.3950 0.3918 -0.1506 0.9076 0.6242 0.7682 -0.1420 -24.917 2.674 -78.835 B 603 HIS B 66 HIS^? B 646 ASP B 15 ASP~? B 739 GLY B 70 GLY.? ULMNm 3 1ddj_c13 PLASMINOGEN user 3 3 RMSD = 1.24 A TRANSFORM -0.8232 0.1155 0.5558 0.1524 -0.8982 0.4123 0.5469 0.4241 0.7218 -1.913 54.289 -80.614 B 603 HIS B 66 HIS^? B 646 ASP B 15 ASP~? B 739 GLY A 88 GLY.? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.24 A TRANSFORM -0.5907 0.5829 -0.5579 0.8069 0.4275 -0.4077 0.0008 -0.6910 -0.7229 -4.156 -0.356 9.379 B 603 HIS A 66 HIS^? B 646 ASP A 15 ASP~? B 739 GLY B 88 GLY.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 24 3 RMSD = 1.25 A TRANSFORM -0.5532 -0.8141 0.1767 0.6605 -0.5579 -0.5025 0.5076 -0.1613 0.8463 82.010 70.940 -9.465 A 228 ASP B 15 ASP~? A 260 ASP B 99 ASP^? A 329 ASP A 63 ASP^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 RMSD = 1.25 A TRANSFORM -0.1657 -0.6935 -0.7011 -0.4248 0.6918 -0.5839 0.8900 0.2011 -0.4093 39.874 74.721 6.961 179 ASP A 20 ASP~? 214 ASP A 78 ASP.? 289 ASP A 26 ASP~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.25 A TRANSFORM -0.3664 -0.7666 -0.5273 0.5885 0.2481 -0.7695 0.7208 -0.5922 0.3602 74.130 36.267 36.178 C 603 HIS B 66 HIS^? C 646 ASP B 15 ASP~? C 739 GLY B 70 GLY.? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.25 A TRANSFORM 0.3757 0.7610 0.5289 0.1594 -0.6152 0.7721 0.9130 -0.2057 -0.3524 -29.750 51.129 30.014 C 603 HIS A 66 HIS^? C 646 ASP A 15 ASP~? C 739 GLY A 70 GLY.? ULMNm 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 3 3 RMSD = 1.27 A TRANSFORM 0.3664 -0.7244 -0.5839 -0.7977 0.0785 -0.5979 0.4790 0.6849 -0.5491 24.786 83.202 34.200 C 107 ASP B 15 ASP~? C 246 ASP B 120 ASP.? C 275 HIS B 66 HIS^? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 12 3 RMSD = 1.27 A TRANSFORM -0.0645 0.9963 -0.0563 -0.3992 -0.0775 -0.9136 -0.9146 -0.0364 0.4027 -25.803 57.294 81.787 54 ASP B 99 ASP^? 158 THR A 97 THR^? 317 ASP A 120 ASP.? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.28 A TRANSFORM 0.6776 0.1973 -0.7084 -0.6048 -0.3985 -0.6895 -0.4184 0.8957 -0.1507 3.124 76.875 78.491 A 241 ASP A 25 ASP~? A 279 GLU A 34 GLU^? A 369 ASP A 20 ASP~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 4 3 RMSD = 1.29 A TRANSFORM -0.4399 0.8268 -0.3505 -0.2241 0.2769 0.9344 0.8697 0.4896 0.0635 20.141 0.226 -83.429 B 60 HIS B 66 HIS^? B 84 ASP B 15 ASP~? B 140 GLY B 100 GLY^? ULMNm 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 RMSD = 1.29 A TRANSFORM -0.6158 -0.3454 -0.7082 -0.7875 0.2987 0.5391 0.0253 0.8897 -0.4559 128.769 86.294 47.781 32 ASP A 15 ASP~? 64 HIS A 66 HIS^? 155 ASN A 117 ASN^? ULMNm 3 1gns_c00 SUBTILISIN BPN' user 1 3 RMSD = 1.29 A TRANSFORM -0.4585 -0.8873 0.0492 -0.2897 0.0969 -0.9522 0.8402 -0.4508 -0.3015 43.735 67.519 8.064 A 32 ASP A 15 ASP~? A 64 HIS A 66 HIS^? A 155 ASN A 117 ASN^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 14 3 RMSD = 1.29 A TRANSFORM 0.8011 0.5915 0.0915 0.5474 -0.6623 -0.5117 -0.2420 0.4600 -0.8543 -15.252 22.962 23.163 A 67 ASP B 20 ASP~? A 68 ALA B 23 ALA~? A 72 LEU B 27 LEU~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 2 3 RMSD = 1.29 A TRANSFORM -0.9303 -0.1666 0.3267 -0.3368 0.0360 -0.9409 0.1450 -0.9854 -0.0896 59.716 52.039 -0.718 B 60 HIS A 66 HIS^? B 84 ASP A 15 ASP~? B 140 GLY A 100 GLY^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 37 3 RMSD = 1.30 A TRANSFORM -0.2336 -0.8362 0.4962 -0.9444 0.0737 -0.3203 0.2313 -0.5434 -0.8070 59.177 118.253 59.329 A 228 ASP B 12 ASP~? A 261 ASP A 12 ASP~? A 329 ASP A 63 ASP^? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 2 3 RMSD = 1.30 A TRANSFORM 0.4499 -0.8931 -0.0064 -0.8930 -0.4500 0.0130 -0.0144 -0.0001 -0.9999 -32.884 83.152 31.707 A1132 ASP A 102 ASP^? A1134 ALA A 116 ALA^? A1137 ASN A 117 ASN^? ULMNm 3 1gns_c00 SUBTILISIN BPN' user 2 3 RMSD = 1.30 A TRANSFORM 0.4107 0.9117 0.0115 -0.2677 0.1085 0.9574 0.8716 -0.3963 0.2886 -51.930 27.039 -7.316 A 32 ASP B 15 ASP~? A 64 HIS B 66 HIS^? A 155 ASN B 117 ASN^? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 1.30 A TRANSFORM 0.6006 -0.0655 -0.7969 -0.0705 0.9884 -0.1343 0.7965 0.1369 0.5890 10.846 56.433 53.948 B 137 ARG A 55 ARG~? B 141 THR A 59 THR~? B 235 ASP A 26 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.31 A TRANSFORM -0.5755 -0.6732 -0.4644 0.8052 -0.3672 -0.4657 0.1430 -0.6419 0.7533 114.424 8.631 7.844 199 ASP B 99 ASP^? 242 GLU B 43 GLU^? 329 ASP A 99 ASP^? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 1.31 A TRANSFORM -0.0759 0.8647 0.4965 -0.8573 0.1976 -0.4753 -0.5092 -0.4617 0.7263 -31.389 133.144 68.489 A 137 ARG B 18 ARG.? A 141 THR B 59 THR~? A 235 ASP B 12 ASP~? ULMNm 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 2 3 RMSD = 1.31 A TRANSFORM -0.1209 0.6558 0.7452 -0.7162 0.4622 -0.5229 -0.6874 -0.5969 0.4138 44.830 99.770 109.428 32 ASP B 15 ASP~? 64 HIS B 66 HIS^? 155 ASN B 117 ASN^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 3 3 RMSD = 1.32 A TRANSFORM 0.5285 0.6915 -0.4925 -0.6433 0.7047 0.2992 0.5539 0.1587 0.8173 -3.272 71.794 -11.110 A 228 ASP A 12 ASP~? A 261 ASP B 12 ASP~? A 329 ASP B 63 ASP^? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 1.33 A TRANSFORM 0.0881 -0.8583 -0.5056 0.8514 -0.1985 0.4854 -0.5170 -0.4732 0.7133 30.744 28.171 69.648 C 137 ARG B 18 ARG.? C 141 THR B 59 THR~? C 235 ASP B 12 ASP~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 4 3 RMSD = 1.33 A TRANSFORM 0.9725 0.2273 0.0501 -0.2255 0.9735 -0.0385 -0.0575 0.0261 0.9980 -93.668 9.516 -8.121 A1132 ASP B 102 ASP^? A1134 ALA B 116 ALA^? A1137 ASN B 117 ASN^? ULMNm 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 1 3 RMSD = 1.33 A TRANSFORM 0.3776 0.8933 0.2439 -0.6404 0.4422 -0.6280 -0.6688 0.0809 0.7390 13.047 27.764 42.555 104 ASN A 117 ASN^? 192 ASP A 15 ASP~? 195 HIS A 66 HIS^? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 1 3 RMSD = 1.33 A TRANSFORM -0.7701 0.0874 -0.6320 -0.6378 -0.0857 0.7654 0.0128 0.9925 0.1218 111.665 52.665 43.077 A 170 SER A 32 SER^? A 239 VAL A 113 VAL^? A 413 ASN A 107 ASN.? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 RMSD = 1.34 A TRANSFORM -0.7264 -0.4778 -0.4940 -0.6844 0.5692 0.4557 0.0635 0.6691 -0.7405 61.043 94.405 36.923 A 137 ARG A 18 ARG.? A 141 THR A 59 THR~? A 235 ASP A 12 ASP~? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 RMSD = 1.34 A TRANSFORM 0.7272 0.4659 0.5041 0.6831 -0.5631 -0.4651 0.0671 0.6825 -0.7278 -60.986 66.888 36.236 C 137 ARG A 18 ARG.? C 141 THR A 59 THR~? C 235 ASP A 12 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 RMSD = 1.35 A TRANSFORM 0.1496 -0.9790 -0.1386 0.7351 0.0163 0.6778 -0.6613 -0.2033 0.7221 70.336 -32.324 27.687 A 67 ASP A 20 ASP~? A 68 ALA A 23 ALA~? A 72 LEU A 27 LEU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.35 A TRANSFORM 0.1887 0.8669 0.4614 0.7837 -0.4161 0.4612 0.5918 0.2745 -0.7579 11.420 -8.047 -10.447 199 ASP A 99 ASP^? 242 GLU A 43 GLU^? 329 ASP B 99 ASP^? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 RMSD = 1.35 A TRANSFORM -0.7738 -0.3220 -0.5455 -0.3031 -0.5680 0.7652 -0.5562 0.7575 0.3419 70.363 69.666 34.931 B 1 SER B 90 SER.? B 69 ALA B 60 ALA~? B 241 ASN B 61 ASN^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 2 3 RMSD = 1.35 A TRANSFORM 0.1148 0.9918 -0.0566 0.0367 0.0527 0.9979 0.9927 -0.1166 -0.0303 -27.297 0.083 -49.642 I 303 TYR B 114 TYR^? I 306 VAL B 38 VAL^? I 308 VAL B 118 VAL^? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.36 A TRANSFORM -0.2088 0.8135 0.5428 0.2620 0.5813 -0.7704 -0.9422 -0.0186 -0.3345 -13.651 39.531 90.940 B 1 SER A 90 SER.? B 69 ALA A 60 ALA~? B 241 ASN A 61 ASN^? ULMNm 3 1oqz_c01 GLUTARYL ACYLASE user 1 3 RMSD = 1.36 A TRANSFORM 0.7713 -0.1035 0.6280 -0.6355 -0.0693 0.7690 -0.0361 -0.9922 -0.1192 -6.135 18.091 12.760 B 170 SER A 32 SER^? B 239 VAL A 113 VAL^? B 413 ASN A 107 ASN.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.36 A TRANSFORM -0.6785 -0.7250 0.1185 -0.0197 -0.1433 -0.9895 0.7343 -0.6737 0.0830 59.190 48.630 -21.677 I 303 TYR A 114 TYR^? I 306 VAL A 38 VAL^? I 308 VAL A 118 VAL^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 RMSD = 1.36 A TRANSFORM 0.1519 0.0733 0.9857 -0.0915 0.9940 -0.0599 -0.9841 -0.0811 0.1577 18.913 -32.460 59.131 A 67 ASP B 20 ASP~? A 68 ALA B 16 ALA~? A 72 LEU B 13 LEU~? ULMNm 3 1ig8_c00 HEXOKINASE PII user 2 3 RMSD = 1.36 A TRANSFORM -0.2537 0.9642 0.0776 -0.4561 -0.0485 -0.8886 -0.8530 -0.2609 0.4520 -18.100 129.468 49.019 A 158 SER B 32 SER^? A 173 ARG B 9 ARG~? A 211 ASP B 33 ASP^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 22 3 RMSD = 1.37 A TRANSFORM -0.6188 -0.7315 -0.2865 0.7128 -0.3695 -0.5962 0.3302 -0.5731 0.7500 60.402 96.257 -11.914 193 ASP A 48 ASP~? 231 ASP A 20 ASP~? 294 ASP A 33 ASP^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 41 3 RMSD = 1.37 A TRANSFORM 0.1444 -0.8443 -0.5161 -0.3897 -0.5280 0.7546 -0.9096 0.0921 -0.4052 69.428 128.238 54.927 193 ASP B 20 ASP~? 231 ASP B 33 ASP^? 294 ASP B 15 ASP~? ULMNm 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 2 3 RMSD = 1.38 A TRANSFORM -0.4607 -0.8298 -0.3151 -0.7513 0.1755 0.6362 -0.4726 0.5298 -0.7043 117.126 15.500 49.030 104 ASN B 117 ASN^? 192 ASP B 15 ASP~? 195 HIS B 66 HIS^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.40 A TRANSFORM 0.8013 -0.4213 -0.4248 0.1942 0.8548 -0.4813 0.5659 0.3032 0.7667 42.420 -11.565 -24.689 A 67 ASP A 20 ASP~? A 68 ALA A 23 ALA~? A 72 LEU A 13 LEU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.40 A TRANSFORM -0.2317 0.5644 0.7923 0.8038 -0.3476 0.4827 0.5479 0.7488 -0.3731 -18.840 -31.482 -34.634 141 ASP A 63 ASP^? 166 GLY A 100 GLY^? 169 GLU A 81 GLU.? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 34 3 RMSD = 1.41 A TRANSFORM 0.1534 -0.9846 0.0835 -0.8987 -0.1741 -0.4025 0.4109 -0.0133 -0.9116 28.698 124.311 36.944 179 ASP B 12 ASP~? 214 ASP A 121 ASP.? 289 ASP A 63 ASP^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.42 A TRANSFORM 0.3935 -0.0552 -0.9177 -0.8518 -0.3973 -0.3414 -0.3457 0.9160 -0.2033 151.335 61.003 7.606 A 316 ALA A 49 ALA~? A 317 GLY A 46 GLY~? A 318 ASP A 48 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 14 3 RMSD = 1.42 A TRANSFORM -0.4381 0.3073 0.8448 0.5797 -0.6217 0.5268 0.6870 0.7205 0.0942 21.808 57.641 -11.532 A 228 ASP A 26 ASP~? A 261 ASP A 63 ASP^? A 329 ASP A 20 ASP~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.42 A TRANSFORM 0.9176 -0.3356 -0.2129 -0.2899 -0.9316 0.2191 -0.2719 -0.1393 -0.9522 -8.141 92.845 -0.551 D 465 GLY A 88 GLY.? D 501 ASP A 121 ASP.? E 367 TYR B 114 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 8 3 RMSD = 1.42 A TRANSFORM -0.5896 -0.1692 -0.7898 0.7670 -0.4239 -0.4817 -0.2532 -0.8898 0.3797 53.396 -7.456 37.964 141 ASP B 63 ASP^? 166 GLY B 100 GLY^? 169 GLU B 81 GLU.? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 13 3 RMSD = 1.43 A TRANSFORM 0.5465 0.8356 0.0549 0.3298 -0.1544 -0.9314 -0.7698 0.5271 -0.3600 -59.769 16.271 75.245 54 ASP B 99 ASP^? 158 THR B 97 THR^? 317 ASP A 120 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 27 3 RMSD = 1.43 A TRANSFORM -0.3929 -0.8968 -0.2035 0.5367 -0.4033 0.7411 -0.7467 0.1820 0.6398 80.506 49.307 46.082 A 228 ASP B 63 ASP^? A 260 ASP A 63 ASP^? A 329 ASP A 12 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 10 3 RMSD = 1.43 A TRANSFORM 0.4596 0.8654 0.1994 0.6592 -0.1819 -0.7296 -0.5951 0.4668 -0.6541 -22.255 67.205 56.993 A 228 ASP A 63 ASP^? A 260 ASP B 63 ASP^? A 329 ASP B 12 ASP~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.44 A TRANSFORM 0.7872 0.5083 -0.3493 -0.5275 0.8483 0.0457 0.3195 0.1483 0.9359 -37.439 27.517 -67.641 A 465 GLY A 88 GLY.? A 501 ASP A 121 ASP.? B 367 TYR B 114 TYR^? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 RMSD = 1.45 A TRANSFORM 0.7614 0.4694 0.4471 -0.6446 0.4751 0.5989 0.0687 -0.7442 0.6644 -63.290 90.736 98.360 D 137 ARG A 18 ARG.? D 141 THR A 59 THR~? D 235 ASP A 12 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 42 3 RMSD = 1.45 A TRANSFORM -0.0945 -0.0649 -0.9934 0.9934 0.0592 -0.0984 0.0652 -0.9961 0.0588 57.748 23.244 60.562 A 228 ASP B 15 ASP~? A 261 ASP A 99 ASP^? A 329 ASP B 63 ASP^? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 RMSD = 1.45 A TRANSFORM -0.6049 0.5801 0.5456 -0.2111 0.5438 -0.8123 -0.7678 -0.6065 -0.2064 64.736 45.374 135.830 A 170 SER B 32 SER^? A 239 VAL B 113 VAL^? A 413 ASN B 107 ASN.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.46 A TRANSFORM -0.0095 0.9256 0.3784 -0.9521 0.1072 -0.2863 -0.3056 -0.3630 0.8803 1.604 19.351 -55.073 B 250 ALA A 49 ALA~? B 251 GLY A 46 GLY~? B 252 ASP A 48 ASP~? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 RMSD = 1.46 A TRANSFORM -0.8016 0.5666 0.1907 -0.3933 -0.2595 -0.8820 -0.4503 -0.7820 0.4309 31.587 127.618 177.780 B 109 ASP B 102 ASP^? B 182 GLU B 81 GLU.? B 286 ASN B 117 ASN^? ULMNm 3 1oqz_c01 GLUTARYL ACYLASE user 2 3 RMSD = 1.47 A TRANSFORM 0.6184 -0.5715 -0.5394 -0.2220 0.5314 -0.8175 0.7539 0.6253 0.2018 39.243 12.504 -80.862 B 170 SER B 32 SER^? B 239 VAL B 113 VAL^? B 413 ASN B 107 ASN.? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 RMSD = 1.47 A TRANSFORM -0.7652 0.1665 -0.6219 -0.4020 0.6311 0.6634 0.5029 0.7576 -0.4160 81.160 23.250 61.004 A 109 ASP B 102 ASP^? A 182 GLU B 81 GLU.? A 286 ASN B 117 ASN^? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 RMSD = 1.47 A TRANSFORM 0.1028 -0.8880 -0.4482 -0.7553 0.2236 -0.6161 0.6473 0.4019 -0.6477 28.034 128.706 62.863 D 137 ARG B 18 ARG.? D 141 THR B 59 THR~? D 235 ASP B 12 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 4 3 RMSD = 1.47 A TRANSFORM 0.8160 0.3266 -0.4770 -0.5677 0.6084 -0.5546 0.1090 0.7233 0.6819 -4.632 83.914 -7.315 A 228 ASP A 12 ASP~? A 261 ASP B 20 ASP~? A 329 ASP B 63 ASP^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 13 3 RMSD = 1.47 A TRANSFORM 0.8641 -0.1119 0.4907 -0.3696 -0.8028 0.4678 0.3416 -0.5856 -0.7351 6.917 48.920 44.034 A 67 ASP B 20 ASP~? A 68 ALA B 23 ALA~? A 72 LEU B 13 LEU~? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 RMSD = 1.48 A TRANSFORM -0.3126 -0.9476 -0.0665 0.3342 -0.1752 0.9261 -0.8891 0.2673 0.3715 38.105 -21.909 73.606 54 ASP A 99 ASP^? 158 THR A 97 THR^? 317 ASP B 120 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 38 3 RMSD = 1.48 A TRANSFORM 0.2227 -0.8443 0.4874 -0.8255 0.1026 0.5550 -0.5186 -0.5260 -0.6741 39.344 88.198 88.105 A 228 ASP B 12 ASP~? A 261 ASP A 20 ASP~? A 329 ASP A 63 ASP^? ULMNm 3 1a0j_c13 TRYPSIN user 3 3 RMSD = 1.48 A TRANSFORM 0.4003 0.2178 0.8901 0.1520 -0.9737 0.1699 0.9037 0.0672 -0.4229 -3.643 70.758 11.521 B 57 HIS B 66 HIS^? B 102 ASP B 15 ASP~? B 193 GLY B 100 GLY^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 6 3 RMSD = 1.48 A TRANSFORM -0.0022 0.1098 0.9940 0.5667 -0.8188 0.0917 0.8239 0.5635 -0.0604 6.860 66.496 -20.730 A 228 ASP A 15 ASP~? A 261 ASP B 99 ASP^? A 329 ASP A 63 ASP^? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 4 3 RMSD = 1.49 A TRANSFORM -0.0604 0.9469 -0.3158 -0.9846 -0.0045 0.1749 0.1642 0.3214 0.9326 -14.949 75.274 -14.271 E 57 HIS B 66 HIS^? E 102 ASP B 15 ASP~? E 193 GLY B 100 GLY^? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.49 A TRANSFORM -0.9393 0.2854 -0.1905 -0.0331 0.4772 0.8782 0.3415 0.8311 -0.4388 54.598 51.498 108.641 B 109 ASP A 102 ASP^? B 182 GLU A 81 GLU.? B 286 ASN A 117 ASN^? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 RMSD = 1.50 A TRANSFORM -0.2223 -0.7004 0.6782 0.9750 -0.1574 0.1571 -0.0032 0.6962 0.7179 54.332 -58.035 16.195 A 198 GLY A 88 GLY.? A 228 SER A 94 SER.? A 549 ASP A 92 ASP.? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.50 A TRANSFORM -0.7890 -0.5399 0.2933 -0.5985 0.7832 -0.1684 -0.1388 -0.3085 -0.9411 52.462 39.971 58.364 E 57 HIS A 66 HIS^? E 102 ASP A 15 ASP~? E 193 GLY A 100 GLY^? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.50 A TRANSFORM -0.1371 0.9821 -0.1290 0.9099 0.0734 -0.4082 -0.3915 -0.1733 -0.9037 -64.176 -12.031 62.461 E 49 ASP B 15 ASP~? E 86 HIS B 66 HIS^? E 250 ALA B 85 ALA.? ULMNm 3 2odj_o01 PORIN D user 1 3 RMSD = 1.50 A TRANSFORM -0.1163 -0.9447 0.3065 0.7595 0.1143 0.6404 -0.6400 0.3073 0.7042 17.834 -57.524 84.740 B 156 HIS A 66 HIS^? B 208 ASP A 8 ASP~? B 296 SER B 17 SER.?