*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 3 3 RMSD = 0.96 A TRANSFORM 0.1789 -0.5682 -0.8032 0.9263 0.3725 -0.0573 0.3317 -0.7337 0.5930 16.821 -3.029 8.466 B 66 HIS A 173 HIS^? B 110 GLY A 175 GLY^? B 140 TYR A 38 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.02 A TRANSFORM -0.3624 -0.9146 0.1794 0.9030 -0.3922 -0.1753 0.2307 0.0985 0.9680 13.824 -9.900 -11.361 141 ASP A 201 ASP^? 166 GLY A 37 GLY^? 169 GLU A 154 GLU^? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 2 3 RMSD = 1.05 A TRANSFORM -0.3616 -0.7995 0.4796 -0.5439 -0.2370 -0.8050 0.7573 -0.5519 -0.3492 19.366 36.089 5.775 C 66 HIS A 173 HIS^? C 110 GLY A 175 GLY^? C 140 TYR A 38 TYR^? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.05 A TRANSFORM 0.5956 -0.7003 -0.3933 0.6119 0.7129 -0.3426 0.5204 -0.0366 0.8532 2.510 3.845 -11.021 B 66 HIS A 173 HIS^? B 110 GLY A 174 GLY^? B 140 TYR A 38 TYR^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.05 A TRANSFORM 0.4670 -0.4505 0.7609 0.8477 0.4731 -0.2401 -0.2518 0.7571 0.6028 15.521 -146.532 -144.932 A 420 ALA A 20 ALA~? B 182 GLY A 27 GLY.? B 183 GLY A 28 GLY.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.09 A TRANSFORM -0.3104 -0.6374 -0.7053 -0.1040 -0.7147 0.6917 -0.9449 0.2880 0.1556 54.728 40.664 38.269 I 303 TYR A 32 TYR^? I 306 VAL A 31 VAL^? I 308 VAL A 29 VAL.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.10 A TRANSFORM 0.1427 0.8909 0.4311 -0.9819 0.0725 0.1752 0.1248 -0.4483 0.8851 6.709 79.222 -49.154 D 465 GLY A 198 GLY^? D 501 ASP A 61 ASP.? E 367 TYR A 6 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.10 A TRANSFORM 0.8594 0.4800 0.1760 0.5027 -0.7308 -0.4618 -0.0931 0.4853 -0.8694 -19.862 25.387 -18.097 A 465 GLY A 198 GLY^? A 501 ASP A 61 ASP.? B 367 TYR A 6 TYR^? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.11 A TRANSFORM -0.0090 -0.4904 0.8715 -0.1716 -0.8578 -0.4845 0.9851 -0.1539 -0.0764 -0.113 31.806 -10.019 C 66 HIS A 173 HIS^? C 110 GLY A 174 GLY^? C 140 TYR A 38 TYR^? ULMNm 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 RMSD = 1.14 A TRANSFORM -0.0787 0.4507 -0.8892 0.6359 -0.6642 -0.3930 -0.7677 -0.5964 -0.2343 22.279 70.501 38.843 A 62 SER A 144 SER^? A 154 ASP A 35 ASP.? A 261 ARG A 122 ARG^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.15 A TRANSFORM -0.6593 0.3835 -0.6467 -0.6916 0.0281 0.7218 0.2949 0.9231 0.2467 21.816 30.632 -35.528 141 ASP A 162 ASP^? 166 GLY A 28 GLY.? 169 GLU A 22 GLU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.17 A TRANSFORM 0.3320 0.8945 -0.2996 0.4096 0.1494 0.9000 0.8497 -0.4214 -0.3167 20.464 19.473 -4.389 199 ASP A 156 ASP^? 242 GLU A 197 GLU^? 329 ASP A 162 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.18 A TRANSFORM -0.3821 -0.9125 0.1462 0.2998 -0.2721 -0.9144 0.8741 -0.3055 0.3776 14.162 8.607 -19.178 141 ASP A 201 ASP^? 166 GLY A 178 GLY^? 169 GLU A 154 GLU^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 RMSD = 1.19 A TRANSFORM -0.0669 -0.9828 -0.1723 -0.7457 0.1640 -0.6458 0.6630 0.0853 -0.7438 80.373 57.075 -11.210 199 ASP A 162 ASP^? 218 GLU A 134 GLU^? 329 ASP A 156 ASP^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.26 A TRANSFORM -0.4146 0.7967 -0.4398 -0.1525 0.4156 0.8967 0.8971 0.4389 -0.0508 79.019 54.079 111.067 F 141 GLY A 137 GLY^? F 144 GLU A 138 GLU^? F 164 GLU A 74 GLU^? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 RMSD = 1.27 A TRANSFORM -0.6535 -0.6522 0.3842 0.2961 -0.6874 -0.6632 0.6966 -0.3196 0.6423 49.891 94.917 2.169 A 225 HIS A 173 HIS^? A 259 TYR A 176 TYR^? A 552 ASP A 82 ASP^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.27 A TRANSFORM 0.3714 0.9157 0.1535 0.1413 0.1076 -0.9841 -0.9176 0.3872 -0.0895 27.682 119.037 176.698 C 141 GLY A 137 GLY^? C 144 GLU A 138 GLU^? C 164 GLU A 74 GLU^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.28 A TRANSFORM -0.5414 -0.8267 -0.1529 -0.1069 -0.1127 0.9879 -0.8339 0.5512 -0.0274 121.821 64.558 166.999 D 141 GLY A 137 GLY^? D 144 GLU A 138 GLU^? D 164 GLU A 74 GLU^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.28 A TRANSFORM 0.9426 -0.1145 -0.3137 0.3288 0.1539 0.9318 -0.0584 -0.9814 0.1827 54.720 43.809 177.750 E 141 GLY A 137 GLY^? E 144 GLU A 138 GLU^? E 164 GLU A 74 GLU^? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.28 A TRANSFORM 0.5497 -0.7305 0.4053 0.1417 -0.3966 -0.9070 0.8233 0.5560 -0.1145 60.932 131.551 112.144 B 141 GLY A 137 GLY^? B 144 GLU A 138 GLU^? B 164 GLU A 74 GLU^? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 RMSD = 1.29 A TRANSFORM -0.6808 -0.1212 -0.7223 0.0518 0.9758 -0.2127 0.7306 -0.1822 -0.6580 22.909 40.518 26.254 A 53 SER A 125 SER^? A 54 PRO A 124 PRO^? A 96 ASP A 35 ASP.? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.31 A TRANSFORM -0.4710 0.1017 0.8763 0.0662 -0.9865 0.1500 0.8797 0.1287 0.4578 -5.408 44.803 -46.779 A 81 ASP A 35 ASP.? A 99 GLY A 95 GLY^? A 125 ASN A 96 ASN^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 5 3 RMSD = 1.31 A TRANSFORM 0.9647 0.1608 -0.2088 0.0137 -0.8218 -0.5696 -0.2631 0.5466 -0.7950 3.142 44.957 23.487 I 303 TYR A 97 TYR^? I 306 VAL A 184 VAL^? I 308 VAL A 194 VAL^? ULMNm 3 1oyg_c00 LEVANSUCRASE user 2 3 RMSD = 1.34 A TRANSFORM -0.4976 0.5812 -0.6439 0.6390 0.7477 0.1810 0.5866 -0.3214 -0.7434 44.366 -7.694 -1.362 A 86 ASP A 162 ASP^? A 247 ASP A 156 ASP^? A 342 GLU A 158 GLU^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 RMSD = 1.34 A TRANSFORM 0.2726 -0.6295 0.7276 -0.5813 -0.7104 -0.3969 0.7667 -0.3147 -0.5596 -15.763 41.194 -24.749 A 49 ASP A 186 ASP^? A 147 THR A 188 THR^? A 294 ASP A 82 ASP^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.37 A TRANSFORM 0.0324 -0.9887 0.1464 -0.5963 -0.1366 -0.7910 0.8021 -0.0617 -0.5940 77.760 59.118 -12.218 199 ASP A 162 ASP^? 218 GLU A 138 GLU^? 329 ASP A 156 ASP^? ULMNm 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 RMSD = 1.38 A TRANSFORM 0.3939 0.8395 -0.3742 0.9192 -0.3573 0.1658 0.0055 -0.4093 -0.9124 4.605 106.307 36.586 A 461 GLU A 138 GLU^? A 503 TYR A 78 TYR^? A 537 GLU A 74 GLU^? ULMNm 3 1pyl_c00 RIBONUCLEASE user 1 3 RMSD = 1.38 A TRANSFORM 0.5977 -0.7768 0.1982 0.6062 0.2762 -0.7458 0.5246 0.5659 0.6360 19.363 -5.878 -8.439 A 56 GLU A 151 GLU^? A 67 ARG A 57 ARG~? A 86 HIS A 63 HIS.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.39 A TRANSFORM 0.7596 0.6043 -0.2404 0.2973 0.0061 0.9548 0.5784 -0.7967 -0.1750 9.809 50.616 6.244 B 194 SER A 125 SER^? B 292 ASP A 186 ASP^? B 322 HIS A 8 HIS.? ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 3 3 RMSD = 1.42 A TRANSFORM 0.9393 -0.2260 0.2581 -0.2928 -0.1361 0.9464 -0.1788 -0.9646 -0.1940 -9.987 15.305 25.650 A 66 HIS A 173 HIS^? A 110 GLY A 175 GLY^? A 140 TYR A 38 TYR^? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.42 A TRANSFORM 0.3209 -0.7198 0.6155 0.9371 0.1470 -0.3166 0.1374 0.6784 0.7217 -2.137 12.172 -13.393 A 99 ARG A 116 ARG^? A 101 ASP A 186 ASP^? A 132 ASP A 189 ASP^? ULMNm 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 RMSD = 1.43 A TRANSFORM 0.3910 -0.2483 -0.8862 0.7292 -0.5039 0.4630 -0.5616 -0.8273 -0.0160 30.271 12.728 13.027 A 396 ARG A 196 ARG^? A 581 ARG A 122 ARG^? A 713 ARG A 57 ARG~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.44 A TRANSFORM -0.3049 0.7399 -0.5997 -0.9144 -0.0514 0.4016 0.2663 0.6708 0.6922 24.401 10.150 -13.750 B 99 ARG A 116 ARG^? B 101 ASP A 186 ASP^? B 132 ASP A 189 ASP^? ULMNm 3 1emh_d00 HYDROLASE/DNA user 1 3 RMSD = 1.44 A TRANSFORM 0.8443 -0.0496 0.5336 -0.3423 0.7161 0.6083 -0.4123 -0.6962 0.5876 -29.367 -9.779 26.351 A 271 PRO A 139 PRO^? A 272 LEU A 67 LEU^? A 276 ARG A 122 ARG^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.46 A TRANSFORM -0.7689 0.5596 -0.3092 -0.4930 -0.8269 -0.2706 -0.4071 -0.0557 0.9117 18.034 43.124 -11.587 141 ASP A 61 ASP.? 166 GLY A 103 GLY^? 169 GLU A 106 GLU^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 4 3 RMSD = 1.46 A TRANSFORM 0.7413 0.1822 -0.6460 -0.1499 -0.8932 -0.4239 -0.6543 0.4111 -0.6348 15.704 47.406 31.058 I 303 TYR A 97 TYR^? I 306 VAL A 184 VAL^? I 308 VAL A 193 VAL^? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 RMSD = 1.49 A TRANSFORM -0.7926 -0.5107 0.3333 0.3381 -0.8228 -0.4567 0.5075 -0.2493 0.8248 52.756 96.112 8.797 A 225 HIS A 173 HIS^? A 259 TYR A 176 TYR^? A 552 ASP A 189 ASP^?