*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1uk7_c00 3.07.01.0009 user 5 3 RMSD = 1.04 A TRANSFORM 0.9060 0.3204 0.2767 0.2787 -0.9434 0.1798 0.3186 -0.0857 -0.9440 -2.441 38.250 4.024 A 103 ALA B 42 ALA~? A 224 ASP B 115 ASP~? A 252 HIS B 58 HIS~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 10 3 RMSD = 1.06 A TRANSFORM 0.8131 -0.5417 0.2132 -0.0927 0.2411 0.9661 -0.5747 -0.8053 0.1458 28.903 13.031 14.545 A 229 ALA B 42 ALA~? A 257 ALA B 46 ALA~? A 328 ASP B 59 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.06 A TRANSFORM -0.8174 0.4169 0.3975 0.1142 -0.5591 0.8212 0.5646 0.7166 0.4094 32.910 14.391 5.307 A 229 ALA A 42 ALA~? A 257 ALA A 46 ALA~? A 328 ASP A 59 ASP~? ULMNm 3 1uk7_c00 3.07.01.0009 user 2 3 RMSD = 1.07 A TRANSFORM -0.8935 -0.4114 0.1800 -0.2694 0.8118 0.5181 -0.3593 0.4145 -0.8361 7.016 35.372 5.219 A 103 ALA A 42 ALA~? A 224 ASP A 115 ASP~? A 252 HIS A 58 HIS~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 RMSD = 1.09 A TRANSFORM -0.4407 0.3673 0.8191 -0.3654 0.7601 -0.5374 -0.8199 -0.5361 -0.2008 10.945 -11.477 31.263 A 49 ASP B 115 ASP~? A 86 HIS B 58 HIS~? A 250 ALA B 42 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 RMSD = 1.09 A TRANSFORM -0.4407 0.3673 0.8191 -0.3654 0.7601 -0.5374 -0.8199 -0.5361 -0.2008 10.945 -11.477 31.263 A 49 ASP B 115 ASP~? A 86 HIS B 58 HIS~? A 250 ALA B 42 ALA~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 RMSD = 1.10 A TRANSFORM -0.5162 0.8250 0.2298 -0.0420 -0.2924 0.9554 0.8554 0.4835 0.1856 57.667 -26.223 0.156 C 49 ASP B 115 ASP~? C 86 HIS B 58 HIS~? C 250 ALA B 42 ALA~? ULMNm 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 RMSD = 1.11 A TRANSFORM 0.4707 -0.2983 -0.8303 -0.4039 0.7638 -0.5034 0.7844 0.5724 0.2391 -73.570 24.922 29.403 F 49 ASP B 115 ASP~? F 86 HIS B 58 HIS~? F 250 ALA B 42 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.11 A TRANSFORM 0.4711 -0.6324 0.6149 0.3402 -0.5130 -0.7881 0.8139 0.5805 -0.0265 10.202 -10.700 21.345 A 49 ASP A 115 ASP~? A 86 HIS A 58 HIS~? A 250 ALA A 42 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.11 A TRANSFORM 0.4711 -0.6324 0.6149 0.3402 -0.5130 -0.7881 0.8139 0.5805 -0.0265 10.202 -10.700 21.345 A 49 ASP A 115 ASP~? A 86 HIS A 58 HIS~? A 250 ALA A 42 ALA~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.12 A TRANSFORM 0.5210 -0.8475 -0.1015 0.0811 -0.0692 0.9943 -0.8497 -0.5262 0.0327 58.312 -27.293 10.052 C 49 ASP A 115 ASP~? C 86 HIS A 58 HIS~? C 250 ALA A 42 ALA~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.13 A TRANSFORM 0.6515 -0.2277 0.7237 -0.4269 0.6785 0.5979 -0.6271 -0.6984 0.3448 38.239 -20.144 57.136 A 198 GLY A 36 GLY~? A 228 SER A 114 SER~? A 549 ASP A 115 ASP~? ULMNm 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 RMSD = 1.14 A TRANSFORM -0.5031 0.5718 -0.6480 0.3798 -0.5272 -0.7601 -0.7763 -0.6285 0.0480 -72.221 25.449 39.270 F 49 ASP A 115 ASP~? F 86 HIS A 58 HIS~? F 250 ALA A 42 ALA~? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.14 A TRANSFORM -0.6267 -0.7602 0.1711 -0.0870 -0.1500 -0.9849 0.7744 -0.6321 0.0278 45.486 36.954 30.940 B 158 ASP A 115 ASP~? B 161 ARG A 112 ARG~? B 186 HIS A 58 HIS~? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 RMSD = 1.14 A TRANSFORM 0.6137 -0.7858 -0.0764 -0.1501 -0.2111 0.9659 -0.7751 -0.5813 -0.2475 -0.384 30.493 51.723 A 53 SER A 114 SER~? A 54 PRO A 113 PRO~? A 96 ASP A 115 ASP~? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 RMSD = 1.14 A TRANSFORM 0.6395 0.6525 0.4064 0.0730 0.4747 -0.8771 -0.7653 0.5906 0.2560 36.244 34.529 34.188 B 158 ASP B 115 ASP~? B 161 ARG B 112 ARG~? B 186 HIS B 58 HIS~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 RMSD = 1.15 A TRANSFORM -0.6287 -0.0635 0.7751 0.4746 -0.8209 0.3177 0.6160 0.5676 0.5462 42.869 -19.722 48.809 A 198 GLY B 36 GLY~? A 228 SER B 114 SER~? A 549 ASP B 115 ASP~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 RMSD = 1.17 A TRANSFORM -0.3763 0.7797 -0.5005 0.4387 -0.3259 -0.8374 -0.8160 -0.5347 -0.2194 49.596 -45.902 -2.304 D 49 ASP B 115 ASP~? D 86 HIS B 58 HIS~? D 250 ALA B 42 ALA~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.17 A TRANSFORM 0.0759 0.2798 0.9571 -0.8329 0.5455 -0.0934 -0.5482 -0.7900 0.2744 114.984 69.831 130.025 B1198 GLY A 36 GLY~? B1228 SER A 114 SER~? B1549 ASP A 115 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.18 A TRANSFORM 0.9198 -0.3894 0.0487 -0.0869 -0.3231 -0.9424 0.3827 0.8625 -0.3310 44.580 64.545 17.697 A 229 ALA A 104 ALA.? A 257 ALA A 105 ALA.? A 328 ASP A 73 ASP^? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.19 A TRANSFORM 0.3523 -0.5451 -0.7608 -0.4686 0.6009 -0.6476 0.8101 0.5847 -0.0437 50.423 -44.952 -12.207 D 49 ASP A 115 ASP~? D 86 HIS A 58 HIS~? D 250 ALA A 42 ALA~? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.20 A TRANSFORM 0.7973 -0.2130 0.5647 0.5742 0.5561 -0.6009 -0.1860 0.8034 0.5657 4.988 71.193 50.982 C 603 HIS A 58 HIS~? C 646 ASP A 59 ASP~? C 739 GLY A 124 GLY~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 RMSD = 1.20 A TRANSFORM -0.0264 -0.5928 0.8049 0.8468 -0.4411 -0.2971 0.5312 0.6737 0.5137 117.707 65.808 121.817 B1198 GLY B 36 GLY~? B1228 SER B 114 SER~? B1549 ASP B 115 ASP~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 RMSD = 1.21 A TRANSFORM 0.0950 0.3355 -0.9372 -0.5529 0.8007 0.2306 0.8278 0.4963 0.2616 -8.691 -2.645 34.552 B 49 ASP B 115 ASP~? B 86 HIS B 58 HIS~? B 250 ALA B 42 ALA~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.21 A TRANSFORM -0.1937 -0.9433 0.2695 0.4912 -0.3310 -0.8057 0.8493 -0.0237 0.5274 21.736 49.432 25.480 A 194 SER A 63 SER~? A 292 ASP A 108 ASP^? A 322 HIS B 78 HIS^? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.22 A TRANSFORM 0.8343 -0.1975 0.5148 0.5174 0.6030 -0.6072 -0.1905 0.7729 0.6053 8.560 72.225 -13.023 A 603 HIS A 58 HIS~? A 646 ASP A 59 ASP~? A 739 GLY A 124 GLY~? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.22 A TRANSFORM -0.0606 -0.9976 -0.0321 0.8373 -0.0333 -0.5458 0.5434 -0.0600 0.8373 -25.651 -11.377 12.252 C 51 ALA A 42 ALA~? C 148 HIS A 58 HIS~? C 163 ASP A 115 ASP~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 RMSD = 1.22 A TRANSFORM -0.0960 -0.3354 0.9372 -0.5052 0.8277 0.2444 -0.8576 -0.4500 -0.2489 -53.175 30.025 26.376 E 49 ASP B 115 ASP~? E 86 HIS B 58 HIS~? E 250 ALA B 42 ALA~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.23 A TRANSFORM -0.1343 0.0219 -0.9907 0.5584 -0.8243 -0.0939 -0.8187 -0.5658 0.0985 -6.930 -2.430 44.360 B 49 ASP A 115 ASP~? B 86 HIS A 58 HIS~? B 250 ALA A 42 ALA~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.23 A TRANSFORM 0.8666 -0.4808 0.1335 -0.1529 -0.0011 0.9882 -0.4750 -0.8768 -0.0744 27.008 46.253 17.578 B 194 SER A 63 SER~? B 292 ASP A 108 ASP^? B 322 HIS B 78 HIS^? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.24 A TRANSFORM 0.0736 0.9427 0.3254 -0.8594 0.2255 -0.4589 -0.5060 -0.2459 0.8267 -31.881 -5.228 16.942 C 51 ALA B 42 ALA~? C 148 HIS B 58 HIS~? C 163 ASP B 115 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 27 3 RMSD = 1.24 A TRANSFORM -0.2224 0.1070 -0.9691 0.9749 0.0351 -0.2198 0.0105 -0.9936 -0.1121 51.328 102.039 2.826 193 ASP B 110 ASP^? 231 ASP A 93 ASP^? 294 ASP B 115 ASP~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.24 A TRANSFORM 0.1340 -0.0223 0.9907 0.5098 -0.8558 -0.0882 0.8498 0.5169 -0.1033 -54.947 30.787 16.583 E 49 ASP A 115 ASP~? E 86 HIS A 58 HIS~? E 250 ALA A 42 ALA~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 4 3 RMSD = 1.24 A TRANSFORM -0.3390 0.8644 0.3713 0.3742 0.4860 -0.7898 -0.8632 -0.1287 -0.4882 10.049 10.870 19.648 14 ASP B 131 ASP~? 16 HIS B 0 HIS.? 67 GLY B 124 GLY~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.25 A TRANSFORM -0.9833 -0.1545 -0.0963 -0.1814 0.7852 0.5920 -0.0158 0.5996 -0.8001 16.296 51.113 73.844 C 603 HIS A 58 HIS~? C 646 ASP A 59 ASP~? C 739 GLY B 36 GLY~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 4 3 RMSD = 1.25 A TRANSFORM -0.4550 0.3083 -0.8354 -0.8672 0.0598 0.4943 0.2024 0.9494 0.2402 29.230 6.724 0.996 A 105 ALA B 42 ALA~? A 244 ASP B 115 ASP~? A 271 HIS B 58 HIS~? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 4 3 RMSD = 1.25 A TRANSFORM -0.6123 0.7428 0.2709 0.2009 -0.1852 0.9619 0.7647 0.6434 -0.0359 -0.639 28.578 41.746 A 53 SER B 114 SER~? A 54 PRO B 113 PRO~? A 96 ASP B 115 ASP~? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.26 A TRANSFORM 0.5416 -0.7918 0.2824 0.5789 0.1077 -0.8083 0.6096 0.6012 0.5167 -34.523 50.809 -28.176 B 603 HIS A 58 HIS~? B 646 ASP A 59 ASP~? B 739 GLY B 36 GLY~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 4 3 RMSD = 1.26 A TRANSFORM 0.2070 0.7973 0.5670 -0.5184 0.5809 -0.6276 -0.8297 -0.1641 0.5336 15.276 51.060 32.800 A 194 SER B 63 SER~? A 292 ASP B 108 ASP^? A 322 HIS A 78 HIS^? ULMNm 3 1ddj_c14 PLASMINOGEN user 5 3 RMSD = 1.26 A TRANSFORM -0.7746 -0.0068 0.6324 -0.5962 -0.3259 -0.7337 0.2110 -0.9454 0.2484 10.828 78.434 54.139 C 603 HIS B 58 HIS~? C 646 ASP B 59 ASP~? C 739 GLY B 124 GLY~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 RMSD = 1.27 A TRANSFORM 0.4160 0.0204 -0.9091 0.8891 -0.2189 0.4019 -0.1908 -0.9755 -0.1092 26.462 0.503 8.239 A 105 ALA A 42 ALA~? A 244 ASP A 115 ASP~? A 271 HIS A 58 HIS~? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.27 A TRANSFORM -0.5363 -0.7819 -0.3179 -0.8213 0.3968 0.4098 -0.1943 0.4809 -0.8550 -24.430 30.498 -4.946 B 603 HIS A 58 HIS~? B 646 ASP A 59 ASP~? B 739 GLY A 124 GLY~? ULMNm 3 1ddj_c12 PLASMINOGEN user 5 3 RMSD = 1.28 A TRANSFORM -0.8136 -0.0049 0.5814 -0.5395 -0.3667 -0.7580 0.2169 -0.9303 0.2956 14.753 79.244 -10.032 A 603 HIS B 58 HIS~? A 646 ASP B 59 ASP~? A 739 GLY B 124 GLY~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.28 A TRANSFORM 0.2743 -0.9143 -0.2979 -0.9141 -0.3442 0.2145 -0.2987 0.2135 -0.9302 -29.498 16.069 64.460 B 51 ALA A 42 ALA~? B 148 HIS A 58 HIS~? B 163 ASP A 115 ASP~? ULMNm 3 1ddj_c14 PLASMINOGEN user 4 3 RMSD = 1.29 A TRANSFORM 0.9786 0.1950 -0.0662 0.2058 -0.9382 0.2783 -0.0078 -0.2860 -0.9582 7.188 54.288 76.276 C 603 HIS B 58 HIS~? C 646 ASP B 59 ASP~? C 739 GLY A 36 GLY~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 3 3 RMSD = 1.29 A TRANSFORM -0.8600 0.3991 0.3180 0.1866 -0.3341 0.9239 0.4750 0.8539 0.2128 31.731 45.790 8.834 B 194 SER B 63 SER~? B 292 ASP B 108 ASP^? B 322 HIS A 78 HIS^? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.29 A TRANSFORM 0.8013 0.0374 -0.5971 -0.0107 0.9988 0.0482 0.5982 -0.0322 0.8007 -25.718 8.271 -55.784 H 51 ALA A 42 ALA~? H 148 HIS A 58 HIS~? H 163 ASP A 115 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 RMSD = 1.29 A TRANSFORM 0.5885 -0.7145 0.3782 0.6056 0.6996 0.3793 -0.5357 0.0058 0.8444 40.557 71.383 12.887 229 ASP A 73 ASP^? 264 GLU B 69 GLU.? 328 ASP A 108 ASP^? ULMNm 3 1ddj_c13 PLASMINOGEN user 4 3 RMSD = 1.30 A TRANSFORM -0.5363 0.6364 0.5544 -0.6053 0.1678 -0.7781 -0.5882 -0.7529 0.2952 -34.016 55.562 -19.457 B 603 HIS B 58 HIS~? B 646 ASP B 59 ASP~? B 739 GLY A 36 GLY~? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.30 A TRANSFORM -0.2854 0.9180 0.2755 -0.8937 -0.3588 0.2695 0.3462 -0.1692 0.9228 -2.645 14.844 11.736 A 51 ALA A 42 ALA~? A 148 HIS A 58 HIS~? A 163 ASP A 115 ASP~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.30 A TRANSFORM -0.8282 0.1797 -0.5308 -0.0041 -0.9491 -0.3148 -0.5604 -0.2586 0.7869 -19.524 13.978 -50.568 H 51 ALA B 42 ALA~? H 148 HIS B 58 HIS~? H 163 ASP B 115 ASP~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.30 A TRANSFORM -0.2738 0.9597 0.0627 0.9271 0.2460 0.2828 0.2560 0.1356 -0.9571 -32.747 6.874 62.545 B 51 ALA B 42 ALA~? B 148 HIS B 58 HIS~? B 163 ASP B 115 ASP~? ULMNm 3 1ddj_c13 PLASMINOGEN user 5 3 RMSD = 1.32 A TRANSFORM 0.5208 0.8522 -0.0498 0.8383 -0.4996 0.2182 0.1611 -0.1554 -0.9746 -33.230 26.153 -4.611 B 603 HIS B 58 HIS~? B 646 ASP B 59 ASP~? B 739 GLY B 124 GLY~? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.32 A TRANSFORM 0.2840 -0.9550 -0.0851 0.9092 0.2400 0.3402 -0.3045 -0.1740 0.9365 0.512 5.774 14.284 A 51 ALA B 42 ALA~? A 148 HIS B 58 HIS~? A 163 ASP B 115 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 1.33 A TRANSFORM -0.9915 -0.1225 -0.0436 -0.1258 0.8199 0.5585 -0.0327 0.5593 -0.8283 18.130 52.589 10.973 A 603 HIS A 58 HIS~? A 646 ASP A 59 ASP~? A 739 GLY B 36 GLY~? ULMNm 3 1ddj_c15 PLASMINOGEN user 3 3 RMSD = 1.33 A TRANSFORM 0.6115 -0.6386 0.4672 0.5736 -0.0490 -0.8177 0.5450 0.7680 0.3364 -38.812 47.594 38.938 D 603 HIS A 58 HIS~? D 646 ASP A 59 ASP~? D 739 GLY B 36 GLY~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 10 3 RMSD = 1.33 A TRANSFORM -0.6530 0.7005 0.2880 -0.1089 0.2894 -0.9510 -0.7495 -0.6523 -0.1127 3.151 53.304 -18.278 A 49 ASP B 93 ASP^? A 147 THR B 95 THR.? A 294 ASP A 93 ASP^? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.34 A TRANSFORM -0.4827 -0.6832 -0.5479 -0.8577 0.2424 0.4534 -0.1770 0.6888 -0.7030 -21.683 26.340 56.587 D 603 HIS A 58 HIS~? D 646 ASP A 59 ASP~? D 739 GLY A 124 GLY~? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.34 A TRANSFORM 0.0521 0.9978 0.0397 0.8415 -0.0225 -0.5397 -0.5377 0.0616 -0.8409 -7.019 -11.576 64.439 D 51 ALA A 42 ALA~? D 148 HIS A 58 HIS~? D 163 ASP A 115 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 10 3 RMSD = 1.35 A TRANSFORM 0.1860 0.2387 -0.9531 -0.9824 0.0269 -0.1850 -0.0185 0.9707 0.2395 49.281 110.123 -2.511 193 ASP A 110 ASP^? 231 ASP B 93 ASP^? 294 ASP A 115 ASP~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 RMSD = 1.35 A TRANSFORM 0.6619 -0.7495 0.0142 0.1271 0.0935 -0.9875 0.7387 0.6554 0.1572 1.155 52.736 -30.428 A 49 ASP A 93 ASP^? A 147 THR A 95 THR.? A 294 ASP B 93 ASP^? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.36 A TRANSFORM -0.0657 -0.9455 -0.3188 -0.8640 0.2138 -0.4559 0.4992 0.2455 -0.8310 -0.841 -5.338 59.818 D 51 ALA B 42 ALA~? D 148 HIS B 58 HIS~? D 163 ASP B 115 ASP~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.36 A TRANSFORM -0.9034 -0.3434 0.2568 -0.2200 0.8852 0.4098 -0.3680 0.3137 -0.8753 1.230 9.888 -4.702 F 51 ALA A 42 ALA~? F 148 HIS A 58 HIS~? F 163 ASP A 115 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.36 A TRANSFORM 0.4606 -0.2538 -0.8505 0.2054 0.9627 -0.1760 0.8635 -0.0937 0.4956 77.194 14.265 0.020 A 67 ASP A 93 ASP^? A 68 ALA A 70 ALA^? A 72 LEU A 65 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 RMSD = 1.36 A TRANSFORM -0.5127 0.5075 -0.6925 -0.1556 -0.8482 -0.5064 -0.8444 -0.1518 0.5138 79.137 20.933 7.157 A 67 ASP B 93 ASP^? A 68 ALA B 70 ALA^? A 72 LEU B 65 LEU~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 13 3 RMSD = 1.37 A TRANSFORM -0.3698 0.3879 -0.8442 -0.6415 0.5506 0.5341 0.6720 0.7391 0.0452 47.299 94.206 2.219 193 ASP B 59 ASP~? 231 ASP B 108 ASP^? 294 ASP A 115 ASP~? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM -0.9224 -0.2952 0.2492 0.1875 -0.9061 -0.3793 0.3377 -0.3031 0.8911 1.472 -10.752 -57.738 E 51 ALA A 42 ALA~? E 148 HIS A 58 HIS~? E 163 ASP A 115 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 4 3 RMSD = 1.37 A TRANSFORM 0.9887 0.1469 -0.0281 0.1494 -0.9600 0.2368 0.0078 -0.2383 -0.9712 9.169 56.382 13.026 A 603 HIS B 58 HIS~? A 646 ASP B 59 ASP~? A 739 GLY A 36 GLY~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 RMSD = 1.37 A TRANSFORM 0.3407 -0.0795 -0.9368 0.6462 -0.7039 0.2948 -0.6829 -0.7058 -0.1885 45.666 92.307 11.879 193 ASP A 59 ASP~? 231 ASP A 108 ASP^? 294 ASP B 115 ASP~? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM 0.7933 -0.0010 -0.6089 0.0334 -0.9984 0.0452 -0.6080 -0.0562 -0.7920 -24.888 -11.861 -6.219 G 51 ALA A 42 ALA~? G 148 HIS A 58 HIS~? G 163 ASP A 115 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 8 3 RMSD = 1.38 A TRANSFORM -0.9599 -0.2798 -0.0156 -0.0809 0.2237 0.9713 -0.2683 0.9336 -0.2374 55.911 21.243 26.032 199 ASP B 115 ASP~? 242 GLU B 25 GLU.? 329 ASP A 59 ASP~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 6 3 RMSD = 1.38 A TRANSFORM 0.9188 0.2296 0.3212 0.2243 -0.9730 0.0539 0.3249 0.0225 -0.9455 -7.829 13.508 -6.543 F 51 ALA B 42 ALA~? F 148 HIS B 58 HIS~? F 163 ASP B 115 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 5 3 RMSD = 1.38 A TRANSFORM -0.5988 0.4272 0.6775 -0.6013 0.3190 -0.7326 -0.5291 -0.8460 0.0658 -36.759 51.448 47.877 D 603 HIS B 58 HIS~? D 646 ASP B 59 ASP~? D 739 GLY A 36 GLY~? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.39 A TRANSFORM 0.9364 0.1876 0.2966 -0.1906 0.9815 -0.0191 -0.2947 -0.0387 0.9548 -7.477 -14.732 -56.060 E 51 ALA B 42 ALA~? E 148 HIS B 58 HIS~? E 163 ASP B 115 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 6 3 RMSD = 1.39 A TRANSFORM 0.4586 0.8372 -0.2979 0.8758 -0.3690 0.3111 0.1505 -0.4036 -0.9025 -29.682 20.904 58.277 D 603 HIS B 58 HIS~? D 646 ASP B 59 ASP~? D 739 GLY B 124 GLY~? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.40 A TRANSFORM -0.8196 0.2193 -0.5294 -0.0152 0.9152 0.4027 0.5728 0.3381 -0.7467 -18.978 -17.302 -12.034 G 51 ALA B 42 ALA~? G 148 HIS B 58 HIS~? G 163 ASP B 115 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 RMSD = 1.42 A TRANSFORM 0.0801 0.2980 0.9512 0.5750 -0.7933 0.2001 0.8142 0.5309 -0.2349 27.177 6.897 19.709 A 67 ASP A 115 ASP~? A 68 ALA A 116 ALA~? A 72 LEU A 89 LEU^? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.43 A TRANSFORM 0.4893 -0.8544 0.1748 0.4024 0.0434 -0.9144 0.7737 0.5178 0.3651 40.507 48.306 32.427 A 194 SER A 114 SER~? A 292 ASP A 131 ASP~? A 322 HIS B 41 HIS~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 RMSD = 1.44 A TRANSFORM -0.0414 -0.6030 0.7967 -0.5621 0.6733 0.4804 -0.8261 -0.4279 -0.3668 30.065 7.502 28.919 A 67 ASP B 115 ASP~? A 68 ALA B 116 ALA~? A 72 LEU B 89 LEU^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 13 3 RMSD = 1.45 A TRANSFORM -0.8914 0.4092 0.1948 0.0854 0.5739 -0.8145 -0.4451 -0.7094 -0.5465 50.851 61.921 24.346 A 229 ALA B 104 ALA.? A 257 ALA B 105 ALA.? A 328 ASP B 73 ASP^? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.45 A TRANSFORM -0.1272 0.7038 -0.6990 0.9817 -0.0116 -0.1903 -0.1420 -0.7103 -0.6894 12.349 23.366 8.259 F 51 ALA A 87 ALA^? F 148 HIS A 78 HIS^? F 163 ASP A 110 ASP^? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.47 A TRANSFORM -0.9544 0.1142 0.2759 -0.1397 0.6458 -0.7506 -0.2639 -0.7549 -0.6004 -44.706 28.545 74.717 B 51 ALA A 87 ALA^? B 148 HIS A 78 HIS^? B 163 ASP A 110 ASP^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 RMSD = 1.47 A TRANSFORM 0.4252 0.1041 -0.8991 0.6656 -0.7091 0.2327 -0.6134 -0.6973 -0.3708 54.798 24.258 8.112 A 229 ALA A 46 ALA~? A 257 ALA A 42 ALA~? A 328 ASP A 59 ASP~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.47 A TRANSFORM 0.9877 0.1452 -0.0579 0.0763 -0.1244 0.9893 0.1365 -0.9815 -0.1339 38.078 55.900 31.832 B 194 SER A 114 SER~? B 292 ASP A 131 ASP~? B 322 HIS B 41 HIS~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 11 3 RMSD = 1.47 A TRANSFORM -0.4419 0.2164 -0.8706 -0.6488 0.5932 0.4767 0.6196 0.7754 -0.1217 58.024 26.018 -1.272 A 229 ALA B 46 ALA~? A 257 ALA B 42 ALA~? A 328 ASP B 59 ASP~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 8 3 RMSD = 1.48 A TRANSFORM 0.1014 -0.4242 -0.8999 -0.9888 0.0568 -0.1381 0.1097 0.9038 -0.4137 14.468 30.982 2.872 F 51 ALA B 87 ALA^? F 148 HIS B 78 HIS^? F 163 ASP B 110 ASP^? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 RMSD = 1.48 A TRANSFORM 0.8315 0.3555 -0.4269 -0.2244 -0.4880 -0.8435 -0.5081 0.7972 -0.3260 87.542 116.180 121.846 A 451 GLU B 103 GLU.? A 504 TYR B 96 TYR.? A 540 GLU B 102 GLU.? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 RMSD = 1.48 A TRANSFORM 0.8943 -0.0093 -0.4475 0.4084 0.4262 0.8072 0.1832 -0.9046 0.3849 53.247 63.557 41.879 229 ASP A 115 ASP~? 264 GLU B 51 GLU.? 328 ASP A 110 ASP^? ULMNm 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 RMSD = 1.48 A TRANSFORM -0.2124 -0.7203 -0.6604 0.9553 -0.2954 0.0150 -0.2059 -0.6277 0.7508 41.878 122.688 -23.811 A 461 GLU B 103 GLU.? A 503 TYR B 96 TYR.? A 537 GLU B 102 GLU.? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 9 3 RMSD = 1.50 A TRANSFORM 0.9656 -0.1829 0.1848 0.1112 -0.3519 -0.9294 0.2350 0.9180 -0.3195 -51.498 30.226 68.195 B 51 ALA B 87 ALA^? B 148 HIS B 78 HIS^? B 163 ASP B 110 ASP^?