*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ddj_c13 PLASMINOGEN user 7 3 RMSD = 0.58 A TRANSFORM 0.8414 0.5111 -0.1758 0.3339 -0.7473 -0.5745 0.4250 -0.4247 0.7994 -56.812 56.400 -8.066 B 603 HIS B 280 HIS~? B 646 ASP B 284 ASP~? B 739 GLY B 137 GLY^? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 0.59 A TRANSFORM -0.7236 0.4450 0.5276 -0.5125 -0.8584 0.0211 -0.4623 0.2552 -0.8492 -42.462 68.411 -41.723 B 603 HIS A 280 HIS~? B 646 ASP A 284 ASP~? B 739 GLY A 137 GLY^? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 RMSD = 0.66 A TRANSFORM -0.8186 -0.1888 0.5425 -0.1079 0.9782 0.1775 0.5642 -0.0868 0.8211 -14.215 -23.934 -26.889 B 114 HIS B 280 HIS~? B 197 ASP B 284 ASP~? B 223 ALA B 94 ALA.? ULMNm 3 1ddj_c12 PLASMINOGEN user 6 3 RMSD = 0.68 A TRANSFORM -0.8652 0.4756 -0.1588 -0.3106 -0.2597 0.9144 -0.3936 -0.8405 -0.3724 11.222 76.728 28.253 A 603 HIS B 280 HIS~? A 646 ASP B 284 ASP~? A 739 GLY B 137 GLY^? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 RMSD = 0.68 A TRANSFORM 0.8266 0.1872 -0.5307 0.0183 -0.9515 -0.3071 0.5625 -0.2441 0.7900 -79.679 21.277 -22.840 A 114 HIS B 280 HIS~? A 197 ASP B 284 ASP~? A 223 ALA B 94 ALA.? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 0.70 A TRANSFORM 0.7733 0.0290 -0.6334 0.3187 0.8458 0.4278 -0.5482 0.5326 -0.6448 -37.871 -18.967 -56.174 B 114 HIS A 280 HIS~? B 197 ASP A 284 ASP~? B 223 ALA A 94 ALA.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 0.71 A TRANSFORM -0.7812 -0.0217 0.6239 -0.2288 -0.9199 -0.3184 -0.5809 0.3915 -0.7137 -56.447 21.083 -52.878 A 114 HIS A 280 HIS~? A 197 ASP A 284 ASP~? A 223 ALA A 94 ALA.? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 0.72 A TRANSFORM 0.9361 0.0936 0.3390 0.2966 0.3076 -0.9041 0.1889 -0.9469 -0.2602 21.468 39.670 30.445 A 603 HIS A 280 HIS~? A 646 ASP A 284 ASP~? A 739 GLY A 137 GLY^? ULMNm 3 1ddj_c14 PLASMINOGEN user 5 3 RMSD = 0.74 A TRANSFORM -0.8554 0.4679 -0.2221 -0.3441 -0.1928 0.9189 -0.3871 -0.8625 -0.3259 8.448 74.009 92.379 C 603 HIS B 280 HIS~? C 646 ASP B 284 ASP~? C 739 GLY B 137 GLY^? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 0.78 A TRANSFORM 0.9216 0.0505 0.3848 0.3436 0.3548 -0.8695 0.1805 -0.9336 -0.3096 20.913 37.572 92.615 C 603 HIS A 280 HIS~? C 646 ASP A 284 ASP~? C 739 GLY A 137 GLY^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 21 3 RMSD = 0.96 A TRANSFORM -0.1558 0.9053 -0.3953 0.4565 0.4208 0.7839 -0.8760 0.0583 0.4788 36.116 39.580 15.793 199 ASP B 114 ASP.? 218 GLU A 186 GLU.? 329 ASP A 171 ASP~? ULMNm 3 1a0j_c13 TRYPSIN user 2 3 RMSD = 0.97 A TRANSFORM 0.4716 0.5553 -0.6850 -0.8736 0.1887 -0.4485 0.1198 -0.8099 -0.5741 18.068 30.236 77.671 B 57 HIS A 280 HIS~? B 102 ASP A 284 ASP~? B 193 GLY A 97 GLY^? ULMNm 3 1a0j_c13 TRYPSIN user 6 3 RMSD = 0.97 A TRANSFORM -0.4028 0.1246 0.9067 0.8485 -0.3205 0.4210 -0.3431 -0.9390 -0.0233 49.407 48.267 88.689 B 57 HIS B 280 HIS~? B 102 ASP B 284 ASP~? B 193 GLY B 97 GLY^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.98 A TRANSFORM 0.8406 -0.4565 -0.2916 -0.2654 -0.8163 0.5130 0.4723 0.3538 0.8073 33.683 -55.593 -128.952 A 183 GLY B 117 GLY.? B 419 GLY B 119 GLY.? B 420 ALA B 105 ALA.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 0.99 A TRANSFORM -0.5505 -0.7999 -0.2391 -0.0685 0.3287 -0.9420 -0.8320 0.5022 0.2357 43.603 -49.929 -7.214 A 250 ALA A 105 ALA.? A 251 GLY A 102 GLY^? A 252 ASP A 243 ASP.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.99 A TRANSFORM -0.9045 -0.4261 -0.0171 0.1793 -0.3435 -0.9219 -0.3870 0.8369 -0.3871 40.393 -85.288 -152.493 A 183 GLY A 117 GLY.? B 419 GLY A 119 GLY.? B 420 ALA A 105 ALA.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 0.99 A TRANSFORM 0.3777 -0.8693 -0.3188 -0.0261 -0.3542 0.9348 0.9255 0.3448 0.1565 41.643 -11.505 -10.406 A 250 ALA B 105 ALA.? A 251 GLY B 102 GLY^? A 252 ASP B 243 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 0.99 A TRANSFORM -0.1461 -0.4569 -0.8774 0.3623 -0.8500 0.3823 0.9205 0.2621 -0.2898 -3.662 86.113 13.348 179 ASP B 171 ASP~? 227 GLU A 245 GLU.? 289 ASP A 114 ASP.? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 5 3 RMSD = 1.00 A TRANSFORM 0.8602 0.4919 -0.1346 -0.4921 0.8699 0.0339 -0.1337 -0.0371 -0.9903 -32.293 4.198 40.659 B 57 HIS B 280 HIS~? B 102 ASP B 284 ASP~? B 193 GLY B 97 GLY^? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 5 3 RMSD = 1.00 A TRANSFORM 0.7138 0.6691 0.2069 -0.6752 0.5791 0.4568 -0.1859 0.4658 -0.8652 -15.161 20.101 1.567 A 57 HIS B 280 HIS~? A 102 ASP B 284 ASP~? A 193 GLY B 97 GLY^? ULMNm 3 1a0j_c15 TRYPSIN user 6 3 RMSD = 1.00 A TRANSFORM -0.0846 0.9842 -0.1554 0.6593 0.1722 0.7319 -0.7471 0.0405 0.6635 -24.930 4.958 106.881 D 57 HIS B 280 HIS~? D 102 ASP B 284 ASP~? D 193 GLY B 97 GLY^? ULMNm 3 1a0j_c15 TRYPSIN user 2 3 RMSD = 1.00 A TRANSFORM 0.2962 0.6455 0.7040 -0.5603 0.7143 -0.4193 0.7735 0.2703 -0.5733 -7.445 -18.376 82.836 D 57 HIS A 280 HIS~? D 102 ASP A 284 ASP~? D 193 GLY A 97 GLY^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.00 A TRANSFORM -0.0186 -0.5105 0.8597 0.2448 0.8313 0.4989 0.9694 -0.2197 -0.1095 52.898 -31.965 -49.622 B 250 ALA A 105 ALA.? B 251 GLY A 102 GLY^? B 252 ASP A 243 ASP.? ULMNm 3 1a0j_c12 TRYPSIN user 2 3 RMSD = 1.00 A TRANSFORM 0.1465 -0.9797 0.1371 0.4193 0.1871 0.8884 0.8960 0.0726 -0.4382 64.304 45.195 58.087 A 57 HIS A 280 HIS~? A 102 ASP A 284 ASP~? A 193 GLY A 97 GLY^? ULMNm 3 1a0j_c12 TRYPSIN user 5 3 RMSD = 1.00 A TRANSFORM -0.3398 -0.6386 -0.6905 -0.2856 0.7696 -0.5711 -0.8961 -0.0031 0.4439 47.796 15.690 74.979 A 57 HIS B 280 HIS~? A 102 ASP B 284 ASP~? A 193 GLY B 97 GLY^? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 RMSD = 1.00 A TRANSFORM -0.7332 0.4812 0.4806 0.6769 0.5846 0.4473 0.0657 -0.6532 0.7543 -20.500 13.050 75.465 B 57 HIS A 280 HIS~? B 102 ASP A 284 ASP~? B 193 GLY A 97 GLY^? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.00 A TRANSFORM -0.5311 0.7921 0.3009 0.8136 0.5759 -0.0802 0.2368 -0.2022 0.9503 -13.591 10.092 37.981 A 57 HIS A 280 HIS~? A 102 ASP A 284 ASP~? A 193 GLY A 97 GLY^? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 5 3 RMSD = 1.00 A TRANSFORM 0.7214 0.6601 0.2095 -0.6708 0.5907 0.4484 -0.1722 0.4641 -0.8689 -14.987 19.636 1.411 A 57 HIS B 280 HIS~? A 102 ASP B 284 ASP~? A 193 GLY B 97 GLY^? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.01 A TRANSFORM -0.5400 0.7886 0.2940 0.8116 0.5804 -0.0662 0.2228 -0.2028 0.9535 -13.623 10.087 37.952 A 57 HIS A 280 HIS~? A 102 ASP A 284 ASP~? A 193 GLY A 97 GLY^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.01 A TRANSFORM 0.0706 0.1472 -0.9866 -0.0348 0.9888 0.1451 -0.9969 -0.0241 -0.0749 15.092 -39.426 -47.328 B 250 ALA B 105 ALA.? B 251 GLY B 102 GLY^? B 252 ASP B 243 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 20 3 RMSD = 1.01 A TRANSFORM -0.5883 -0.2842 -0.7571 -0.8039 0.1038 0.5856 0.0878 -0.9531 0.2895 53.343 30.956 57.107 199 ASP A 284 ASP~? 218 GLU A 206 GLU~? 329 ASP A 141 ASP.? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 5 3 RMSD = 1.01 A TRANSFORM -0.8354 0.5380 0.1124 0.5260 0.7231 0.4478 -0.1597 -0.4332 0.8871 2.839 1.689 34.099 30 GLY B 117 GLY.? 48 HIS B 244 HIS.? 99 ASP B 243 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.01 A TRANSFORM -0.9045 0.3086 -0.2944 0.3218 0.9468 0.0037 -0.2799 0.0914 0.9557 132.057 -7.868 20.405 A 316 ALA A 105 ALA.? A 317 GLY A 102 GLY^? A 318 ASP A 243 ASP.? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 RMSD = 1.01 A TRANSFORM 0.9339 0.3507 0.0697 -0.3573 0.9221 0.1483 0.0122 0.1634 -0.9865 0.659 -4.045 -2.759 30 GLY A 117 GLY.? 48 HIS A 244 HIS.? 99 ASP A 243 ASP.? ULMNm 3 1a0j_c14 TRYPSIN user 2 3 RMSD = 1.02 A TRANSFORM -0.9939 -0.0690 0.0863 -0.1019 0.2708 -0.9572 -0.0427 0.9602 0.2762 33.727 20.730 39.971 C 57 HIS A 280 HIS~? C 102 ASP A 284 ASP~? C 193 GLY A 97 GLY^? ULMNm 3 1a0j_c14 TRYPSIN user 5 3 RMSD = 1.02 A TRANSFORM 0.9595 -0.2267 -0.1673 0.0690 -0.3866 0.9197 0.2732 0.8939 0.3553 29.478 58.251 41.452 C 57 HIS B 280 HIS~? C 102 ASP B 284 ASP~? C 193 GLY B 97 GLY^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.03 A TRANSFORM 0.2780 0.4080 0.8696 -0.3413 0.8882 -0.3076 0.8979 0.2113 -0.3862 61.792 17.931 -2.783 199 ASP A 114 ASP.? 218 GLU B 186 GLU.? 329 ASP B 171 ASP~? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 6 3 RMSD = 1.03 A TRANSFORM -0.8208 0.1155 -0.5594 0.2843 0.9320 -0.2249 -0.4954 0.3436 0.7978 14.343 -9.249 24.446 E 57 HIS B 280 HIS~? E 102 ASP B 284 ASP~? E 193 GLY B 97 GLY^? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 RMSD = 1.04 A TRANSFORM 0.7921 -0.4241 0.4390 -0.0782 0.6427 0.7621 0.6054 0.6380 -0.4759 34.861 10.485 -0.409 E 57 HIS A 280 HIS~? E 102 ASP A 284 ASP~? E 193 GLY A 97 GLY^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 5 3 RMSD = 1.07 A TRANSFORM 0.6942 -0.1833 -0.6961 -0.4911 -0.8276 -0.2719 0.5263 -0.5306 0.6645 -5.232 24.975 21.197 14 ASP A 284 ASP~? 16 HIS A 282 HIS~? 67 GLY A 242 GLY^? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 2 3 RMSD = 1.08 A TRANSFORM -0.8817 -0.4351 -0.1823 -0.4711 0.8314 0.2946 -0.0234 -0.3457 0.9380 68.800 -30.532 49.889 A 44 HIS A 281 HIS~? A 45 HIS B 281 HIS~? A 261 PHE B 239 PHE^? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.08 A TRANSFORM 0.0072 -0.9206 0.3905 -0.5004 -0.3414 -0.7957 -0.8658 0.1897 0.4631 22.058 62.305 29.083 179 ASP A 171 ASP~? 227 GLU B 245 GLU.? 289 ASP B 114 ASP.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.09 A TRANSFORM 0.9191 -0.0186 -0.3936 0.1210 0.9640 0.2369 -0.3750 0.2654 -0.8882 12.679 -0.690 -42.191 A 465 GLY A 137 GLY^? A 501 ASP B 114 ASP.? B 367 TYR A 220 TYR^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.09 A TRANSFORM 0.4647 -0.7502 -0.4704 -0.7814 -0.5973 0.1806 0.4164 -0.2836 0.8638 46.314 70.884 -23.056 D 465 GLY A 137 GLY^? D 501 ASP B 114 ASP.? E 367 TYR A 220 TYR^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 12 3 RMSD = 1.09 A TRANSFORM -0.7745 -0.4212 0.4720 0.2968 -0.9008 -0.3169 -0.5586 0.1053 -0.8227 18.486 24.076 -8.753 14 ASP B 284 ASP~? 16 HIS B 282 HIS~? 67 GLY B 242 GLY^? ULMNm 3 1sll_c00 SIALIDASE L user 1 3 RMSD = 1.10 A TRANSFORM 0.0342 0.9335 -0.3569 -0.3846 -0.3173 -0.8668 0.9225 -0.1669 -0.3482 -45.391 4.787 24.326 318 ASP A 224 ASP.? 595 GLU A 252 GLU~? 713 TYR A 220 TYR^? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 5 3 RMSD = 1.10 A TRANSFORM 0.7815 -0.5929 -0.1944 0.6239 0.7451 0.2359 -0.0049 0.3056 -0.9521 67.442 -32.438 11.801 A 44 HIS B 281 HIS~? A 45 HIS A 281 HIS~? A 261 PHE A 239 PHE^? ULMNm 3 1sll_c00 SIALIDASE L user 3 3 RMSD = 1.11 A TRANSFORM 0.1192 0.4423 0.8889 0.2185 -0.8850 0.4111 -0.9685 -0.1453 0.2021 -19.127 33.587 35.873 318 ASP B 224 ASP.? 595 GLU B 252 GLU~? 713 TYR B 220 TYR^? ULMNm 3 2odj_o01 PORIN D user 10 3 RMSD = 1.12 A TRANSFORM -0.9193 0.3725 -0.1271 0.2890 0.8582 0.4243 -0.2671 -0.3533 0.8966 -15.689 -24.187 82.591 B 156 HIS B 244 HIS.? B 208 ASP B 114 ASP.? B 296 SER B 201 SER^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 18 3 RMSD = 1.12 A TRANSFORM -0.3288 0.7233 0.6073 0.5477 0.6699 -0.5013 0.7694 -0.1678 0.6163 12.986 68.702 6.350 193 ASP B 141 ASP.? 231 ASP B 171 ASP~? 294 ASP B 284 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 4 3 RMSD = 1.13 A TRANSFORM 0.6281 0.1138 0.7697 -0.7306 -0.2539 0.6338 -0.2676 0.9605 0.0763 30.339 -11.198 -15.111 A 250 ALA B 118 ALA.? A 251 GLY B 117 GLY.? A 252 ASP B 114 ASP.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 7 3 RMSD = 1.13 A TRANSFORM -0.8470 -0.0906 -0.5238 0.3459 -0.8421 -0.4138 0.4036 0.5317 -0.7446 38.086 66.291 -62.705 D 465 GLY B 197 GLY.? D 501 ASP A 114 ASP.? E 367 TYR B 220 TYR^? ULMNm 3 1sll_c00 SIALIDASE L user 4 3 RMSD = 1.14 A TRANSFORM 0.4928 0.8699 -0.0222 0.6691 -0.3625 0.6488 -0.5563 0.3345 0.7607 -23.808 14.378 15.137 318 ASP B 224 ASP.? 595 GLU B 256 GLU~? 713 TYR B 220 TYR^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.14 A TRANSFORM -0.5723 0.0528 0.8184 0.2069 0.9750 0.0817 0.7936 -0.2160 0.5689 22.551 -3.505 80.482 A 241 ASP B 284 ASP~? A 265 GLU B 273 GLU~? A 369 ASP B 141 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.14 A TRANSFORM -0.5817 0.6357 -0.5075 0.6927 0.0601 -0.7187 0.4264 0.7696 0.4753 5.552 -38.905 -7.985 A 250 ALA A 118 ALA.? A 251 GLY A 117 GLY.? A 252 ASP A 114 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 4 3 RMSD = 1.14 A TRANSFORM 0.8546 0.2461 -0.4573 -0.5138 0.2722 -0.8136 0.0758 -0.9302 -0.3590 12.432 -30.699 -39.239 B 250 ALA B 118 ALA.? B 251 GLY B 117 GLY.? B 252 ASP B 114 ASP.? ULMNm 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 RMSD = 1.14 A TRANSFORM 0.3545 -0.2784 0.8927 0.9271 -0.0198 -0.3743 -0.1219 -0.9603 -0.2510 26.039 -8.996 97.106 A 263 HIS A 136 HIS.? D 59 GLU B 273 GLU~? D 128 HIS A 280 HIS~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.14 A TRANSFORM -0.2510 -0.2903 -0.9234 -0.2251 -0.9103 0.3474 0.9414 -0.2950 -0.1632 25.543 35.437 45.551 A 316 ALA B 118 ALA.? A 317 GLY B 117 GLY.? A 318 ASP B 114 ASP.? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.15 A TRANSFORM 0.7935 0.4851 -0.3676 -0.5788 0.7881 -0.2094 -0.1882 -0.3789 -0.9061 -19.458 6.815 16.567 E 57 HIS A 244 HIS.? E 102 ASP A 243 ASP.? E 193 GLY A 117 GLY.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.15 A TRANSFORM 0.1764 -0.8078 0.5625 0.0723 -0.5592 -0.8258 -0.9817 -0.1863 0.0403 55.015 12.374 50.850 A 316 ALA A 118 ALA.? A 317 GLY A 117 GLY.? A 318 ASP A 114 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.15 A TRANSFORM -0.3531 0.7153 0.6031 -0.8543 0.0163 -0.5195 0.3814 0.6987 -0.6053 138.461 14.028 -14.736 A 316 ALA B 118 ALA.? A 317 GLY B 117 GLY.? A 318 ASP B 114 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.15 A TRANSFORM -0.8115 0.0566 0.5816 0.5330 -0.3365 0.7763 -0.2397 -0.9400 -0.2429 34.020 0.247 -36.326 B 250 ALA A 118 ALA.? B 251 GLY A 117 GLY.? B 252 ASP A 114 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.15 A TRANSFORM 0.1711 0.5259 -0.8331 0.1850 -0.8477 -0.4971 0.9677 0.0690 0.2423 -16.835 38.623 4.896 141 ASP A 284 ASP~? 166 GLY B 246 GLY.? 169 GLU B 249 GLU~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 4 3 RMSD = 1.16 A TRANSFORM 0.6747 0.7379 0.0157 -0.7381 0.6746 0.0142 0.0001 0.0212 -0.9998 -3.873 -10.296 -30.175 B 60 HIS A 280 HIS~? B 84 ASP A 284 ASP~? B 140 GLY A 162 GLY.? ULMNm 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 5 3 RMSD = 1.16 A TRANSFORM -0.5602 -0.0345 -0.8276 -0.2453 0.9612 0.1260 -0.7912 -0.2736 0.5469 2.268 -19.693 94.712 B 59 GLU B 273 GLU~? B 128 HIS A 280 HIS~? C 263 HIS A 136 HIS.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 7 3 RMSD = 1.16 A TRANSFORM -0.7803 0.6241 -0.0415 0.4350 0.5891 0.6810 -0.4494 -0.5133 0.7311 9.199 9.325 -2.842 A 465 GLY B 197 GLY.? A 501 ASP A 114 ASP.? B 367 TYR B 220 TYR^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 1.16 A TRANSFORM 0.4835 0.8692 -0.1036 0.8325 -0.4200 0.3614 -0.2706 0.2610 0.9266 123.563 30.581 15.841 A 316 ALA A 118 ALA.? A 317 GLY A 117 GLY.? A 318 ASP A 114 ASP.? ULMNm 3 1a0j_c14 TRYPSIN user 1 3 RMSD = 1.16 A TRANSFORM -0.4587 -0.0134 0.8885 -0.2858 -0.9445 -0.1618 -0.8414 0.3282 -0.4294 61.068 66.123 63.156 C 57 HIS A 244 HIS.? C 102 ASP A 243 ASP.? C 193 GLY A 117 GLY.? ULMNm 3 1cns_c00 CHITINASE user 8 3 RMSD = 1.17 A TRANSFORM 0.6770 -0.7251 0.1263 -0.7244 -0.6261 0.2885 0.1301 0.2868 0.9491 -10.738 27.647 73.329 A 67 GLU B 172 GLU~? A 89 GLU B 273 GLU~? A 120 SER A 129 SER~? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 5 3 RMSD = 1.17 A TRANSFORM -0.7610 0.3793 0.5263 0.6446 0.3508 0.6793 -0.0730 -0.8562 0.5114 -0.669 23.634 43.739 E 57 HIS B 244 HIS.? E 102 ASP B 243 ASP.? E 193 GLY B 117 GLY.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 9 3 RMSD = 1.18 A TRANSFORM -0.5044 0.7213 0.4746 0.8599 0.3698 0.3520 -0.0784 -0.5857 0.8068 5.020 -3.346 5.955 B 60 HIS B 280 HIS~? B 84 ASP B 284 ASP~? B 140 GLY B 162 GLY.? ULMNm 3 1a0j_c15 TRYPSIN user 1 3 RMSD = 1.18 A TRANSFORM -0.3905 0.7668 -0.5094 -0.9031 -0.4264 0.0505 0.1785 -0.4798 -0.8591 -20.628 37.672 86.176 D 57 HIS A 244 HIS.? D 102 ASP A 243 ASP.? D 193 GLY A 117 GLY.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.19 A TRANSFORM 0.6128 0.4176 -0.6709 0.0089 0.8453 0.5342 -0.7902 0.3333 -0.5143 -6.941 5.569 58.789 A 241 ASP A 284 ASP~? A 265 GLU A 273 GLU~? A 369 ASP A 141 ASP.? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.20 A TRANSFORM -0.9562 0.2886 0.0484 -0.0365 0.0464 -0.9983 0.2904 0.9563 0.0338 18.798 4.372 -8.801 A 57 HIS A 244 HIS.? A 102 ASP A 243 ASP.? A 193 GLY A 117 GLY.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.20 A TRANSFORM 0.5581 -0.7558 -0.3424 -0.6417 -0.6548 0.3993 0.5260 0.0031 0.8505 56.992 60.438 28.790 199 ASP A 122 ASP~? 242 GLU A 143 GLU^? 329 ASP A 114 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 11 3 RMSD = 1.20 A TRANSFORM -0.0894 -0.1020 0.9908 -0.3538 -0.9266 -0.1273 -0.9310 0.3619 -0.0468 20.735 46.240 0.126 141 ASP B 284 ASP~? 166 GLY A 246 GLY.? 169 GLU A 249 GLU~? ULMNm 3 1a0j_c14 TRYPSIN user 4 3 RMSD = 1.20 A TRANSFORM 0.6373 0.3644 -0.6790 0.0808 -0.9079 -0.4113 0.7663 -0.2073 0.6081 29.906 60.391 82.193 C 57 HIS B 244 HIS.? C 102 ASP B 243 ASP.? C 193 GLY B 117 GLY.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.20 A TRANSFORM -0.9382 -0.0714 0.3387 0.0810 0.9061 0.4153 0.3365 -0.4171 0.8443 27.914 2.832 -7.004 A 465 GLY B 137 GLY^? A 501 ASP A 114 ASP.? B 367 TYR B 220 TYR^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 RMSD = 1.20 A TRANSFORM 0.4937 0.8665 -0.0738 -0.4206 0.3122 0.8518 -0.7612 0.3895 -0.5186 -0.918 96.140 -16.292 193 ASP A 141 ASP.? 231 ASP A 171 ASP~? 294 ASP A 284 ASP~? ULMNm 3 1a0j_c12 TRYPSIN user 1 3 RMSD = 1.21 A TRANSFORM 0.9086 0.0898 0.4079 0.0657 0.9337 -0.3520 0.4124 -0.3466 -0.8425 23.052 6.702 46.352 A 57 HIS A 244 HIS.? A 102 ASP A 243 ASP.? A 193 GLY A 117 GLY.? ULMNm 3 1a0j_c13 TRYPSIN user 1 3 RMSD = 1.22 A TRANSFORM -0.2222 -0.6019 -0.7670 -0.6247 -0.5161 0.5860 0.7486 -0.6094 0.2613 44.382 80.468 67.490 B 57 HIS A 244 HIS.? B 102 ASP A 243 ASP.? B 193 GLY A 117 GLY.? ULMNm 3 1a0j_c15 TRYPSIN user 5 3 RMSD = 1.22 A TRANSFORM 0.3895 0.2125 0.8962 0.8076 -0.5466 -0.2214 -0.4428 -0.8100 0.3845 6.464 30.823 110.388 D 57 HIS B 244 HIS.? D 102 ASP B 243 ASP.? D 193 GLY B 117 GLY.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 6 3 RMSD = 1.22 A TRANSFORM -0.3671 0.4519 0.8130 0.5278 -0.6185 0.5821 -0.7659 -0.6429 0.0115 9.658 34.124 -9.145 B 60 HIS B 244 HIS.? B 84 ASP B 243 ASP.? B 140 GLY B 117 GLY.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 11 3 RMSD = 1.23 A TRANSFORM -0.8409 -0.4273 0.3322 0.5188 -0.8111 0.2700 -0.1541 -0.3993 -0.9038 20.051 20.083 4.634 14 ASP B 284 ASP~? 16 HIS B 281 HIS~? 67 GLY B 242 GLY^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.23 A TRANSFORM 0.5314 -0.7150 -0.4544 0.4848 -0.1832 0.8552 0.6947 0.6747 -0.2493 41.954 50.365 -17.038 A 229 ALA A 105 ALA.? A 257 ALA A 118 ALA.? A 328 ASP A 122 ASP~? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 RMSD = 1.23 A TRANSFORM -0.8167 0.4365 0.3774 -0.0940 0.5447 -0.8333 0.5693 0.7161 0.4038 1.584 -6.208 26.915 B 57 HIS A 244 HIS.? B 102 ASP A 243 ASP.? B 193 GLY A 117 GLY.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.23 A TRANSFORM -0.6356 -0.7685 -0.0737 0.6706 -0.5023 -0.5460 -0.3826 0.3964 -0.8346 54.676 55.909 -57.529 D 465 GLY B 137 GLY^? D 501 ASP A 114 ASP.? E 367 TYR B 220 TYR^? ULMNm 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 RMSD = 1.24 A TRANSFORM -0.3050 0.1357 0.9426 0.7196 0.6812 0.1348 0.6238 -0.7194 0.3054 22.586 13.488 75.880 A 18 HIS B 282 HIS~? A 91 ARG A 285 ARG~? A 129 SER B 229 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.24 A TRANSFORM -0.6662 -0.7424 -0.0711 -0.4473 0.4740 -0.7584 -0.5967 0.4735 0.6479 50.530 17.913 1.678 A 229 ALA B 105 ALA.? A 257 ALA B 118 ALA.? A 328 ASP B 122 ASP~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 4 3 RMSD = 1.24 A TRANSFORM 0.7508 -0.2900 -0.5935 -0.6604 -0.3458 -0.6665 0.0119 -0.8923 0.4512 1.374 0.834 32.116 14 ASP A 284 ASP~? 16 HIS A 281 HIS~? 67 GLY A 242 GLY^? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 4 3 RMSD = 1.24 A TRANSFORM 0.9783 0.0023 0.2070 -0.1739 -0.5337 0.8276 -0.1124 0.8457 0.5217 20.601 39.867 1.564 A 57 HIS B 244 HIS.? A 102 ASP B 243 ASP.? A 193 GLY B 117 GLY.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.25 A TRANSFORM -0.9545 0.2967 0.0288 -0.0198 0.0331 -0.9993 0.2975 0.9544 0.0258 18.134 4.525 -8.986 A 57 HIS A 244 HIS.? A 102 ASP A 243 ASP.? A 193 GLY A 117 GLY.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 31 3 RMSD = 1.25 A TRANSFORM -0.7069 0.5611 -0.4306 -0.2246 0.3992 0.8889 -0.6707 -0.7251 0.1562 44.354 29.028 52.793 199 ASP B 141 ASP.? 218 GLU A 249 GLU~? 329 ASP B 284 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 4 3 RMSD = 1.25 A TRANSFORM 0.8815 0.4683 0.0601 0.3838 -0.6366 -0.6689 0.2749 -0.6127 0.7409 -56.399 48.545 63.767 D 603 HIS B 280 HIS~? D 646 ASP B 284 ASP~? D 739 GLY B 137 GLY^? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.25 A TRANSFORM 0.7878 -0.4488 -0.4219 -0.5411 -0.8315 -0.1259 0.2943 -0.3274 0.8979 17.698 95.211 26.833 B 757 ASP A 284 ASP~? B 759 HIS A 280 HIS~? B 810 SER B 266 SER.? ULMNm 3 1a0j_c12 TRYPSIN user 4 3 RMSD = 1.25 A TRANSFORM -0.7661 0.5413 -0.3466 0.0139 0.5531 0.8330 -0.6426 -0.6333 0.4312 9.809 30.273 71.559 A 57 HIS B 244 HIS.? A 102 ASP B 243 ASP.? A 193 GLY B 117 GLY.? ULMNm 3 1a0j_c13 TRYPSIN user 5 3 RMSD = 1.26 A TRANSFORM -0.0589 -0.9608 0.2708 0.6447 -0.2437 -0.7245 -0.7622 -0.1319 -0.6338 63.927 53.814 50.934 B 57 HIS B 244 HIS.? B 102 ASP B 243 ASP.? B 193 GLY B 117 GLY.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 33 3 RMSD = 1.27 A TRANSFORM -0.1018 -0.2056 -0.9733 0.1612 -0.9689 0.1878 0.9817 0.1378 -0.1318 40.106 54.818 2.674 199 ASP B 171 ASP~? 218 GLU A 207 GLU~? 329 ASP A 114 ASP.? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 4 3 RMSD = 1.28 A TRANSFORM 0.9403 0.3395 0.0217 0.0005 -0.0653 0.9979 -0.3402 0.9383 0.0616 -6.341 29.539 21.426 B 57 HIS B 244 HIS.? B 102 ASP B 243 ASP.? B 193 GLY B 117 GLY.? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.28 A TRANSFORM -0.4493 0.6502 -0.6127 0.3752 0.7597 0.5310 -0.8108 -0.0087 0.5853 -2.769 34.426 29.012 A 757 ASP A 284 ASP~? A 759 HIS A 280 HIS~? A 810 SER B 266 SER.? ULMNm 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 2 3 RMSD = 1.29 A TRANSFORM -0.5050 -0.6404 -0.5787 -0.8627 0.3535 0.3616 0.0270 -0.6819 0.7310 12.610 27.044 9.667 A 48 ALA B 182 ALA~? A 52 HIS B 195 HIS^? A 191 TRP B 191 TRP.? ULMNm 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 2 3 RMSD = 1.29 A TRANSFORM 0.9112 -0.0099 0.4120 -0.2853 -0.7364 0.6134 -0.2973 0.6764 0.6738 6.033 30.324 5.262 E 166 ASP B 243 ASP.? E 168 LYS B 104 LYS.? E 171 ASN B 103 ASN.? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.29 A TRANSFORM -0.7600 0.5660 0.3196 -0.5429 -0.8231 0.1667 -0.3574 0.0468 -0.9328 -51.082 65.474 29.582 D 603 HIS A 280 HIS~? D 646 ASP A 284 ASP~? D 739 GLY A 137 GLY^? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 RMSD = 1.30 A TRANSFORM -0.8947 -0.4218 0.1471 0.3285 -0.8444 -0.4232 -0.3027 0.3303 -0.8940 27.949 90.022 -8.071 B 757 ASP B 284 ASP~? B 759 HIS B 280 HIS~? B 810 SER A 266 SER.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 4 3 RMSD = 1.30 A TRANSFORM 0.9738 -0.0025 0.2274 -0.1927 -0.5403 0.8191 -0.1208 0.8415 0.5266 20.733 39.895 1.639 A 57 HIS B 244 HIS.? A 102 ASP B 243 ASP.? A 193 GLY B 117 GLY.? ULMNm 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 1 3 RMSD = 1.30 A TRANSFORM 0.3324 -0.9423 0.0409 0.9353 0.3237 -0.1430 -0.1215 -0.0858 -0.9889 25.189 16.863 -24.631 A 48 ALA A 182 ALA~? A 52 HIS A 195 HIS^? A 191 TRP A 191 TRP.? ULMNm 3 1euu_c00 SIALIDASE user 4 3 RMSD = 1.30 A TRANSFORM -0.0022 0.5877 -0.8090 0.9309 0.2967 0.2131 -0.3653 0.7527 0.5478 -5.842 -25.794 -7.702 92 ASP B 224 ASP.? 260 GLU B 256 GLU~? 370 TYR B 220 TYR^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 15 3 RMSD = 1.31 A TRANSFORM 0.0075 -0.7824 0.6227 -0.2944 -0.5969 -0.7463 -0.9556 0.1777 0.2348 72.540 36.295 11.239 199 ASP A 171 ASP~? 218 GLU B 207 GLU~? 329 ASP B 114 ASP.? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 3 3 RMSD = 1.31 A TRANSFORM 0.7982 0.4881 -0.3531 -0.0619 0.6494 0.7579 -0.5992 0.5831 -0.5485 -7.675 10.826 -4.612 E 57 HIS A 280 HIS~? E 102 ASP A 284 ASP~? E 193 GLY A 162 GLY.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 RMSD = 1.32 A TRANSFORM -0.6969 -0.6958 -0.1734 0.5372 -0.3464 -0.7690 -0.4751 0.6291 -0.6152 60.970 36.189 -0.913 199 ASP B 122 ASP~? 242 GLU B 143 GLU^? 329 ASP B 114 ASP.? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 RMSD = 1.33 A TRANSFORM 0.5443 0.0540 0.8371 -0.1582 0.9866 0.0393 0.8238 0.1538 -0.5456 25.657 24.540 7.908 A 757 ASP B 284 ASP~? A 759 HIS B 280 HIS~? A 810 SER A 266 SER.? ULMNm 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 1 3 RMSD = 1.34 A TRANSFORM -0.8965 0.4100 -0.1679 0.0888 -0.2050 -0.9747 0.4341 0.8887 -0.1473 -4.546 -2.474 -11.744 E 166 ASP A 243 ASP.? E 168 LYS A 104 LYS.? E 171 ASN A 103 ASN.? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 7 3 RMSD = 1.34 A TRANSFORM -0.7089 0.3325 0.6220 0.2573 0.9430 -0.2109 0.6567 -0.0105 0.7541 11.614 -8.631 21.627 E 57 HIS B 280 HIS~? E 102 ASP B 284 ASP~? E 193 GLY B 162 GLY.? ULMNm 3 2odj_o01 PORIN D user 4 3 RMSD = 1.36 A TRANSFORM 0.9738 0.0438 0.2230 -0.0849 0.9803 0.1785 0.2107 0.1927 -0.9584 -9.285 -29.606 45.693 B 156 HIS A 244 HIS.? B 208 ASP A 114 ASP.? B 296 SER A 201 SER^? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 15 3 RMSD = 1.37 A TRANSFORM -0.3578 -0.3873 -0.8497 0.5848 0.6164 -0.5273 -0.7280 0.6856 -0.0059 59.275 23.162 -0.473 199 ASP B 243 ASP.? 242 GLU B 210 GLU~? 329 ASP B 122 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.37 A TRANSFORM 0.1919 -0.9787 0.0734 -0.8829 -0.1395 0.4484 0.4286 0.1508 0.8908 70.131 39.590 23.541 199 ASP A 171 ASP~? 242 GLU A 143 GLU^? 329 ASP B 114 ASP.? ULMNm 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 RMSD = 1.37 A TRANSFORM 0.5979 -0.3352 0.7281 -0.1345 0.8535 0.5034 0.7902 0.3989 -0.4652 15.947 -96.425 -67.849 C 137 TYR A 216 TYR~? C 142 LEU A 99 LEU^? C 165 LYS A 215 LYS~? ULMNm 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 8 3 RMSD = 1.37 A TRANSFORM -0.5533 0.7181 -0.4221 -0.7409 -0.6559 -0.1445 0.3806 -0.2328 -0.8950 -8.740 49.654 46.196 B 18 HIS B 282 HIS~? B 91 ARG A 285 ARG~? B 129 SER B 229 SER~? ULMNm 3 1a0j_c15 TRYPSIN user 3 3 RMSD = 1.37 A TRANSFORM 0.0007 0.8797 0.4755 -0.9405 -0.1610 0.2992 -0.3398 0.4474 -0.8272 -19.466 20.405 68.238 D 57 HIS A 280 HIS~? D 102 ASP A 284 ASP~? D 193 GLY A 162 GLY.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 RMSD = 1.38 A TRANSFORM 0.3600 0.9315 0.0514 0.9251 -0.3493 -0.1486 0.1205 -0.1010 0.9876 -33.362 22.489 2.025 141 ASP B 227 ASP^? 166 GLY B 242 GLY^? 169 GLU B 245 GLU.? ULMNm 3 1a0j_c13 TRYPSIN user 3 3 RMSD = 1.38 A TRANSFORM -0.7007 0.3534 -0.6198 -0.6422 -0.6909 0.3321 0.3108 -0.6307 -0.7110 20.860 72.433 69.832 B 57 HIS A 280 HIS~? B 102 ASP A 284 ASP~? B 193 GLY A 162 GLY.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 2 3 RMSD = 1.38 A TRANSFORM 0.6747 -0.0952 0.7319 0.2822 0.9496 -0.1367 0.6820 -0.2988 -0.6676 34.708 -17.802 -11.089 B 60 HIS A 280 HIS~? B 84 ASP A 284 ASP~? B 140 GLY A 97 GLY^? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.39 A TRANSFORM 0.3007 -0.9525 -0.0480 0.7057 0.1884 0.6831 0.6416 0.2392 -0.7288 8.704 37.783 -15.946 A 81 ASP B 243 ASP.? A 99 GLY B 102 GLY^? A 125 ASN B 103 ASN.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 7 3 RMSD = 1.39 A TRANSFORM -0.6092 0.5196 -0.5991 -0.0772 0.7130 0.6969 -0.7892 -0.4708 0.3943 7.465 -1.612 9.442 B 60 HIS B 280 HIS~? B 84 ASP B 284 ASP~? B 140 GLY B 97 GLY^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 10 3 RMSD = 1.39 A TRANSFORM -0.8620 0.1096 0.4950 0.3249 -0.6301 0.7052 -0.3892 -0.7687 -0.5075 -0.079 18.124 24.685 14 ASP B 284 ASP~? 16 HIS B 281 HIS~? 67 GLY B 225 GLY.? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 RMSD = 1.39 A TRANSFORM 0.2557 -0.9593 -0.1200 0.8974 0.1894 0.3984 0.3595 0.2096 -0.9093 84.917 89.140 28.460 229 ASP A 141 ASP.? 264 GLU B 273 GLU~? 328 ASP A 284 ASP~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 3 3 RMSD = 1.40 A TRANSFORM 0.8926 0.2131 -0.3973 -0.4091 0.0125 -0.9124 0.1894 -0.9770 -0.0983 -17.880 -14.554 32.865 14 ASP A 284 ASP~? 16 HIS A 281 HIS~? 67 GLY A 225 GLY.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.40 A TRANSFORM -0.2016 0.8006 0.5643 -0.9787 -0.1873 -0.0840 -0.0384 0.5692 -0.8213 -21.911 24.104 -35.393 141 ASP A 227 ASP^? 166 GLY A 242 GLY^? 169 GLU A 245 GLU.? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 12 3 RMSD = 1.40 A TRANSFORM 0.9827 0.0127 -0.1845 0.0712 0.8948 0.4408 -0.1707 0.4463 -0.8784 12.435 17.496 71.931 A 241 ASP B 243 ASP.? A 279 GLU B 206 GLU~? A 369 ASP B 122 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.40 A TRANSFORM 0.9214 -0.3855 0.0492 0.3196 0.8237 0.4683 0.2211 0.4157 -0.8822 46.652 -122.083 -165.709 A 420 ALA A 272 ALA~? B 182 GLY A 246 GLY.? B 183 GLY A 242 GLY^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 1.41 A TRANSFORM -0.2638 0.9336 0.2423 0.4066 -0.1202 0.9057 -0.8747 -0.3375 0.3479 -6.311 85.513 49.359 179 ASP A 114 ASP.? 214 ASP A 163 ASP.? 289 ASP A 122 ASP~? ULMNm 3 1euu_c00 SIALIDASE user 1 3 RMSD = 1.41 A TRANSFORM -0.0816 0.8019 0.5919 -0.4632 0.4953 -0.7349 0.8825 0.3341 -0.3310 -14.347 -49.673 -8.042 92 ASP A 224 ASP.? 260 GLU A 252 GLU~? 370 TYR A 220 TYR^? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 10 3 RMSD = 1.41 A TRANSFORM -0.4558 -0.7608 -0.4621 -0.8010 0.5769 -0.1597 -0.3881 -0.2973 0.8723 78.087 77.719 63.604 229 ASP B 141 ASP.? 264 GLU A 273 GLU~? 328 ASP B 284 ASP~? ULMNm 3 1euu_c00 SIALIDASE user 3 3 RMSD = 1.42 A TRANSFORM 0.3053 0.9483 0.0866 0.4761 -0.2307 0.8486 -0.8247 0.2179 0.5219 -26.281 -15.067 9.526 92 ASP B 224 ASP.? 260 GLU B 252 GLU~? 370 TYR B 220 TYR^? ULMNm 3 1a0j_c13 TRYPSIN user 7 3 RMSD = 1.42 A TRANSFORM 0.7035 -0.2515 0.6647 0.5126 -0.4683 -0.7197 -0.4923 -0.8470 0.2005 46.774 51.618 88.042 B 57 HIS B 280 HIS~? B 102 ASP B 284 ASP~? B 193 GLY B 162 GLY.? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 3 3 RMSD = 1.42 A TRANSFORM 0.8874 0.2601 -0.3806 -0.2542 0.9649 0.0665 -0.3845 -0.0378 -0.9223 31.511 -40.708 26.187 A 44 HIS A 282 HIS~? A 45 HIS A 281 HIS~? A 261 PHE A 98 PHE^? ULMNm 3 2odj_o00 PORIN D user 11 3 RMSD = 1.43 A TRANSFORM 0.1907 0.2306 -0.9542 -0.2903 -0.9153 -0.2792 0.9377 -0.3303 0.1076 8.222 35.302 37.278 A 156 HIS B 244 HIS.? A 208 ASP B 114 ASP.? A 296 SER B 201 SER^? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 8 3 RMSD = 1.43 A TRANSFORM 0.1751 -0.8995 0.4002 -0.3763 0.3145 0.8715 0.9098 0.3032 0.2835 85.302 49.537 6.896 199 ASP A 243 ASP.? 242 GLU A 210 GLU~? 329 ASP A 122 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 14 3 RMSD = 1.43 A TRANSFORM -0.3414 -0.6682 -0.6611 0.8653 0.0512 -0.4986 -0.3670 0.7423 -0.5607 55.318 19.191 -5.384 199 ASP B 171 ASP~? 242 GLU B 143 GLU^? 329 ASP A 114 ASP.? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.44 A TRANSFORM -0.7027 -0.7114 -0.0150 -0.4300 0.4077 0.8055 0.5669 -0.5725 0.5924 59.311 34.847 42.586 B 46 ASP A 284 ASP~? B 100 ARG A 139 ARG.? B 116 GLN B 274 GLN~? ULMNm 3 12as_c00 ASPARAGINE SYNTHETASE user 3 3 RMSD = 1.44 A TRANSFORM 0.6605 0.7466 -0.0797 0.0233 -0.1264 -0.9917 0.7505 -0.6531 0.1009 3.018 18.811 36.294 A 46 ASP A 284 ASP~? A 100 ARG A 139 ARG.? A 116 GLN B 274 GLN~? ULMNm 3 1sll_c00 SIALIDASE L user 2 3 RMSD = 1.44 A TRANSFORM -0.2648 0.6658 0.6975 -0.7355 0.3283 -0.5927 0.6236 0.6700 -0.4028 -5.744 -13.768 -10.324 318 ASP A 224 ASP.? 595 GLU A 256 GLU~? 713 TYR A 220 TYR^? ULMNm 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 RMSD = 1.44 A TRANSFORM -0.2843 0.9515 0.1174 0.1117 -0.0888 0.9898 -0.9522 -0.2946 0.0811 7.507 8.394 77.632 A 36 GLU B 252 GLU~? A 47 ASP B 243 ASP.? A 161 TYR B 220 TYR^? ULMNm 3 1ig8_c00 HEXOKINASE PII user 2 3 RMSD = 1.44 A TRANSFORM 0.1548 -0.9495 0.2730 0.1920 -0.2421 -0.9511 -0.9691 -0.1996 -0.1448 48.924 72.904 -5.585 A 158 SER A 169 SER.? A 173 ARG A 166 ARG.? A 211 ASP A 171 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 8 3 RMSD = 1.44 A TRANSFORM -0.1301 -0.0311 0.9910 -0.9360 0.3336 -0.1124 0.3271 0.9422 0.0725 9.053 -1.664 -24.823 A 271 PRO B 234 PRO.? A 272 LEU B 233 LEU.? A 276 ARG B 96 ARG^? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.44 A TRANSFORM 0.2746 0.9369 0.2165 0.7130 -0.3495 0.6079 -0.6452 0.0126 0.7639 -4.101 27.095 28.541 A 317 GLU A 172 GLU~? A 319 ASP B 122 ASP~? A 359 ARG B 120 ARG~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.44 A TRANSFORM -0.9534 -0.1217 -0.2762 -0.1691 0.9734 0.1548 -0.2500 -0.1943 0.9486 42.477 -128.297 -127.824 A 420 ALA B 272 ALA~? B 182 GLY B 246 GLY.? B 183 GLY B 242 GLY^? ULMNm 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 RMSD = 1.45 A TRANSFORM -0.1783 0.1523 -0.9721 0.3147 -0.9272 -0.2030 0.9323 0.3421 -0.1174 61.535 65.632 48.399 B 36 GLU B 252 GLU~? B 47 ASP B 243 ASP.? B 161 TYR B 220 TYR^? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.45 A TRANSFORM -0.0686 -0.7356 0.6739 -0.7303 -0.4232 -0.5362 -0.6797 0.5290 0.5082 -6.074 40.556 40.698 B 51 ALA B 279 ALA~? B 148 HIS B 280 HIS~? B 163 ASP B 284 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 13 3 RMSD = 1.45 A TRANSFORM -0.1177 0.7954 -0.5945 -0.8175 -0.4175 -0.3968 0.5638 -0.4393 -0.6994 25.304 63.095 18.439 199 ASP B 141 ASP.? 242 GLU B 210 GLU~? 329 ASP B 284 ASP~? ULMNm 3 2odj_o01 PORIN D user 6 3 RMSD = 1.45 A TRANSFORM 0.7436 -0.5886 -0.3173 0.4809 0.1411 0.8653 0.4645 0.7960 -0.3880 -2.433 -7.013 33.680 B 156 HIS B 136 HIS.? B 208 ASP A 243 ASP.? B 296 SER A 229 SER~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 8 3 RMSD = 1.45 A TRANSFORM -0.8463 0.1498 0.5112 0.4438 0.7290 0.5212 0.2946 -0.6680 0.6834 49.457 -31.646 58.537 A 44 HIS B 282 HIS~? A 45 HIS B 281 HIS~? A 261 PHE B 98 PHE^? ULMNm 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 4 3 RMSD = 1.45 A TRANSFORM -0.5790 0.3113 -0.7536 0.3369 0.9330 0.1265 -0.7425 0.1807 0.6450 -13.933 -104.264 -45.051 C 137 TYR B 216 TYR.? C 142 LEU B 99 LEU^? C 165 LYS B 215 LYS.? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.45 A TRANSFORM 0.3647 0.3215 0.8738 0.1527 0.9051 -0.3968 0.9185 -0.2782 -0.2810 -47.712 -25.033 -44.707 H 51 ALA B 279 ALA~? H 148 HIS B 280 HIS~? H 163 ASP B 284 ASP~? ULMNm 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 RMSD = 1.45 A TRANSFORM 0.4884 0.7477 0.4500 -0.1042 0.5619 -0.8206 0.8664 -0.3539 -0.3523 13.995 -28.248 68.509 A 36 GLU A 252 GLU~? A 47 ASP A 243 ASP.? A 161 TYR A 220 TYR^? ULMNm 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 RMSD = 1.46 A TRANSFORM 0.1834 -0.5149 0.8374 -0.5147 -0.7761 -0.3644 -0.8375 0.3642 0.4073 98.124 62.622 59.360 B 36 GLU A 252 GLU~? B 47 ASP A 243 ASP.? B 161 TYR A 220 TYR^? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.46 A TRANSFORM -0.0622 -0.1693 -0.9836 0.5916 -0.8000 0.1003 0.8039 0.5756 -0.1499 -39.454 53.535 27.885 B 51 ALA A 279 ALA~? B 148 HIS A 280 HIS~? B 163 ASP A 284 ASP~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.46 A TRANSFORM -0.2419 0.8522 -0.4639 0.0318 0.4848 0.8741 -0.9698 -0.1967 0.1443 -74.637 0.601 -36.597 H 51 ALA A 279 ALA~? H 148 HIS A 280 HIS~? H 163 ASP A 284 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 15 3 RMSD = 1.46 A TRANSFORM -0.8588 0.5082 0.0650 0.2055 0.4580 -0.8648 0.4693 0.7294 0.4978 3.901 78.781 -9.867 193 ASP A 284 ASP~? 231 ASP B 122 ASP~? 294 ASP A 141 ASP.? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 6 3 RMSD = 1.47 A TRANSFORM 0.5351 -0.7168 -0.4471 0.5818 0.6964 -0.4202 -0.6126 0.0352 -0.7896 51.165 10.731 14.758 B 46 ASP B 284 ASP~? B 100 ARG B 139 ARG.? B 116 GLN A 274 GLN~? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.47 A TRANSFORM -0.1278 -0.5733 0.8093 0.9687 0.1030 0.2259 0.2128 -0.8129 -0.5422 37.266 -16.820 15.832 C 603 HIS A 244 HIS.? C 646 ASP A 122 ASP~? C 739 GLY B 137 GLY^? ULMNm 3 12as_c00 ASPARAGINE SYNTHETASE user 5 3 RMSD = 1.48 A TRANSFORM -0.4963 0.6783 0.5419 -0.1449 -0.6801 0.7186 -0.8560 -0.2781 -0.4358 14.969 52.792 25.187 A 46 ASP B 284 ASP~? A 100 ARG B 139 ARG.? A 116 GLN A 274 GLN~? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.48 A TRANSFORM -0.2717 0.5876 0.7622 -0.9623 -0.1545 -0.2240 0.0139 0.7943 -0.6074 -43.830 11.905 -39.876 B 603 HIS A 244 HIS.? B 646 ASP A 122 ASP~? B 739 GLY B 137 GLY^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 9 3 RMSD = 1.48 A TRANSFORM -0.6329 -0.2505 0.7326 -0.1164 0.9662 0.2299 0.7655 -0.0602 0.6407 12.366 -40.524 -11.788 14 ASP B 284 ASP~? 16 HIS B 280 HIS~? 67 GLY B 225 GLY.? ULMNm 3 1euu_c00 SIALIDASE user 2 3 RMSD = 1.48 A TRANSFORM 0.1409 -0.1600 0.9770 -0.8235 0.5288 0.2054 0.5495 0.8335 0.0573 34.733 -25.569 -17.092 92 ASP A 224 ASP.? 260 GLU A 256 GLU~? 370 TYR A 220 TYR^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 15 3 RMSD = 1.48 A TRANSFORM 0.4444 0.8149 0.3720 -0.3659 0.5442 -0.7550 0.8177 -0.1994 -0.5400 -3.804 52.013 30.898 179 ASP B 114 ASP.? 214 ASP B 163 ASP.? 289 ASP B 122 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 29 3 RMSD = 1.48 A TRANSFORM 0.9458 0.2437 0.2146 -0.1897 -0.1219 0.9743 -0.2636 0.9622 0.0690 7.164 115.628 -18.729 193 ASP B 284 ASP~? 231 ASP A 122 ASP~? 294 ASP B 141 ASP.? ULMNm 3 2phk_c03 MC-PEPTIDE user 2 3 RMSD = 1.48 A TRANSFORM -0.7604 -0.5655 0.3194 -0.4439 0.0934 -0.8912 -0.4741 0.8195 0.3220 51.361 17.018 25.450 A 149 ASP B 243 ASP.? A 151 LYS B 104 LYS.? A 154 ASN B 103 ASN.? ULMNm 3 1c54_c00 RIBONUCLEASE SA user 1 3 RMSD = 1.49 A TRANSFORM 0.2778 0.9439 0.1783 -0.7221 0.3276 -0.6093 0.6335 -0.0406 -0.7726 -25.312 -30.322 -20.038 A 54 GLU A 164 GLU.? A 65 ARG A 166 ARG.? A 85 HIS A 195 HIS^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.49 A TRANSFORM -0.7325 -0.3459 0.5863 -0.6691 0.2075 -0.7136 -0.1251 0.9150 0.3835 19.679 -8.629 -12.258 141 ASP A 171 ASP~? 166 GLY A 102 GLY^? 169 GLU A 245 GLU.? ULMNm 3 1ax4_c06 TRYPTOPHANASE user 5 3 RMSD = 1.49 A TRANSFORM -0.1224 0.9898 0.0722 -0.8272 -0.1420 0.5437 -0.5484 -0.0068 -0.8362 -28.608 93.155 21.472 C 130 PHE B 133 PHE^? C 223 ASP A 122 ASP~? C 265 LYS A 104 LYS.? ULMNm 3 1hwt_d00 GENE REGULATION/DNA user 2 3 RMSD = 1.49 A TRANSFORM 0.1933 -0.7081 -0.6791 0.8635 -0.2059 0.4605 0.4659 0.6754 -0.5717 56.784 24.894 21.812 C 70 ARG B 257 ARG~? C 71 LYS B 253 LYS~? C 72 VAL B 254 VAL~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 2 3 RMSD = 1.49 A TRANSFORM 0.6040 0.1287 -0.7865 0.3344 0.8549 0.3967 -0.7234 0.5026 -0.4733 -18.144 -36.928 -34.538 14 ASP A 284 ASP~? 16 HIS A 280 HIS~? 67 GLY A 225 GLY.? ULMNm 3 1ax4_c04 TRYPTOPHANASE user 5 3 RMSD = 1.50 A TRANSFORM 0.3185 -0.0373 0.9472 0.8844 0.3713 -0.2828 0.3411 -0.9278 -0.1512 47.018 29.654 82.696 A 130 PHE B 133 PHE^? A 223 ASP A 122 ASP~? A 265 LYS A 104 LYS.? ULMNm 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 RMSD = 1.50 A TRANSFORM 0.5957 -0.1946 -0.7792 -0.0108 0.9682 -0.2501 -0.8031 -0.1574 -0.5747 28.779 -16.271 32.462 B 18 HIS A 136 HIS.? B 91 ARG A 139 ARG.? B 129 SER A 135 SER.?