*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 5 3 RMSD = 0.64 A TRANSFORM 0.3338 0.3250 -0.8848 -0.4581 -0.7644 -0.4536 0.8238 -0.5568 0.1063 9.163 15.827 -71.366 B 250 ALA A 165 ALA~? B 251 GLY A 162 GLY~? B 252 ASP A 163 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 5 3 RMSD = 0.67 A TRANSFORM 0.2177 0.9567 0.1931 -0.2642 -0.1327 0.9553 -0.9396 0.2590 -0.2239 -2.383 -16.405 30.831 A 250 ALA A 165 ALA~? A 251 GLY A 162 GLY~? A 252 ASP A 163 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 5 3 RMSD = 0.69 A TRANSFORM -0.8291 0.4641 0.3119 -0.4733 -0.8794 0.0504 -0.2976 0.1058 -0.9488 163.561 52.537 18.345 A 316 ALA A 165 ALA~? A 317 GLY A 162 GLY~? A 318 ASP A 163 ASP~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.73 A TRANSFORM -0.1920 -0.2473 0.9497 0.8760 0.3930 0.2795 0.4424 -0.8856 -0.1412 -30.216 -35.055 -21.948 H 51 ALA A 60 ALA^? H 148 HIS A 88 HIS^? H 163 ASP A 99 ASP^? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.74 A TRANSFORM -0.2018 -0.2137 0.9558 -0.8339 -0.4744 -0.2821 -0.5138 0.8540 0.0825 -30.673 34.734 -35.951 G 51 ALA A 60 ALA^? G 148 HIS A 88 HIS^? G 163 ASP A 99 ASP^? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.75 A TRANSFORM -0.8773 -0.3448 -0.3338 -0.2134 -0.3426 0.9149 0.4298 -0.8739 -0.2270 16.745 -10.493 47.530 C 51 ALA A 60 ALA^? C 148 HIS A 88 HIS^? C 163 ASP A 99 ASP^? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.77 A TRANSFORM 0.8833 0.3679 0.2905 -0.1845 -0.2968 0.9370 -0.4309 0.8812 0.1943 -49.881 -13.484 29.224 D 51 ALA A 60 ALA^? D 148 HIS A 88 HIS^? D 163 ASP A 99 ASP^? ULMNm 3 1lio_c01 ADENOSINE KINASE user 5 3 RMSD = 0.78 A TRANSFORM 0.1707 -0.8948 -0.4126 0.5473 -0.2621 0.7948 0.8193 0.3615 -0.4450 43.099 -3.735 8.799 A 316 ALA A 165 ALA~? A 317 GLY A 162 GLY~? A 318 ASP A 163 ASP~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.79 A TRANSFORM -0.8993 -0.4207 0.1192 -0.3008 0.3974 -0.8670 -0.3174 0.8155 0.4839 7.367 22.966 23.767 B 51 ALA A 60 ALA^? B 148 HIS A 88 HIS^? B 163 ASP A 99 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 RMSD = 0.79 A TRANSFORM -0.9054 0.3721 -0.2042 -0.0175 -0.5134 -0.8580 0.4241 0.7733 -0.4714 53.810 -70.319 -157.478 A 420 ALA A 149 ALA~? B 182 GLY A 58 GLY^? B 183 GLY A 57 GLY^? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.81 A TRANSFORM 0.8886 0.4404 -0.1280 -0.2916 0.3271 -0.8989 0.3540 -0.8361 -0.4191 -40.172 25.325 51.286 A 51 ALA A 60 ALA^? A 148 HIS A 88 HIS^? A 163 ASP A 99 ASP^? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.82 A TRANSFORM -0.2869 0.3238 -0.9016 0.9341 0.3033 -0.1884 -0.2125 0.8962 0.3895 11.546 -21.125 -49.694 F 51 ALA A 60 ALA^? F 148 HIS A 88 HIS^? F 163 ASP A 99 ASP^? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.85 A TRANSFORM -0.2667 0.3379 -0.9026 -0.9383 -0.3051 0.1631 0.2203 -0.8903 -0.3984 10.584 21.192 -12.845 E 51 ALA A 60 ALA^? E 148 HIS A 88 HIS^? E 163 ASP A 99 ASP^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 1 3 RMSD = 0.99 A TRANSFORM 0.5598 0.8215 -0.1080 0.8072 -0.5113 0.2949 -0.1870 0.2523 0.9494 -51.577 -2.363 -19.866 14 ASP A 73 ASP.? 16 HIS A 74 HIS.? 67 GLY A 66 GLY.? ULMNm 3 1sca_c00 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 RMSD = 1.00 A TRANSFORM 0.6240 -0.6422 -0.4453 0.7331 0.2839 0.6180 0.2704 0.7121 -0.6480 87.369 28.745 33.167 32 ASP A 99 ASP^? 64 HIS A 88 HIS^? 221 SER A 34 SER~? ULMNm 3 1rtf_c03 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 RMSD = 1.00 A TRANSFORM 0.9589 -0.0767 -0.2731 0.2813 0.1311 0.9506 0.0371 0.9884 -0.1472 -28.730 4.739 6.259 B 57 HIS A 88 HIS^? B 102 ASP A 99 ASP^? B 195 SER A 34 SER~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.01 A TRANSFORM 0.6007 0.7168 -0.3542 0.3721 -0.6427 -0.6696 0.7076 -0.2705 0.6528 -43.336 35.907 -17.011 141 ASP A 138 ASP.? 166 GLY A 57 GLY^? 169 GLU A 146 GLU~? ULMNm 3 1a0j_c03 TRYPSIN user 1 3 RMSD = 1.01 A TRANSFORM 0.6702 0.2255 0.7071 0.4785 -0.8596 -0.1794 -0.5673 -0.4586 0.6840 -27.808 33.921 123.839 D 57 HIS A 88 HIS^? D 102 ASP A 99 ASP^? D 195 SER A 34 SER~? ULMNm 3 1a0j_c02 TRYPSIN user 1 3 RMSD = 1.01 A TRANSFORM 0.5067 -0.0761 -0.8588 -0.3398 -0.9331 -0.1178 0.7924 -0.3515 0.4986 29.728 87.633 56.911 C 57 HIS A 88 HIS^? C 102 ASP A 99 ASP^? C 195 SER A 34 SER~? ULMNm 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.01 A TRANSFORM -0.3816 0.8046 -0.4550 0.9107 0.4114 -0.0362 -0.1581 0.4282 0.8898 -9.040 -11.749 51.976 C 107 ASP A 99 ASP^? C 246 ASP A 73 ASP.? C 275 HIS A 88 HIS^? ULMNm 3 1a0j_c00 TRYPSIN user 1 3 RMSD = 1.02 A TRANSFORM -0.5989 0.7140 -0.3627 0.4377 0.6710 0.5985 -0.6707 -0.1997 0.7144 21.072 -3.120 83.048 A 57 HIS A 88 HIS^? A 102 ASP A 99 ASP^? A 195 SER A 34 SER~? ULMNm 3 1a0j_c01 TRYPSIN user 1 3 RMSD = 1.03 A TRANSFORM -0.3026 -0.7716 0.5596 0.2939 -0.6340 -0.7153 -0.9067 0.0520 -0.4186 76.782 66.936 83.058 B 57 HIS A 88 HIS^? B 102 ASP A 99 ASP^? B 195 SER A 34 SER~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.05 A TRANSFORM 0.7242 0.5631 -0.3981 -0.6838 0.6612 -0.3086 -0.0895 -0.4957 -0.8639 13.831 -3.957 45.138 A 67 ASP A 73 ASP.? A 68 ALA A 72 ALA.? A 72 LEU A 70 LEU^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.08 A TRANSFORM 0.1131 0.8341 0.5399 -0.5962 -0.3777 0.7084 -0.7948 0.4021 -0.4546 -46.477 31.757 9.577 141 ASP A 132 ASP.? 166 GLY A 82 GLY.? 169 GLU A 85 GLU.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 2 3 RMSD = 1.09 A TRANSFORM 0.4108 0.9007 0.1414 0.7435 -0.4207 0.5199 -0.5277 0.1084 0.8424 -53.829 -6.281 -7.598 14 ASP A 73 ASP.? 16 HIS A 74 HIS.? 67 GLY A 134 GLY.? ULMNm 3 1qj4_c00 HYDROXYNITRILE LYASE user 1 3 RMSD = 1.10 A TRANSFORM 0.2726 0.5462 0.7921 -0.3397 0.8249 -0.4519 0.9002 0.1459 -0.4104 -16.716 36.160 -12.048 A 80 SER A 34 SER~? A 207 ASP A 99 ASP^? A 235 HIS A 88 HIS^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.11 A TRANSFORM 0.9763 0.1718 0.1313 0.0772 0.2901 -0.9539 0.2020 -0.9415 -0.2699 -43.088 17.516 34.546 141 ASP A 94 ASP.? 166 GLY A 57 GLY^? 169 GLU A 146 GLU~? ULMNm 3 1vom_c00 MYOSIN user 1 3 RMSD = 1.12 A TRANSFORM 0.1489 -0.7335 -0.6632 -0.9886 -0.1242 -0.0846 0.0203 -0.6682 0.7437 77.054 86.671 -9.284 233 ASN A 20 ASN~? 457 GLY A 199 GLY.? 459 GLU A 200 GLU.? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.13 A TRANSFORM 0.2801 -0.7648 -0.5802 -0.4833 -0.6346 0.6031 0.8295 -0.1115 0.5473 -10.261 76.837 35.896 B 34 SER A 21 SER~? B 37 ASN A 20 ASN~? B 45 THR A 10 THR~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.18 A TRANSFORM 0.5887 0.7161 -0.3749 -0.0698 -0.4170 -0.9062 0.8053 -0.5597 0.1955 -42.880 42.617 0.848 141 ASP A 138 ASP.? 166 GLY A 58 GLY^? 169 GLU A 146 GLU~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.20 A TRANSFORM 0.8893 -0.3841 0.2481 0.0440 -0.4682 -0.8825 -0.4551 -0.7958 0.3995 26.545 -72.987 -94.447 A 420 ALA A 60 ALA^? B 182 GLY A 57 GLY^? B 183 GLY A 58 GLY^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 1.24 A TRANSFORM 0.0086 -0.9114 -0.4114 0.9986 -0.0133 0.0503 0.0513 0.4113 -0.9100 73.901 -122.129 -134.869 A 420 ALA A 147 ALA~? B 182 GLY A 84 GLY.? B 183 GLY A 82 GLY.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.26 A TRANSFORM -0.7443 -0.2664 -0.6124 0.6590 -0.1444 -0.7382 -0.1082 0.9530 -0.2830 59.152 21.946 8.500 A 316 ALA A 72 ALA.? A 317 GLY A 82 GLY.? A 318 ASP A 73 ASP.? ULMNm 3 3o4g_o02 ACYLAMINO-ACID-RELEASING ENZYME user 1 3 RMSD = 1.26 A TRANSFORM 0.0416 -0.7025 0.7105 0.9557 0.2354 0.1767 0.2913 -0.6717 -0.6811 -22.404 -37.948 75.803 C 445 SER A 34 SER~? C 524 ASP A 99 ASP^? C 556 HIS A 88 HIS^? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.27 A TRANSFORM 0.9538 -0.2823 -0.1024 -0.2751 -0.6846 -0.6750 -0.1205 -0.6720 0.7306 -53.555 72.784 91.510 B 34 SER A 21 SER~? B 37 ASN A 20 ASN~? B 45 THR A 39 THR~? ULMNm 3 3o4g_o00 ACYLAMINO-ACID-RELEASING ENZYME user 1 3 RMSD = 1.27 A TRANSFORM -0.3938 -0.7528 -0.5274 -0.7604 0.5892 -0.2732 -0.5164 -0.2934 0.8045 53.268 18.662 10.529 A 445 SER A 34 SER~? A 524 ASP A 99 ASP^? A 556 HIS A 88 HIS^? ULMNm 3 3o4g_o00 ACYLAMINO-ACID-RELEASING ENZYME user 1 3 RMSD = 1.27 A TRANSFORM -0.3938 -0.7528 -0.5274 -0.7604 0.5892 -0.2732 -0.5164 -0.2934 0.8045 53.268 18.662 10.529 A 445 SER A 34 SER~? A 524 ASP A 99 ASP^? A 556 HIS A 88 HIS^? ULMNm 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 RMSD = 1.28 A TRANSFORM 0.4377 0.1242 0.8905 0.4811 -0.8691 -0.1152 -0.7596 -0.4789 0.4401 6.862 38.554 121.406 D 107 ASP A 99 ASP^? D 246 ASP A 29 ASP~? D 275 HIS A 88 HIS^? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.28 A TRANSFORM -0.7199 -0.6782 0.1477 0.4640 -0.6285 -0.6243 -0.5162 0.3809 -0.7671 102.183 4.479 20.098 C 49 ASP A 99 ASP^? C 86 HIS A 88 HIS^? C 250 ALA A 60 ALA^? ULMNm 3 1azw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.29 A TRANSFORM -0.7147 0.6129 -0.3370 0.6319 0.7724 0.0645 -0.2999 0.1669 0.9393 38.900 -18.527 73.135 A 110 SER A 34 SER~? A 266 ASP A 99 ASP^? A 294 HIS A 88 HIS^? ULMNm 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.29 A TRANSFORM 0.6942 -0.7177 0.0546 -0.1846 -0.2508 -0.9503 -0.6957 -0.6496 0.3066 -80.074 35.772 81.690 F 49 ASP A 99 ASP^? F 86 HIS A 88 HIS^? F 250 ALA A 33 ALA~? ULMNm 3 1a8q_c00 BROMOPEROXIDASE A1 user 1 3 RMSD = 1.29 A TRANSFORM 0.0549 -0.0669 0.9963 -0.9748 0.2126 0.0680 0.2163 0.9749 0.0535 31.678 23.462 -34.071 94 SER A 34 SER~? 223 ASP A 99 ASP^? 252 HIS A 88 HIS^? ULMNm 3 1dwo_c00 HYDROXYNITRILE LYASE user 1 3 RMSD = 1.30 A TRANSFORM 0.1029 0.9945 0.0207 0.4647 -0.0297 -0.8850 0.8795 -0.1006 0.4652 15.401 37.761 96.298 A 80 SER A 34 SER~? A 208 ASP A 99 ASP^? A 236 HIS A 88 HIS^? ULMNm 3 1qfm_c00 PROLYL OLIGOPEPTIDASE user 1 3 RMSD = 1.30 A TRANSFORM 0.2934 0.7492 -0.5938 0.1877 0.5639 0.8042 -0.9374 0.3474 -0.0249 8.077 9.277 98.066 A 554 SER A 34 SER~? A 641 ASP A 99 ASP^? A 680 HIS A 88 HIS^? ULMNm 3 1a7u_c03 CHLOROPEROXIDASE T user 1 3 RMSD = 1.30 A TRANSFORM -0.6984 0.6580 0.2816 -0.3138 -0.6351 0.7058 -0.6433 -0.4046 -0.6500 27.406 93.585 42.611 B 98 SER A 34 SER~? B 228 ASP A 99 ASP^? B 257 HIS A 88 HIS^? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 RMSD = 1.31 A TRANSFORM 0.2546 -0.9668 -0.0202 0.8663 0.2187 0.4491 0.4298 0.1318 -0.8933 91.680 -43.158 -1.702 A 261 GLY A 4 GLY.? B 17 GLN A 120 GLN^? B 140 GLU A 3 GLU.? ULMNm 3 1de6_c01 L-RHAMNOSE ISOMERASE user 1 3 RMSD = 1.31 A TRANSFORM -0.0512 -0.9975 0.0483 -0.0291 0.0499 0.9983 0.9983 -0.0497 0.0316 52.192 16.279 10.706 B 236 LYS A 157 LYS~? B 270 HIS A 156 HIS~? B 302 ASP A 154 ASP~? ULMNm 3 1a7u_c02 CHLOROPEROXIDASE T user 1 3 RMSD = 1.31 A TRANSFORM -0.8749 -0.4500 0.1788 0.4767 -0.7356 0.4814 0.0851 -0.5064 -0.8581 48.824 44.622 55.126 A 98 SER A 34 SER~? A 228 ASP A 99 ASP^? A 257 HIS A 88 HIS^? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.31 A TRANSFORM -0.8303 -0.0850 0.5508 0.1310 0.9308 0.3411 0.5417 -0.3554 0.7617 60.831 -97.500 -24.046 D 49 ASP A 99 ASP^? D 86 HIS A 88 HIS^? D 250 ALA A 60 ALA^? ULMNm 3 1dwo_c01 HYDROXYNITRILE LYASE user 1 3 RMSD = 1.32 A TRANSFORM 0.3268 -0.1452 0.9339 -0.7983 -0.5714 0.1905 -0.5060 0.8077 0.3026 40.214 60.187 85.734 B 80 SER A 34 SER~? B 208 ASP A 99 ASP^? B 236 HIS A 88 HIS^? ULMNm 3 1lio_c01 ADENOSINE KINASE user 3 3 RMSD = 1.32 A TRANSFORM 0.7096 -0.0346 0.7037 0.6948 0.2000 -0.6908 0.1169 -0.9792 -0.1659 -15.620 5.027 76.069 A 316 ALA A 93 ALA^? A 317 GLY A 95 GLY.? A 318 ASP A 94 ASP.? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.33 A TRANSFORM -0.1706 -0.9389 -0.2991 -0.8138 -0.0369 0.5800 0.5556 -0.3423 0.7577 63.273 -3.349 8.880 A 49 ASP A 99 ASP^? A 86 HIS A 88 HIS^? A 250 ALA A 60 ALA^? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.33 A TRANSFORM -0.1706 -0.9389 -0.2991 -0.8138 -0.0369 0.5800 0.5556 -0.3423 0.7577 63.273 -3.349 8.880 A 49 ASP A 99 ASP^? A 86 HIS A 88 HIS^? A 250 ALA A 60 ALA^? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.34 A TRANSFORM -0.5163 0.6387 0.5705 -0.6957 -0.7013 0.1557 -0.4995 0.3165 -0.8064 -36.861 41.621 57.739 B 49 ASP A 99 ASP^? B 86 HIS A 88 HIS^? B 250 ALA A 60 ALA^? ULMNm 3 1de6_c03 L-RHAMNOSE ISOMERASE user 1 3 RMSD = 1.34 A TRANSFORM -0.6654 0.7433 -0.0694 -0.0376 -0.1262 -0.9913 0.7456 0.6570 -0.1119 32.695 31.190 3.527 D 236 LYS A 157 LYS~? D 270 HIS A 156 HIS~? D 302 ASP A 154 ASP~? ULMNm 3 1azw_c01 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.34 A TRANSFORM 0.0929 -0.9761 0.1963 0.9539 0.1438 0.2634 0.2853 -0.1628 -0.9445 76.537 -3.669 41.715 B 110 SER A 34 SER~? B 266 ASP A 99 ASP^? B 294 HIS A 88 HIS^? ULMNm 3 2qs9_o00 RETINOBLASTOMA-BINDING PROTEIN 9 user 1 3 RMSD = 1.34 A TRANSFORM -0.5621 0.6675 -0.4884 -0.1942 -0.6805 -0.7065 0.8039 0.3023 -0.5122 -1.527 48.403 -14.140 A 75 SER A 34 SER~? A 138 ASP A 99 ASP^? A 165 HIS A 88 HIS^? ULMNm 3 1de6_c00 L-RHAMNOSE ISOMERASE user 1 3 RMSD = 1.34 A TRANSFORM 0.3561 0.1927 0.9143 0.3804 -0.9236 0.0465 -0.8535 -0.3312 0.4023 5.222 30.376 79.039 A 236 LYS A 157 LYS~? A 270 HIS A 156 HIS~? A 302 ASP A 154 ASP~? ULMNm 3 1a8s_c00 CHLOROPEROXIDASE F user 1 3 RMSD = 1.35 A TRANSFORM -0.7153 -0.3523 -0.6036 0.3516 0.5649 -0.7465 -0.6040 0.7462 0.2802 54.839 59.157 51.927 94 SER A 34 SER~? 224 ASP A 99 ASP^? 253 HIS A 88 HIS^? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 4 3 RMSD = 1.35 A TRANSFORM -0.4678 -0.5167 0.7171 0.5822 0.4303 0.6899 0.6650 -0.7402 -0.0995 56.919 27.923 23.454 B 194 SER A 38 SER~? B 292 ASP A 138 ASP.? B 322 HIS A 156 HIS~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.36 A TRANSFORM 0.2773 0.7309 0.6236 -0.0665 -0.6329 0.7714 -0.9585 0.2554 0.1269 4.873 -85.512 -118.024 A 420 ALA A 31 ALA~? B 182 GLY A 82 GLY.? B 183 GLY A 84 GLY.? ULMNm 3 1pfq_c00 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 RMSD = 1.36 A TRANSFORM 0.8501 -0.1884 -0.4917 0.1225 -0.8374 0.5326 0.5121 0.5130 0.6889 -23.118 24.134 -32.243 A 630 SER A 34 SER~? A 708 ASP A 99 ASP^? A 740 HIS A 88 HIS^? ULMNm 3 1zoi_c01 ESTERASE user 1 3 RMSD = 1.36 A TRANSFORM 0.2104 0.9713 0.1110 -0.2569 -0.0547 0.9649 -0.9433 0.2315 -0.2380 27.209 -1.313 54.440 B 97 SER A 34 SER~? B 227 ASP A 99 ASP^? B 256 HIS A 88 HIS^? ULMNm 3 1de6_c02 L-RHAMNOSE ISOMERASE user 1 3 RMSD = 1.36 A TRANSFORM 0.3529 0.0697 -0.9331 -0.2910 0.9559 -0.0387 -0.8893 -0.2852 -0.3576 18.073 9.532 83.234 C 236 LYS A 157 LYS~? C 270 HIS A 156 HIS~? C 302 ASP A 154 ASP~? ULMNm 3 1c4x_c00 2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIEuser 1 3 RMSD = 1.36 A TRANSFORM 0.3673 0.1311 -0.9208 -0.2882 0.9573 0.0213 -0.8843 -0.2576 -0.3894 23.833 35.765 56.088 A 110 SER A 34 SER~? A 235 ASP A 99 ASP^? A 263 HIS A 88 HIS^? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 RMSD = 1.36 A TRANSFORM 0.4283 -0.8302 -0.3569 -0.0560 -0.4186 0.9064 0.9019 0.3682 0.2258 -15.188 51.937 20.550 B 34 SER A 21 SER~? B 37 ASN A 20 ASN~? B 45 THR A 203 THR.? ULMNm 3 1zoi_c00 ESTERASE user 1 3 RMSD = 1.36 A TRANSFORM 0.2174 0.9646 0.1490 0.9430 -0.1682 -0.2872 0.2520 -0.2030 0.9462 26.981 3.450 48.764 A 97 SER A 34 SER~? A 227 ASP A 99 ASP^? A 256 HIS A 88 HIS^? ULMNm 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 RMSD = 1.36 A TRANSFORM -0.6803 -0.6159 0.3973 -0.5316 0.7878 0.3110 0.5045 -0.0003 0.8634 77.729 40.632 53.807 B 107 ASP A 99 ASP^? B 246 ASP A 29 ASP~? B 275 HIS A 88 HIS^? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.37 A TRANSFORM 0.8264 0.2885 -0.4835 -0.1632 0.9446 0.2847 -0.5388 0.1563 -0.8278 -11.012 -12.882 0.453 B 60 HIS A 88 HIS^? B 84 ASP A 99 ASP^? B 140 GLY A 82 GLY.? ULMNm 3 2qs9_o01 RETINOBLASTOMA-BINDING PROTEIN 9 user 1 3 RMSD = 1.37 A TRANSFORM 0.9826 0.1734 0.0662 -0.1794 0.7959 0.5783 -0.0476 0.5801 -0.8131 -29.799 23.892 -5.033 B 75 SER A 34 SER~? B 138 ASP A 99 ASP^? B 165 HIS A 88 HIS^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.38 A TRANSFORM 0.4169 0.8686 -0.2677 0.1760 -0.3661 -0.9138 0.8917 -0.3338 0.3055 -45.966 35.912 -10.685 141 ASP A 132 ASP.? 166 GLY A 58 GLY^? 169 GLU A 146 GLU~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.38 A TRANSFORM -0.3354 0.7044 0.6255 -0.7295 0.2259 -0.6456 0.5961 0.6729 -0.4381 -58.188 49.966 -23.242 E 49 ASP A 99 ASP^? E 86 HIS A 88 HIS^? E 250 ALA A 33 ALA~? ULMNm 3 1zoi_c02 ESTERASE user 1 3 RMSD = 1.38 A TRANSFORM 0.2510 0.9640 0.0877 -0.7242 0.2471 -0.6438 0.6423 -0.0981 -0.7601 27.440 7.294 57.968 C 97 SER A 34 SER~? C 227 ASP A 99 ASP^? C 256 HIS A 88 HIS^? ULMNm 3 1pfq_c01 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 RMSD = 1.39 A TRANSFORM -0.7335 0.6650 0.1409 -0.4457 -0.6271 0.6388 -0.5132 -0.4057 -0.7563 5.536 40.225 73.425 B 630 SER A 34 SER~? B 708 ASP A 99 ASP^? B 740 HIS A 88 HIS^? ULMNm 3 1b01_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.39 A TRANSFORM -0.6725 -0.5468 0.4988 0.5663 0.0537 0.8224 0.4765 -0.8355 -0.2735 86.227 -24.940 104.220 B 4 ARG A 14 ARG~? B 6 THR A 10 THR~? B 8 THR A 203 THR.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.39 A TRANSFORM 0.9102 -0.1424 -0.3888 -0.3524 -0.7594 -0.5469 0.2174 -0.6348 0.7415 27.816 -57.881 -121.851 A 420 ALA A 72 ALA.? B 182 GLY A 57 GLY^? B 183 GLY A 58 GLY^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.40 A TRANSFORM 0.3708 -0.3801 0.8474 -0.4227 -0.8815 -0.2104 -0.8269 0.2802 0.4875 143.834 64.063 -2.208 A 316 ALA A 72 ALA.? A 317 GLY A 82 GLY.? A 318 ASP A 73 ASP.? ULMNm 3 2lip_c00 LIPASE user 1 3 RMSD = 1.40 A TRANSFORM -0.8047 -0.5817 0.1189 -0.0619 -0.1170 -0.9912 -0.5905 0.8050 -0.0582 52.454 40.974 12.979 87 SER A 34 SER~? 264 ASP A 99 ASP^? 286 HIS A 88 HIS^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.40 A TRANSFORM 0.6291 -0.6735 0.3880 -0.2250 0.3200 0.9203 0.7440 0.6663 -0.0498 41.129 -121.834 -169.655 A 420 ALA A 147 ALA~? B 182 GLY A 57 GLY^? B 183 GLY A 58 GLY^? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 2 3 RMSD = 1.42 A TRANSFORM 0.0774 -0.5965 0.7989 0.9106 -0.2840 -0.3002 -0.4060 -0.7507 -0.5212 33.175 2.812 26.495 B 60 HIS A 88 HIS^? B 84 ASP A 99 ASP^? B 140 GLY A 108 GLY.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.42 A TRANSFORM 0.6351 0.6645 0.3938 0.7470 -0.6582 -0.0940 -0.1968 -0.3538 0.9144 -16.633 -5.007 6.016 A 250 ALA A 72 ALA.? A 251 GLY A 82 GLY.? A 252 ASP A 73 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.42 A TRANSFORM -0.5865 0.7971 0.1437 -0.8082 -0.5876 -0.0392 -0.0532 0.1391 -0.9889 -4.297 18.193 -43.780 B 250 ALA A 72 ALA.? B 251 GLY A 82 GLY.? B 252 ASP A 73 ASP.? ULMNm 3 1uk7_c00 3.07.01.0009 user 1 3 RMSD = 1.42 A TRANSFORM -0.2833 0.4997 -0.8186 0.9478 0.2761 -0.1595 -0.1463 0.8210 0.5518 8.272 6.235 -40.023 A 103 ALA A 60 ALA^? A 224 ASP A 99 ASP^? A 252 HIS A 88 HIS^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.45 A TRANSFORM -0.7775 -0.6177 -0.1180 0.6288 -0.7658 -0.1349 0.0070 0.1791 -0.9838 90.251 41.690 10.718 A 229 ALA A 61 ALA^? A 257 ALA A 60 ALA^? A 328 ASP A 99 ASP^? ULMNm 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.45 A TRANSFORM 0.2724 -0.9612 0.0436 -0.4653 -0.1713 -0.8685 -0.8422 -0.2163 0.4938 -56.681 41.140 68.200 F 49 ASP A 99 ASP^? F 86 HIS A 88 HIS^? F 250 ALA A 31 ALA~? ULMNm 3 1e2t_c05 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.46 A TRANSFORM 0.7398 0.6625 -0.1173 0.4566 -0.3664 0.8107 -0.4941 0.6533 0.5736 19.340 77.065 1.952 F 69 CYH A 89 CYH^? F 107 HIS A 88 HIS^? F 122 ASP A 99 ASP^? ULMNm 3 1e2t_c01 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.46 A TRANSFORM -0.7018 -0.6858 0.1929 0.5050 -0.2879 0.8137 0.5025 -0.6685 -0.5483 112.328 72.589 82.991 B 69 CYH A 89 CYH^? B 107 HIS A 88 HIS^? B 122 ASP A 99 ASP^? ULMNm 3 1ukf_o00 AVIRULENCE PROTEIN AVRPPH3 user 1 3 RMSD = 1.46 A TRANSFORM -0.5642 -0.2481 -0.7874 0.3700 -0.9286 0.0275 0.7381 0.2758 -0.6158 68.868 59.114 19.736 A 98 CYH A 89 CYH^? A 212 HIS A 88 HIS^? A 227 ASP A 99 ASP^? ULMNm 3 1e2t_c04 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.47 A TRANSFORM -0.1627 -0.8008 0.5764 0.9600 0.0063 0.2798 0.2277 -0.5989 -0.7677 49.784 71.108 38.105 E 69 CYH A 89 CYH^? E 107 HIS A 88 HIS^? E 122 ASP A 99 ASP^? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.47 A TRANSFORM -0.2341 -0.2627 -0.9360 0.7444 -0.6677 0.0013 0.6253 0.6965 -0.3519 62.628 -55.660 -53.527 D 49 ASP A 99 ASP^? D 86 HIS A 88 HIS^? D 250 ALA A 33 ALA~? ULMNm 3 1e2t_c06 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.47 A TRANSFORM -0.7990 0.3133 0.5132 -0.4390 0.2793 -0.8540 0.4109 0.9076 0.0856 37.030 101.502 -7.535 G 69 CYH A 89 CYH^? G 107 HIS A 88 HIS^? G 122 ASP A 99 ASP^? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.47 A TRANSFORM -0.4222 0.2378 0.8748 0.1268 -0.9400 0.3167 -0.8976 -0.2446 -0.3668 6.679 34.669 46.663 A 105 ALA A 60 ALA^? A 244 ASP A 99 ASP^? A 271 HIS A 88 HIS^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 1.48 A TRANSFORM 0.3176 0.7300 0.6052 -0.4861 -0.4227 0.7649 -0.8141 0.5371 -0.2206 -19.329 83.525 57.355 179 ASP A 189 ASP.? 214 ASP A 99 ASP^? 289 ASP A 163 ASP~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.48 A TRANSFORM -0.7497 0.6592 -0.0582 -0.1828 -0.2907 -0.9392 0.6360 0.6935 -0.3384 21.319 0.427 -20.080 A 49 ASP A 99 ASP^? A 86 HIS A 88 HIS^? A 250 ALA A 33 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 RMSD = 1.48 A TRANSFORM -0.7497 0.6592 -0.0582 -0.1828 -0.2907 -0.9392 0.6360 0.6935 -0.3384 21.319 0.427 -20.080 A 49 ASP A 99 ASP^? A 86 HIS A 88 HIS^? A 250 ALA A 33 ALA~? ULMNm 3 1e2t_c00 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.48 A TRANSFORM 0.2306 0.8026 -0.5501 0.9450 -0.0500 0.3232 -0.2320 0.5944 0.7700 81.693 69.746 47.741 A 69 CYH A 89 CYH^? A 107 HIS A 88 HIS^? A 122 ASP A 99 ASP^? ULMNm 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 2 3 RMSD = 1.49 A TRANSFORM 0.8233 0.0458 -0.5658 -0.0327 -0.9912 -0.1279 0.5667 -0.1238 0.8146 31.320 50.634 67.380 B 237 HIS A 88 HIS^? B 238 GLY A 58 GLY^? B 287 CYH A 89 CYH^? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.50 A TRANSFORM -0.7054 0.2279 -0.6712 -0.3908 0.6650 0.6365 -0.5914 -0.7113 0.3800 76.657 -27.461 50.436 C 49 ASP A 99 ASP^? C 86 HIS A 88 HIS^? C 250 ALA A 33 ALA~? ULMNm 3 1e2t_c03 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 1.50 A TRANSFORM 0.7718 -0.2508 -0.5843 -0.5114 0.3012 -0.8048 -0.3778 -0.9200 -0.1042 95.933 99.192 92.913 D 69 CYH A 89 CYH^? D 107 HIS A 88 HIS^? D 122 ASP A 99 ASP^? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.50 A TRANSFORM 0.4219 0.8085 -0.4103 -0.8723 0.2386 -0.4268 0.2472 -0.5379 -0.8059 -31.270 57.593 40.562 A 317 GLU A 3 GLU.? A 319 ASP A 11 ASP~? A 359 ARG A 14 ARG~?