*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.60 A TRANSFORM 0.8274 -0.4848 -0.2834 0.5471 0.8098 0.2121 0.1267 -0.3305 0.9353 10.258 -53.842 -13.428 B 99 ARG A 108 ARG~? B 101 ASP A 228 ASP.? B 132 ASP A 104 ASP.? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.61 A TRANSFORM -0.8284 0.4670 0.3094 -0.5149 -0.8522 -0.0922 0.2206 -0.2357 0.9465 12.565 75.442 -21.796 A 99 ARG A 108 ARG~? A 101 ASP A 228 ASP.? A 132 ASP A 104 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.66 A TRANSFORM -0.8240 0.4708 0.3153 -0.5248 -0.8439 -0.1115 0.2136 -0.2574 0.9424 11.903 76.186 -20.451 A 99 ARG A 108 ARG~? A 101 ASP A 228 ASP.? A 132 ASP A 104 ASP.? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 0.67 A TRANSFORM 0.8182 -0.4829 -0.3120 0.5529 0.8097 0.1966 0.1577 -0.3334 0.9295 11.609 -53.669 -14.185 B 99 ARG A 108 ARG~? B 101 ASP A 228 ASP.? B 132 ASP A 104 ASP.? ULMNm 3 1t7d_c01 SIGNAL PEPTIDASE I user 2 3 RMSD = 0.97 A TRANSFORM -0.6284 0.7621 0.1559 0.6589 0.6280 -0.4140 -0.4134 -0.1575 -0.8968 46.732 -12.067 39.731 B 88 SER A 195 SER^? B 90 SER A 141 SER^? B 145 LYS A 6 LYS~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 1.00 A TRANSFORM 0.2216 0.7806 -0.5845 0.6340 0.3401 0.6945 0.7409 -0.5245 -0.4196 32.211 -157.881 -137.553 A 420 ALA A 116 ALA~? B 182 GLY A 122 GLY.? B 183 GLY A 121 GLY.? ULMNm 3 1t7d_c00 SIGNAL PEPTIDASE I user 2 3 RMSD = 1.00 A TRANSFORM 0.7473 -0.5699 -0.3417 -0.4852 -0.8194 0.3053 -0.4540 -0.0623 -0.8888 6.573 67.561 40.062 A 88 SER A 195 SER^? A 90 SER A 141 SER^? A 145 LYS A 6 LYS~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.00 A TRANSFORM -0.9192 -0.3937 0.0043 0.0541 -0.1372 -0.9891 0.3900 -0.9089 0.1474 85.826 -81.067 -131.787 A 420 ALA A 96 ALA^? B 182 GLY A 93 GLY.? B 183 GLY A 94 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.00 A TRANSFORM -0.7953 -0.1098 -0.5962 0.0751 0.9580 -0.2766 0.6016 -0.2648 -0.7537 92.977 -117.626 -127.338 A 420 ALA A 116 ALA~? B 182 GLY A 91 GLY^? B 183 GLY A 122 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.01 A TRANSFORM -0.2211 -0.8874 0.4045 -0.7197 -0.1315 -0.6817 0.6581 -0.4418 -0.6096 55.134 -46.987 -129.793 A 420 ALA A 116 ALA~? B 182 GLY A 121 GLY.? B 183 GLY A 122 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 9 3 RMSD = 1.04 A TRANSFORM -0.3247 0.9036 -0.2795 0.0147 0.3003 0.9537 0.9457 0.3056 -0.1108 44.711 -128.099 -170.015 A 420 ALA A 213 ALA~? B 182 GLY A 94 GLY.? B 183 GLY A 93 GLY.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 5 3 RMSD = 1.06 A TRANSFORM 0.7263 0.6863 0.0396 0.1927 -0.1480 -0.9700 -0.6598 0.7121 -0.2397 3.225 79.904 30.720 A 228 ASP A 167 ASP.? A 260 ASP A 148 ASP~? A 329 ASP A 171 ASP^? ULMNm 3 1qrz_c20 PLASMINOGEN user 4 3 RMSD = 1.09 A TRANSFORM 0.1760 0.7136 -0.6781 -0.7271 0.5586 0.3991 0.6636 0.4228 0.6172 -17.516 2.360 -26.337 A 603 HIS A 115 HIS~? A 646 ASP A 225 ASP~? A 739 GLY A 122 GLY.? ULMNm 3 1qrz_c23 PLASMINOGEN user 4 3 RMSD = 1.10 A TRANSFORM -0.5353 -0.2056 -0.8193 0.7750 -0.5054 -0.3795 -0.3360 -0.8381 0.4298 5.884 -12.206 62.585 D 603 HIS A 115 HIS~? D 646 ASP A 225 ASP~? D 739 GLY A 122 GLY.? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.12 A TRANSFORM 0.5901 -0.6718 0.4477 -0.6625 -0.0860 0.7441 -0.4613 -0.7357 -0.4959 -65.545 5.328 32.558 B 603 HIS A 12 HIS.? B 646 ASP A 221 ASP~? B 739 GLY A 93 GLY.? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.13 A TRANSFORM 0.6173 -0.6777 0.3996 -0.6529 -0.1579 0.7408 -0.4389 -0.7182 -0.5400 -37.436 6.290 70.971 A 603 HIS A 12 HIS.? A 646 ASP A 221 ASP~? A 739 GLY A 93 GLY.? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.13 A TRANSFORM 0.6027 0.4847 0.6339 0.6629 0.1381 -0.7359 -0.4442 0.8637 -0.2380 -38.478 -12.642 13.498 C 603 HIS A 12 HIS.? C 646 ASP A 221 ASP~? C 739 GLY A 93 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 8 3 RMSD = 1.14 A TRANSFORM -0.6907 0.4440 0.5708 -0.3816 -0.8943 0.2338 0.6143 -0.0564 0.7871 47.939 -74.063 -170.603 A 420 ALA A 206 ALA.? B 182 GLY A 91 GLY^? B 183 GLY A 94 GLY.? ULMNm 3 2odj_o00 PORIN D user 5 3 RMSD = 1.14 A TRANSFORM 0.1962 -0.9459 -0.2584 0.4424 0.3205 -0.8376 0.8751 0.0500 0.4814 27.464 19.699 -11.156 A 156 HIS A 12 HIS.? A 208 ASP A 207 ASP.? A 296 SER A 118 SER~? ULMNm 3 1qrz_c22 PLASMINOGEN user 4 3 RMSD = 1.17 A TRANSFORM -0.5796 -0.1908 -0.7923 0.7362 -0.5394 -0.4087 -0.3494 -0.8201 0.4531 60.319 -9.044 23.575 C 603 HIS A 115 HIS~? C 646 ASP A 225 ASP~? C 739 GLY A 122 GLY.? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.18 A TRANSFORM 0.6437 0.4774 0.5982 0.6427 0.0872 -0.7611 -0.4155 0.8744 -0.2507 -92.803 -10.334 50.998 D 603 HIS A 12 HIS.? D 646 ASP A 221 ASP~? D 739 GLY A 93 GLY.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 4 3 RMSD = 1.18 A TRANSFORM 0.6650 0.7152 -0.2151 -0.2048 -0.1024 -0.9734 -0.7183 0.6913 0.0784 6.991 87.669 28.930 A 228 ASP A 167 ASP.? A 260 ASP A 146 ASP~? A 329 ASP A 171 ASP^? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.18 A TRANSFORM 0.2005 -0.1184 -0.9725 -0.5575 0.8025 -0.2127 0.8056 0.5849 0.0949 20.329 22.483 -10.405 A 156 HIS A 4 HIS.? A 208 ASP A 161 ASP^? A 296 SER A 129 SER.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 RMSD = 1.19 A TRANSFORM 0.7416 0.6605 0.1168 -0.5887 0.5575 0.5854 0.3216 -0.5029 0.8023 -15.428 -106.154 -147.482 A 420 ALA A 131 ALA~? B 182 GLY A 125 GLY.? B 183 GLY A 89 GLY^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.20 A TRANSFORM -0.0128 -0.9321 -0.3619 -0.9632 -0.0857 0.2548 -0.2686 0.3519 -0.8967 63.423 78.430 -40.195 D 465 GLY A 180 GLY~? D 501 ASP A 146 ASP~? E 367 TYR A 132 TYR~? ULMNm 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.21 A TRANSFORM 0.2876 -0.0305 -0.9573 -0.9577 0.0004 -0.2877 0.0092 0.9995 -0.0291 40.323 65.757 -10.783 B 348 HIS A 115 HIS~? B 378 CYH A 120 CYH.? B 380 GLY A 122 GLY.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.22 A TRANSFORM 0.7287 -0.5002 -0.4678 0.6193 0.7729 0.1382 0.2924 -0.3904 0.8730 16.696 -18.427 -24.514 A 465 GLY A 180 GLY~? A 501 ASP A 146 ASP~? B 367 TYR A 132 TYR~? ULMNm 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.22 A TRANSFORM 0.9843 -0.0603 -0.1657 0.1668 0.0143 0.9859 -0.0570 -0.9981 0.0242 -27.040 -45.659 82.173 D 348 HIS A 115 HIS~? D 378 CYH A 120 CYH.? D 380 GLY A 122 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.23 A TRANSFORM 0.6442 0.6902 0.3296 -0.7536 0.4990 0.4279 0.1309 -0.5240 0.8416 -10.823 -91.333 -144.800 A 420 ALA A 96 ALA^? B 182 GLY A 122 GLY.? B 183 GLY A 91 GLY^? ULMNm 3 2odj_o01 PORIN D user 5 3 RMSD = 1.25 A TRANSFORM -0.8847 -0.0940 -0.4566 -0.4372 -0.1728 0.8826 -0.1619 0.9805 0.1118 33.918 -13.303 63.106 B 156 HIS A 12 HIS.? B 208 ASP A 207 ASP.? B 296 SER A 118 SER~? ULMNm 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.26 A TRANSFORM -0.2814 0.0250 0.9593 0.9595 -0.0029 0.2816 0.0098 0.9997 -0.0232 1.684 -65.642 -11.034 A 348 HIS A 115 HIS~? A 378 CYH A 120 CYH.? A 380 GLY A 122 GLY.? ULMNm 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 RMSD = 1.26 A TRANSFORM 0.9146 0.3628 -0.1788 0.1551 -0.7229 -0.6734 -0.3735 0.5881 -0.7174 -26.163 60.300 91.094 32 ASP A 228 ASP.? 35 SER A 103 SER^? 215 ASP A 227 ASP.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 RMSD = 1.27 A TRANSFORM -0.6445 0.5917 -0.4844 0.6419 0.0745 -0.7631 -0.4154 -0.8027 -0.4278 37.974 97.518 41.380 193 ASP A 167 ASP.? 231 ASP A 221 ASP~? 294 ASP A 171 ASP^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 8 3 RMSD = 1.27 A TRANSFORM -0.1617 -0.7969 0.5820 0.9432 -0.2983 -0.1464 0.2903 0.5252 0.7999 36.295 89.655 -42.654 193 ASP A 227 ASP.? 231 ASP A 54 ASP~? 294 ASP A 225 ASP~? ULMNm 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.28 A TRANSFORM -0.2827 -0.2883 -0.9148 -0.8868 0.4422 0.1347 0.3657 0.8493 -0.3807 52.749 58.118 -34.228 L 142 LYS A 6 LYS~? L 217 SER A 141 SER^? L 241 SER A 195 SER^? ULMNm 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.28 A TRANSFORM -0.9850 -0.0229 0.1712 -0.1705 -0.0305 -0.9849 0.0278 -0.9993 0.0261 73.557 47.061 77.319 C 348 HIS A 115 HIS~? C 378 CYH A 120 CYH.? C 380 GLY A 122 GLY.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 9 3 RMSD = 1.29 A TRANSFORM -0.8274 -0.5524 -0.1014 0.3182 -0.6098 0.7258 -0.4628 0.5683 0.6804 74.970 83.928 -16.806 193 ASP A 227 ASP.? 231 ASP A 127 ASP.? 294 ASP A 225 ASP~? ULMNm 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 RMSD = 1.29 A TRANSFORM -0.7114 -0.6340 -0.3032 -0.5305 0.7675 -0.3600 0.4609 -0.0953 -0.8823 57.084 9.663 41.455 A 85 HIS A 4 HIS.? A 171 ARG A 13 ARG.? A 190 LYS A 6 LYS~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.29 A TRANSFORM -0.9658 -0.2592 0.0001 0.2383 -0.8877 0.3940 -0.1020 0.3806 0.9191 57.498 83.144 8.996 A 228 ASP A 171 ASP^? A 261 ASP A 18 ASP.? A 329 ASP A 194 ASP.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.29 A TRANSFORM 0.6293 0.5194 -0.5781 -0.6783 0.7302 -0.0823 0.3794 0.4439 0.8118 11.537 -90.173 -177.681 A 420 ALA A 96 ALA^? B 182 GLY A 125 GLY.? B 183 GLY A 89 GLY^? ULMNm 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 RMSD = 1.30 A TRANSFORM 0.7296 0.5865 0.3518 -0.4063 0.7855 -0.4669 -0.5502 0.1977 0.8113 -41.251 9.566 0.119 B 85 HIS A 4 HIS.? B 171 ARG A 13 ARG.? B 190 LYS A 6 LYS~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.31 A TRANSFORM -0.4078 0.9089 0.0868 -0.7240 -0.3798 0.5758 0.5563 0.1720 0.8130 -37.094 26.116 -55.092 B 114 HIS A 4 HIS.? B 197 ASP A 240 ASP~? B 223 ALA A 213 ALA~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 1 3 RMSD = 1.31 A TRANSFORM -0.4529 -0.8153 -0.3608 -0.1403 0.4648 -0.8742 0.8805 -0.3453 -0.3249 93.825 90.283 24.041 A 228 ASP A 104 ASP.? A 261 ASP A 127 ASP.? A 329 ASP A 228 ASP.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.31 A TRANSFORM 0.4153 -0.9066 -0.0743 0.6277 0.3447 -0.6980 0.6585 0.2433 0.7122 -57.213 -23.603 -58.975 A 114 HIS A 4 HIS.? A 197 ASP A 240 ASP~? A 223 ALA A 213 ALA~? ULMNm 3 1naa_c02 CELLOBIOSE DEHYDROGENASE user 1 3 RMSD = 1.32 A TRANSFORM 0.6061 0.7197 0.3385 -0.7071 0.6825 -0.1848 -0.3640 -0.1274 0.9226 -8.196 35.042 19.626 A 609 TYR A 165 TYR.? A 689 HIS A 4 HIS.? A 732 ASN A 9 ASN~? ULMNm 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 1 3 RMSD = 1.32 A TRANSFORM 0.2898 0.9437 -0.1594 0.4730 -0.2860 -0.8333 -0.8320 0.1661 -0.5293 7.470 2.227 31.893 B 46 HIS A 4 HIS.? B 163 ALA A 8 ALA~? B 182 SER A 239 SER~? ULMNm 3 2odj_o01 PORIN D user 2 3 RMSD = 1.32 A TRANSFORM -0.7773 -0.6180 -0.1175 0.5458 -0.7555 0.3624 -0.3127 0.2176 0.9246 32.814 -14.918 70.465 B 156 HIS A 4 HIS.? B 208 ASP A 161 ASP^? B 296 SER A 129 SER.? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 1 3 RMSD = 1.33 A TRANSFORM -0.7024 0.5912 0.3963 -0.5426 -0.0844 -0.8358 -0.4607 -0.8021 0.3800 -43.526 89.068 51.821 A1132 ASP A 104 ASP.? A1134 ALA A 80 ALA.? A1137 ASN A 81 ASN.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 11 3 RMSD = 1.33 A TRANSFORM 0.1708 0.0808 0.9820 -0.6828 -0.7088 0.1771 0.7103 -0.7008 -0.0658 11.845 106.430 45.985 A 228 ASP A 184 ASP~? A 260 ASP A 194 ASP.? A 329 ASP A 54 ASP~? ULMNm 3 1naa_c03 CELLOBIOSE DEHYDROGENASE user 1 3 RMSD = 1.33 A TRANSFORM 0.6895 -0.3219 0.6488 -0.0465 -0.9136 -0.4039 0.7228 0.2484 -0.6449 9.680 38.407 -38.748 B 609 TYR A 165 TYR.? B 689 HIS A 4 HIS.? B 732 ASN A 9 ASN~? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.34 A TRANSFORM -0.7177 0.0014 -0.6964 0.6782 -0.2253 -0.6994 -0.1579 -0.9743 0.1607 56.498 -3.933 31.920 C 603 HIS A 115 HIS~? C 646 ASP A 225 ASP~? C 739 GLY A 89 GLY^? ULMNm 3 1mt5_c07 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.34 A TRANSFORM 0.2220 0.3169 0.9221 0.9537 -0.2674 -0.1377 0.2029 0.9100 -0.3616 18.546 -2.462 -29.855 H 142 LYS A 6 LYS~? H 217 SER A 141 SER^? H 241 SER A 195 SER^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 14 3 RMSD = 1.34 A TRANSFORM -0.0707 -0.6849 -0.7252 -0.3606 0.6954 -0.6216 0.9300 0.2176 -0.2961 74.060 17.891 -10.800 A 229 ALA A 196 ALA^? A 257 ALA A 193 ALA.? A 328 ASP A 184 ASP~? ULMNm 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 RMSD = 1.35 A TRANSFORM 0.1269 -0.4961 -0.8589 0.9876 -0.0172 0.1559 -0.0921 -0.8681 0.4878 90.066 -17.142 24.373 A 32 ASP A 228 ASP.? A 35 SER A 103 SER^? A 218 ASP A 227 ASP.? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 1.35 A TRANSFORM -0.3745 -0.8509 -0.3684 0.9181 -0.2846 -0.2759 0.1299 -0.4416 0.8878 57.380 76.194 94.860 B 137 ARG A 63 ARG~? B 141 THR A 65 THR~? B 235 ASP A 184 ASP~? ULMNm 3 1qrz_c21 PLASMINOGEN user 2 3 RMSD = 1.36 A TRANSFORM -0.0965 0.9317 -0.3501 -0.7056 0.1841 0.6843 0.7020 0.3131 0.6397 -53.454 0.286 -63.702 B 603 HIS A 115 HIS~? B 646 ASP A 225 ASP~? B 739 GLY A 89 GLY^? ULMNm 3 1m21_c00 PEPTIDE AMIDASE user 1 3 RMSD = 1.36 A TRANSFORM -0.8327 0.0526 0.5513 -0.3757 -0.7850 -0.4926 0.4068 -0.6173 0.6734 12.021 36.240 62.009 A 123 LYS A 6 LYS~? A 202 SER A 141 SER^? A 226 SER A 195 SER^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.37 A TRANSFORM -0.3054 -0.9106 -0.2786 0.5939 -0.4109 0.6917 -0.7443 0.0458 0.6663 89.815 7.466 19.555 A 67 ASP A 184 ASP~? A 68 ALA A 185 ALA~? A 72 LEU A 186 LEU~? ULMNm 3 1qrz_c22 PLASMINOGEN user 3 3 RMSD = 1.37 A TRANSFORM -0.7733 -0.1635 -0.6126 0.5741 -0.5906 -0.5671 -0.2691 -0.7902 0.5506 59.136 3.546 16.569 C 603 HIS A 115 HIS~? C 646 ASP A 225 ASP~? C 739 GLY A 91 GLY^? ULMNm 3 1m21_c01 PEPTIDE AMIDASE user 1 3 RMSD = 1.38 A TRANSFORM 0.8283 -0.0560 -0.5574 0.3777 0.7906 0.4819 0.4137 -0.6098 0.6760 25.507 -30.150 10.487 B 123 LYS A 6 LYS~? B 202 SER A 141 SER^? B 226 SER A 195 SER^? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.38 A TRANSFORM 0.3086 0.6974 0.6469 -0.5823 -0.3992 0.7082 0.7521 -0.5952 0.2829 -23.234 2.021 -17.038 274 HIS A 12 HIS.? 320 HIS A 234 HIS^? 375 ASP A 221 ASP~? ULMNm 3 1qrz_c21 PLASMINOGEN user 3 3 RMSD = 1.38 A TRANSFORM -0.0056 0.7162 -0.6979 -0.6079 0.5517 0.5711 0.7940 0.4274 0.4323 -38.269 -7.756 -61.708 B 603 HIS A 115 HIS~? B 646 ASP A 225 ASP~? B 739 GLY A 91 GLY^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.38 A TRANSFORM -0.5623 0.7888 0.2481 0.1251 0.3777 -0.9174 -0.8174 -0.4848 -0.3111 23.883 104.219 41.859 193 ASP A 167 ASP.? 231 ASP A 209 ASP.? 294 ASP A 171 ASP^? ULMNm 3 2dbt_c00 CHITINASE C user 2 3 RMSD = 1.39 A TRANSFORM 0.6718 -0.2093 0.7106 -0.5502 -0.7833 0.2894 0.4960 -0.5854 -0.6413 35.090 58.381 20.656 A 147 GLU A 88 GLU^? A 156 GLU A 100 GLU^? A 194 ASN A 235 ASN.? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 1.40 A TRANSFORM 0.6822 -0.0956 0.7249 -0.5849 0.5235 0.6195 -0.4387 -0.8467 0.3012 -15.103 46.409 66.249 179 ASP A 184 ASP~? 214 ASP A 221 ASP~? 289 ASP A 54 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 7 3 RMSD = 1.40 A TRANSFORM -0.4113 -0.7703 0.4873 -0.9111 0.3622 -0.1967 -0.0250 -0.5249 -0.8508 52.532 84.207 49.942 A 228 ASP A 171 ASP^? A 260 ASP A 146 ASP~? A 329 ASP A 167 ASP.? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.40 A TRANSFORM 0.0965 0.0051 0.9953 0.9363 0.3387 -0.0925 -0.3376 0.9409 0.0279 2.107 30.057 -9.318 A 603 HIS A 4 HIS.? A 646 ASP A 240 ASP~? A 739 GLY A 168 GLY.? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 1.42 A TRANSFORM -0.0483 0.9255 -0.3758 -0.6736 0.2476 0.6964 0.7375 0.2868 0.6114 -26.592 -2.924 -25.133 A 603 HIS A 115 HIS~? A 646 ASP A 225 ASP~? A 739 GLY A 89 GLY^? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 RMSD = 1.42 A TRANSFORM -0.0453 0.1595 -0.9862 -0.6520 -0.7527 -0.0918 -0.7569 0.6388 0.1380 80.012 137.643 37.938 229 ASP A 104 ASP.? 264 GLU A 231 GLU^? 328 ASP A 227 ASP.? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.42 A TRANSFORM -0.9943 -0.0312 -0.1024 -0.1034 0.0330 0.9941 -0.0276 0.9990 -0.0361 72.012 -16.520 44.379 A 198 GLY A 3 GLY.? A 228 SER A 5 SER.? A 549 ASP A 167 ASP.? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.42 A TRANSFORM -0.3359 -0.8428 -0.4205 -0.6990 0.5223 -0.4885 0.6313 0.1298 -0.7646 -0.518 54.926 -30.603 B 603 HIS A 4 HIS.? B 646 ASP A 240 ASP~? B 739 GLY A 168 GLY.? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.43 A TRANSFORM 0.0348 0.0093 0.9993 0.9543 0.2968 -0.0360 -0.2969 0.9549 0.0014 1.067 28.625 52.925 C 603 HIS A 4 HIS.? C 646 ASP A 240 ASP~? C 739 GLY A 168 GLY.? ULMNm 3 1mt5_c04 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.44 A TRANSFORM 0.5738 -0.6659 0.4768 0.6319 0.7303 0.2596 -0.5211 0.1523 0.8398 68.015 -53.893 31.892 E 142 LYS A 6 LYS~? E 217 SER A 141 SER^? E 241 SER A 195 SER^? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.44 A TRANSFORM 0.0391 0.6925 -0.7204 -0.5672 0.6089 0.5545 0.8226 0.3869 0.4166 -10.982 -10.022 -23.027 A 603 HIS A 115 HIS~? A 646 ASP A 225 ASP~? A 739 GLY A 91 GLY^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.45 A TRANSFORM 0.1633 -0.8402 -0.5171 0.9707 0.0433 0.2362 -0.1760 -0.5405 0.8227 71.210 -5.054 -4.942 A 229 ALA A 19 ALA.? A 257 ALA A 16 ALA.? A 328 ASP A 225 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 2 3 RMSD = 1.45 A TRANSFORM 0.1676 -0.9858 0.0106 0.6661 0.1053 -0.7384 0.7268 0.1308 0.6743 21.895 -6.466 -27.331 A 271 PRO A 214 PRO~? A 272 LEU A 216 LEU~? A 276 ARG A 13 ARG.? ULMNm 3 1b2m_c00 5'-R(*GP*(CH2)U)-3' user 2 3 RMSD = 1.45 A TRANSFORM 0.1779 -0.7083 -0.6832 -0.8682 0.2139 -0.4478 0.4632 0.6728 -0.5769 26.695 53.649 -16.292 A 40 HIS A 4 HIS.? A 58 GLU A 237 GLU.? A 92 HIS A 234 HIS^? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 3 3 RMSD = 1.45 A TRANSFORM 0.0574 0.8073 -0.5874 -0.4903 -0.4897 -0.7210 -0.8697 0.3294 0.3677 4.917 61.552 46.088 B 317 GLU A 224 GLU~? B 319 ASP A 221 ASP~? B 359 ARG A 218 ARG~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 1 3 RMSD = 1.46 A TRANSFORM -0.1165 0.2926 -0.9491 0.3408 -0.8858 -0.3149 -0.9329 -0.3602 0.0035 38.881 104.533 58.259 A 228 ASP A 54 ASP~? A 260 ASP A 194 ASP.? A 329 ASP A 184 ASP~? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.46 A TRANSFORM -0.8552 0.2285 0.4653 -0.5127 -0.5055 -0.6940 0.0766 -0.8320 0.5495 18.856 61.312 19.725 A 317 GLU A 224 GLU~? A 319 ASP A 221 ASP~? A 359 ARG A 218 ARG~? ULMNm 3 2dw7_c41 BLL6730 PROTEIN user 2 3 RMSD = 1.47 A TRANSFORM 0.7104 0.3508 -0.6101 0.5295 0.3046 0.7917 0.4636 -0.8855 0.0306 21.752 19.361 28.637 J 182 LYS A 23 LYS~? J 184 LYS A 27 LYS~? J 345 ASP A 18 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.48 A TRANSFORM 0.3503 -0.8202 0.4523 0.9366 0.3112 -0.1610 -0.0087 0.4800 0.8772 32.545 1.861 22.821 A 316 ALA A 169 ALA.? A 317 GLY A 168 GLY.? A 318 ASP A 167 ASP.? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.48 A TRANSFORM 0.4674 -0.3835 -0.7965 0.0875 0.9166 -0.3900 0.8797 0.1126 0.4620 17.902 29.397 4.336 B 1 SER A 5 SER.? B 69 ALA A 8 ALA~? B 241 ASN A 9 ASN~? ULMNm 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 1 3 RMSD = 1.49 A TRANSFORM -0.8762 -0.3726 -0.3058 0.4796 -0.6106 -0.6301 0.0480 -0.6988 0.7137 44.875 39.567 18.857 B 40 HIS A 4 HIS.? B 58 GLU A 237 GLU.? B 92 HIS A 234 HIS^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.49 A TRANSFORM -0.4279 0.8912 0.1504 0.8908 0.3878 0.2367 0.1526 0.2353 -0.9599 29.205 -8.639 27.775 A 229 ALA A 15 ALA.? A 257 ALA A 16 ALA.? A 328 ASP A 221 ASP~? ULMNm 3 2dbt_c00 CHITINASE C user 5 3 RMSD = 1.49 A TRANSFORM -0.5284 -0.1133 -0.8414 0.8359 0.1036 -0.5389 0.1482 -0.9881 0.0400 97.936 8.157 27.907 A 147 GLU A 143 GLU.? A 156 GLU A 197 GLU^? A 194 ASN A 9 ASN~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 13 3 RMSD = 1.49 A TRANSFORM -0.8900 -0.4316 0.1473 0.3893 -0.8872 -0.2476 0.2375 -0.1630 0.9576 67.098 50.201 -5.072 A 229 ALA A 196 ALA^? A 257 ALA A 193 ALA.? A 328 ASP A 171 ASP^? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 3 3 RMSD = 1.49 A TRANSFORM -0.1877 -0.9418 0.2790 -0.5548 -0.1327 -0.8214 0.8106 -0.3089 -0.4975 109.597 120.036 87.795 A 451 GLU A 197 GLU^? A 504 TYR A 233 TYR^? A 540 GLU A 231 GLU^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 RMSD = 1.49 A TRANSFORM -0.7536 -0.3723 -0.5418 -0.4291 0.9029 -0.0235 0.4980 0.2148 -0.8402 61.271 89.267 7.384 193 ASP A 171 ASP^? 231 ASP A 221 ASP~? 294 ASP A 194 ASP.? ULMNm 3 1ig8_c00 HEXOKINASE PII user 1 3 RMSD = 1.50 A TRANSFORM 0.8480 0.5270 0.0563 -0.4917 0.7428 0.4543 0.1976 -0.4130 0.8891 -10.138 50.319 -9.299 A 158 SER A 58 SER~? A 173 ARG A 21 ARG~? A 211 ASP A 54 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 RMSD = 1.50 A TRANSFORM 0.1074 -0.5036 -0.8572 -0.9942 -0.0600 -0.0893 -0.0065 0.8619 -0.5071 48.839 127.518 -0.866 193 ASP A 171 ASP^? 231 ASP A 221 ASP~? 294 ASP A 167 ASP.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.50 A TRANSFORM -0.7317 0.3024 -0.6109 -0.6560 -0.0693 0.7515 0.1849 0.9507 0.2491 42.472 30.657 -42.075 B 60 HIS A 4 HIS.? B 84 ASP A 166 ASP.? B 140 GLY A 236 GLY.? ULMNm 3 2dbt_c02 CHITINASE C user 2 3 RMSD = 1.50 A TRANSFORM -0.4366 -0.0629 -0.8974 0.7110 0.5871 -0.3871 0.5512 -0.8071 -0.2116 83.200 -11.618 20.070 C 147 GLU A 88 GLU^? C 156 GLU A 100 GLU^? C 194 ASN A 235 ASN.? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.50 A TRANSFORM -0.7436 0.1097 0.6596 0.6668 0.1937 0.7196 -0.0488 0.9749 -0.2172 138.869 45.502 118.569 B1198 GLY A 3 GLY.? B1228 SER A 5 SER.? B1549 ASP A 167 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 9 3 RMSD = 1.50 A TRANSFORM -0.6285 -0.2701 0.7294 0.0803 0.9102 0.4063 -0.7736 0.3140 -0.5504 41.980 39.893 41.617 A 228 ASP A 171 ASP^? A 260 ASP A 184 ASP~? A 329 ASP A 194 ASP.?