*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 1 3 RMSD = 0.72 A TRANSFORM 0.5258 0.1912 0.8289 0.8412 -0.2618 -0.4732 -0.1265 -0.9460 0.2985 15.209 49.115 -0.468 B 267 ASP A 152 ASP^? B 268 HIS A 19 HIS^? B 334 TYR A 109 TYR^? ULMNm 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 2 3 RMSD = 0.74 A TRANSFORM 0.2983 0.6126 -0.7319 -0.3241 0.7863 0.5260 -0.8978 -0.0803 -0.4331 56.632 24.360 20.297 B 267 ASP B 152 ASP^? B 268 HIS B 19 HIS^? B 334 TYR B 109 TYR^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 0.88 A TRANSFORM 0.9655 0.1922 0.1756 -0.0903 -0.3853 0.9184 -0.2442 0.9026 0.3546 -10.991 -78.273 -146.812 A 183 GLY B 203 GLY~? B 419 GLY B 166 GLY~? B 420 ALA B 169 ALA~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 RMSD = 0.89 A TRANSFORM -0.6508 0.5868 0.4818 -0.7254 -0.6679 -0.1663 -0.2242 0.4577 -0.8603 5.300 68.305 88.866 A 241 ASP A 89 ASP~? A 265 GLU B 172 GLU~? A 369 ASP A 95 ASP~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.92 A TRANSFORM 0.1924 0.9788 -0.0702 -0.2825 -0.0133 -0.9592 0.9398 -0.2044 -0.2740 -2.775 -26.567 -131.389 A 183 GLY A 203 GLY~? B 419 GLY A 166 GLY~? B 420 ALA A 169 ALA~? ULMNm 3 1do8_c02 MALIC ENZYME user 1 3 RMSD = 0.98 A TRANSFORM 0.9415 -0.3358 -0.0279 -0.0146 -0.1234 0.9922 0.3366 0.9338 0.1211 75.439 -33.991 -39.731 C 112 TYR A 67 TYR^? C 183 LYS A 134 LYS^? C 278 ASP A 136 ASP.? ULMNm 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 1 3 RMSD = 0.98 A TRANSFORM -0.3586 0.8072 -0.4689 0.4937 -0.2623 -0.8291 0.7923 0.5288 0.3044 7.198 22.765 1.797 18 ARG A 110 ARG.? 195 HIS A 19 HIS^? 199 ASP A 152 ASP^? ULMNm 3 1do8_c01 MALIC ENZYME user 1 3 RMSD = 1.02 A TRANSFORM 0.9434 0.3247 0.0670 0.0202 0.1455 -0.9892 0.3309 -0.9346 -0.1307 27.468 32.252 96.036 B 112 TYR A 67 TYR^? B 183 LYS A 134 LYS^? B 278 ASP A 136 ASP.? ULMNm 3 1do8_c00 MALIC ENZYME user 1 3 RMSD = 1.02 A TRANSFORM -0.9465 0.0864 0.3111 -0.0218 -0.9784 0.2056 -0.3221 -0.1878 -0.9279 24.233 56.214 77.269 A 112 TYR A 67 TYR^? A 183 LYS A 134 LYS^? A 278 ASP A 136 ASP.? ULMNm 3 1do8_c03 MALIC ENZYME user 1 3 RMSD = 1.05 A TRANSFORM -0.9374 -0.0571 -0.3436 0.0197 0.9762 -0.2159 -0.3478 0.2092 0.9139 61.536 -56.618 -27.595 D 112 TYR A 67 TYR^? D 183 LYS A 134 LYS^? D 278 ASP A 136 ASP.? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.05 A TRANSFORM 0.3130 -0.2828 0.9067 0.4601 -0.7900 -0.4052 -0.8308 -0.5440 0.1172 -49.688 76.015 149.546 A 1 ALA B 49 ALA^? A 74 ASN B 48 ASN^? A 75 GLY B 47 GLY^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 RMSD = 1.08 A TRANSFORM 0.6269 -0.6145 -0.4790 -0.6789 -0.7324 0.0510 0.3821 -0.2932 0.8764 30.075 61.250 40.171 A 241 ASP B 89 ASP~? A 265 GLU A 172 GLU~? A 369 ASP B 95 ASP~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.09 A TRANSFORM -0.6482 0.7612 -0.0186 0.1333 0.1376 0.9815 -0.7497 -0.6337 0.1907 28.430 -35.486 58.544 C 1 ALA B 49 ALA^? C 74 ASN B 48 ASN^? C 75 GLY B 47 GLY^? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.09 A TRANSFORM 0.1220 -0.9102 0.3957 -0.8354 -0.3094 -0.4543 -0.5360 0.2752 0.7982 27.747 65.300 4.530 B 1 ALA B 49 ALA^? B 74 ASN B 48 ASN^? B 75 GLY B 47 GLY^? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.09 A TRANSFORM -0.1588 0.4266 -0.8904 -0.8554 0.3910 0.3398 -0.4931 -0.8156 -0.3028 -1.336 58.551 159.941 A 1 ALA A 49 ALA^? A 74 ASN A 48 ASN^? A 75 GLY A 47 GLY^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.09 A TRANSFORM 0.3379 0.4471 -0.8282 0.8615 -0.5014 0.0808 0.3791 0.7408 0.5546 24.548 -86.981 -163.906 A 183 GLY B 204 GLY~? B 419 GLY B 203 GLY~? B 420 ALA B 199 ALA~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.10 A TRANSFORM 0.5676 0.4816 0.6677 -0.8175 0.2338 0.5263 -0.0973 0.8446 -0.5264 -1.934 -34.924 -14.264 A 250 ALA A 150 ALA^? A 251 GLY A 151 GLY^? A 252 ASP A 152 ASP^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.10 A TRANSFORM 0.9210 -0.1484 -0.3601 -0.3849 -0.2058 -0.8997 -0.0594 -0.9673 0.2466 28.756 4.139 -28.101 B 250 ALA A 150 ALA^? B 251 GLY A 151 GLY^? B 252 ASP A 152 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 RMSD = 1.11 A TRANSFORM -0.6032 -0.2086 0.7698 -0.0114 0.9674 0.2532 0.7975 -0.1440 0.5859 -2.685 -21.008 -4.092 141 ASP A 152 ASP^? 166 GLY A 47 GLY^? 169 GLU A 103 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 17 3 RMSD = 1.11 A TRANSFORM -0.0293 -0.7170 -0.6965 0.8121 -0.4233 0.4016 0.5828 0.5538 -0.5947 31.753 -29.889 12.017 141 ASP B 152 ASP^? 166 GLY B 47 GLY^? 169 GLU B 102 GLU~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.12 A TRANSFORM -0.8412 0.1557 -0.5178 0.2289 0.9701 -0.0803 -0.4899 0.1861 0.8517 34.768 27.320 90.670 D 1 ALA B 49 ALA^? D 74 ASN B 48 ASN^? D 75 GLY B 47 GLY^? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.12 A TRANSFORM 0.7718 -0.6341 0.0472 0.2737 0.2643 -0.9248 -0.5740 -0.7267 -0.3775 24.248 14.723 73.143 C 1 ALA A 49 ALA^? C 74 ASN A 48 ASN^? C 75 GLY A 47 GLY^? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.13 A TRANSFORM -0.8470 0.1604 -0.5069 -0.3438 -0.8925 0.2920 0.4056 -0.4216 -0.8111 53.228 44.606 45.454 B 1 ALA A 49 ALA^? B 74 ASN A 48 ASN^? B 75 GLY A 47 GLY^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.14 A TRANSFORM 0.3439 0.2971 0.8908 -0.4976 0.8622 -0.0955 0.7963 0.4104 -0.4443 -23.238 -79.648 -136.404 A 183 GLY A 204 GLY~? B 419 GLY A 203 GLY~? B 420 ALA A 199 ALA~? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 6 3 RMSD = 1.14 A TRANSFORM 0.6264 -0.4219 -0.6555 -0.1353 -0.8869 0.4417 0.7677 0.1880 0.6126 106.525 69.864 -36.837 B 137 GLY B 166 GLY~? B 175 ARG B 32 ARG.? B 242 TYR B 34 TYR^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.16 A TRANSFORM -0.2267 0.8741 0.4297 -0.2728 -0.4805 0.8335 -0.9350 -0.0718 -0.3474 10.067 -42.964 -11.038 B 250 ALA B 150 ALA^? B 251 GLY B 151 GLY^? B 252 ASP B 152 ASP^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.16 A TRANSFORM 0.5159 0.6495 -0.5586 0.3229 -0.7514 -0.5755 0.7935 -0.1165 0.5973 31.673 -7.743 -45.738 A 250 ALA B 150 ALA^? A 251 GLY B 151 GLY^? A 252 ASP B 152 ASP^? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.16 A TRANSFORM 0.1075 -0.9002 0.4221 0.9402 0.2301 0.2513 0.3233 -0.3698 -0.8711 8.198 17.417 134.808 D 1 ALA A 49 ALA^? D 74 ASN A 48 ASN^? D 75 GLY A 47 GLY^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 11 3 RMSD = 1.16 A TRANSFORM -0.2921 -0.9544 -0.0617 0.1149 -0.0991 0.9884 0.9495 -0.2816 -0.1387 64.155 -20.629 -13.801 A 229 ALA B 50 ALA^? A 257 ALA B 49 ALA^? A 328 ASP B 100 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 1.16 A TRANSFORM -0.2645 0.9641 0.0225 -0.7890 -0.2029 -0.5800 0.5546 0.1712 -0.8143 117.775 37.323 10.439 A 316 ALA A 150 ALA^? A 317 GLY A 151 GLY^? A 318 ASP A 152 ASP^? ULMNm 3 2dbt_c01 CHITINASE C user 5 3 RMSD = 1.18 A TRANSFORM 0.4812 -0.1948 -0.8547 0.0322 0.9783 -0.2049 -0.8760 -0.0711 -0.4770 54.047 47.249 51.640 B 147 GLU B 207 GLU~? B 156 GLU B 209 GLU~? B 194 ASN B 196 ASN~? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 RMSD = 1.19 A TRANSFORM -0.4914 0.5600 0.6671 -0.8279 -0.0624 -0.5575 0.2706 0.8262 -0.4942 72.108 97.103 -6.519 B 137 GLY A 166 GLY~? B 175 ARG A 32 ARG.? B 242 TYR A 34 TYR^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.22 A TRANSFORM 0.9737 -0.2223 0.0505 -0.2189 -0.8500 0.4792 0.0636 0.4776 0.8763 115.075 7.254 -33.674 A 316 ALA B 150 ALA^? A 317 GLY B 151 GLY^? A 318 ASP B 152 ASP^? ULMNm 3 2dbt_c02 CHITINASE C user 3 3 RMSD = 1.23 A TRANSFORM 0.9463 -0.2219 -0.2351 -0.1286 -0.9256 0.3559 0.2966 0.3065 0.9045 25.048 43.770 -19.188 C 147 GLU B 207 GLU~? C 156 GLU B 209 GLU~? C 194 ASN B 196 ASN~? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 RMSD = 1.23 A TRANSFORM -0.3402 -0.7696 -0.5404 0.2091 -0.6222 0.7544 0.9168 -0.1437 -0.3726 34.229 -28.154 0.124 A 101 VAL B 84 VAL^? A 102 PHE B 82 PHE^? A 169 CYH B 56 CYH^? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 1 3 RMSD = 1.24 A TRANSFORM -0.8273 -0.4057 0.3886 -0.5216 0.2978 -0.7995 -0.2086 0.8642 0.4579 10.108 14.270 -20.310 A 101 VAL A 84 VAL^? A 102 PHE A 82 PHE^? A 169 CYH A 56 CYH^? ULMNm 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 RMSD = 1.24 A TRANSFORM -0.5085 -0.2335 0.8288 0.8557 -0.0299 0.5166 0.0958 -0.9719 -0.2150 7.532 -8.417 85.929 A 140 TYR A 67 TYR^? B 190 LYS A 134 LYS^? B 222 ASP A 136 ASP.? ULMNm 3 1emh_d00 HYDROLASE/DNA user 2 3 RMSD = 1.25 A TRANSFORM 0.4754 0.7806 0.4058 -0.6316 -0.0184 0.7751 -0.6125 0.6248 -0.4843 -48.561 -5.362 40.293 A 271 PRO A 185 PRO~? A 272 LEU A 188 LEU~? A 276 ARG A 179 ARG~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 RMSD = 1.25 A TRANSFORM -0.0419 0.4878 -0.8720 0.3848 0.8133 0.4364 -0.9220 0.3173 0.2218 38.196 74.357 16.659 193 ASP A 119 ASP.? 231 ASP B 22 ASP~? 294 ASP A 89 ASP~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 3 3 RMSD = 1.25 A TRANSFORM 0.9093 0.2929 0.2955 -0.0102 -0.6943 0.7196 -0.4159 0.6574 0.6284 -45.129 -5.509 -13.333 A 271 PRO A 185 PRO~? A 272 LEU A 188 LEU~? A 276 ARG A 191 ARG~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 11 3 RMSD = 1.26 A TRANSFORM -0.2168 0.9748 -0.0524 -0.9286 -0.2225 -0.2970 0.3012 0.0157 -0.9534 57.540 87.031 134.350 B 382 ARG B 191 ARG~? B 451 GLU A 190 GLU~? B 540 GLU A 194 GLU~? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 1.27 A TRANSFORM -0.8277 0.1709 0.5345 0.2753 0.9536 0.1215 0.4890 -0.2477 0.8364 -4.052 -0.975 12.533 A 156 HIS A 19 HIS^? A 208 ASP A 60 ASP.? A 296 SER B 158 SER.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.27 A TRANSFORM -0.9561 -0.2811 -0.0827 0.0251 0.2024 -0.9790 -0.2919 0.9381 0.1865 65.507 32.767 -21.653 A 229 ALA A 50 ALA^? A 257 ALA A 49 ALA^? A 328 ASP A 100 ASP.? ULMNm 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 RMSD = 1.27 A TRANSFORM 0.5097 0.2323 -0.8284 0.8550 -0.0297 0.5178 -0.0956 0.9722 0.2137 1.213 -8.361 -20.454 A 190 LYS A 134 LYS^? A 222 ASP A 136 ASP.? B 140 TYR A 67 TYR^? ULMNm 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 12 3 RMSD = 1.27 A TRANSFORM -0.7659 0.6268 0.1436 0.6147 0.7792 -0.1225 0.1887 0.0055 0.9820 14.415 -15.629 -50.839 A 396 ARG A 197 ARG~? A 581 ARG A 137 ARG.? A 713 ARG B 179 ARG~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.28 A TRANSFORM 0.2494 -0.7484 -0.6146 0.9550 0.2952 0.0280 -0.1605 0.5939 -0.7884 24.906 0.426 56.861 A 156 HIS B 19 HIS^? A 208 ASP B 60 ASP.? A 296 SER A 158 SER.? ULMNm 3 1hwt_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.28 A TRANSFORM -0.4914 0.5025 -0.7114 0.0702 0.8370 0.5427 -0.8681 -0.2167 0.4466 31.976 -29.563 40.115 C 70 ARG A 135 ARG.? C 71 LYS A 134 LYS^? C 72 VAL A 133 VAL^? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 RMSD = 1.28 A TRANSFORM 0.1163 0.2048 -0.9719 -0.1977 -0.9542 -0.2247 0.9733 -0.2183 0.0704 90.534 87.167 125.122 A 50 ASP A 111 ASP.? A 327 GLU B 190 GLU~? A 339 ARG B 189 ARG~? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 4 3 RMSD = 1.30 A TRANSFORM 0.0854 -0.3769 0.9223 -0.9509 0.2455 0.1884 0.2974 0.8931 0.3375 6.614 94.614 -2.609 A 225 HIS A 114 HIS^? A 259 TYR A 17 TYR.? A 552 ASP B 95 ASP~? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 9 3 RMSD = 1.31 A TRANSFORM -0.2726 0.2039 -0.9403 0.2624 -0.9245 -0.2766 0.9256 0.3222 -0.1985 56.899 105.609 10.928 A 225 HIS B 114 HIS^? A 259 TYR B 17 TYR^? A 552 ASP A 95 ASP~? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 RMSD = 1.33 A TRANSFORM -0.9150 0.3599 0.1823 -0.2375 -0.1153 -0.9645 0.3261 0.9258 -0.1910 8.994 33.226 26.373 F 124 ALA B 193 ALA~? F 126 ARG B 189 ARG~? F 138 GLU B 194 GLU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.33 A TRANSFORM -0.1354 0.2535 -0.9578 -0.2210 0.9346 0.2786 -0.9658 -0.2494 0.0705 61.231 6.306 17.353 199 ASP A 152 ASP^? 242 GLU A 29 GLU.? 329 ASP A 111 ASP.? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 5 3 RMSD = 1.33 A TRANSFORM 0.2656 -0.4270 0.8644 0.7003 -0.5307 -0.4774 -0.6626 -0.7321 -0.1581 4.749 45.995 61.380 A 194 SER B 158 SER.? A 292 ASP A 22 ASP~? A 322 HIS B 19 HIS^? ULMNm 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 2 3 RMSD = 1.33 A TRANSFORM 0.8912 -0.2817 0.3555 -0.3406 0.1022 0.9347 0.2996 0.9540 0.0048 -17.460 -25.689 14.853 18 ARG B 110 ARG.? 195 HIS B 19 HIS^? 199 ASP B 152 ASP^? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 RMSD = 1.34 A TRANSFORM 0.2111 -0.3103 -0.9269 -0.9396 0.1970 -0.2800 -0.2695 -0.9300 0.2500 17.954 29.116 52.999 C 124 ALA B 193 ALA~? C 126 ARG B 189 ARG~? C 138 GLU B 194 GLU~? ULMNm 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 RMSD = 1.34 A TRANSFORM 0.6195 -0.7824 0.0636 0.5457 0.3710 -0.7514 -0.5643 -0.5002 -0.6568 40.064 26.891 165.845 A 45 ARG A 135 ARG.? A 136 GLU A 142 GLU^? A 246 GLU A 140 GLU.? ULMNm 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.35 A TRANSFORM -0.0671 0.9205 -0.3849 -0.5866 -0.3484 -0.7311 0.8071 -0.1768 -0.5634 -14.552 62.324 24.095 B 124 ALA A 193 ALA~? B 126 ARG A 200 ARG~? B 138 GLU A 190 GLU~? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 RMSD = 1.35 A TRANSFORM 0.6763 -0.0396 0.7356 -0.6506 0.4361 0.6217 0.3455 0.8990 -0.2691 -39.598 -3.892 28.271 D 124 ALA B 193 ALA~? D 126 ARG B 189 ARG~? D 138 GLU B 194 GLU~? ULMNm 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 RMSD = 1.35 A TRANSFORM 0.6204 -0.7779 0.0994 0.5502 0.3415 -0.7620 -0.5589 -0.5275 -0.6399 38.820 28.155 166.150 A 45 ARG A 135 ARG.? A 136 GLU A 142 GLU^? A 246 GLU A 140 GLU.? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.36 A TRANSFORM -0.5048 -0.7709 -0.3885 0.4299 -0.6147 0.6613 0.7486 -0.1668 -0.6417 53.504 -23.431 29.044 C 124 ALA A 193 ALA~? C 126 ARG A 200 ARG~? C 138 GLU A 190 GLU~? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.37 A TRANSFORM 0.5876 -0.1975 0.7847 -0.3049 -0.9523 -0.0114 -0.7495 0.2326 0.6198 -51.678 42.612 52.239 F 124 ALA A 193 ALA~? F 126 ARG A 200 ARG~? F 138 GLU A 190 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.37 A TRANSFORM 0.9787 0.1215 0.1657 -0.1820 0.8869 0.4246 0.0953 0.4457 -0.8901 -59.913 -24.261 160.539 B 70 ALA A 162 ALA.? B 126 LEU A 163 LEU.? B 158 GLU A 35 GLU^? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.37 A TRANSFORM -0.3253 -0.7939 -0.5137 0.9398 -0.3315 -0.0828 0.1046 0.5097 -0.8540 43.713 -14.235 156.807 C 70 ALA A 162 ALA.? C 126 LEU A 163 LEU.? C 158 GLU A 35 GLU^? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.37 A TRANSFORM -0.6406 0.7268 0.2477 -0.7452 -0.5107 -0.4287 0.1851 0.4593 -0.8688 -16.720 70.542 155.882 A 70 ALA A 162 ALA.? A 126 LEU A 163 LEU.? A 158 GLU A 35 GLU^? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 RMSD = 1.37 A TRANSFORM 0.2442 -0.3120 -0.9182 0.9364 -0.1703 0.3069 0.2521 0.9347 -0.2505 16.437 -27.844 29.772 E 124 ALA B 193 ALA~? E 126 ARG B 189 ARG~? E 138 GLU B 194 GLU~? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.37 A TRANSFORM -0.5140 -0.7651 -0.3879 -0.4307 0.6213 -0.6546 -0.7418 0.1694 0.6489 53.495 25.560 52.589 E 124 ALA A 193 ALA~? E 126 ARG A 200 ARG~? E 138 GLU A 190 GLU~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.38 A TRANSFORM -0.7993 0.5995 -0.0409 -0.5924 -0.7976 -0.1139 0.1009 0.0668 -0.9927 14.796 67.920 93.004 A 241 ASP A 89 ASP~? A 279 GLU A 27 GLU.? A 369 ASP A 95 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 18 3 RMSD = 1.38 A TRANSFORM 0.3628 -0.1539 0.9191 0.8563 0.4441 -0.2636 0.3676 -0.8827 -0.2929 -9.872 92.041 28.256 193 ASP B 119 ASP.? 231 ASP A 22 ASP~? 294 ASP B 89 ASP~? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.38 A TRANSFORM -0.0715 0.9179 -0.3904 0.5977 0.3528 0.7199 -0.7985 0.1818 0.5739 -14.112 -59.915 57.320 D 124 ALA A 193 ALA~? D 126 ARG A 200 ARG~? D 138 GLU A 190 GLU~? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 1.39 A TRANSFORM -0.4853 -0.6147 -0.6218 -0.8442 0.5147 0.1500 -0.2278 -0.5977 0.7687 18.322 12.539 8.656 A 603 HIS B 114 HIS^? A 646 ASP B 119 ASP.? A 739 GLY B 151 GLY^? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 7 3 RMSD = 1.40 A TRANSFORM 0.6523 -0.7576 -0.0220 -0.7577 -0.6510 -0.0458 -0.0204 -0.0465 0.9987 10.964 66.187 39.637 A 241 ASP B 89 ASP~? A 279 GLU B 27 GLU~? A 369 ASP B 95 ASP~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 19 3 RMSD = 1.41 A TRANSFORM 0.4612 -0.2802 0.8419 0.8501 0.4115 -0.3287 0.2543 -0.8673 -0.4280 -7.068 95.080 35.598 193 ASP B 119 ASP.? 231 ASP A 59 ASP.? 294 ASP B 89 ASP~? ULMNm 3 3hde_o02 LYSOZYME user 8 3 RMSD = 1.41 A TRANSFORM -0.4818 0.8758 -0.0299 0.4211 0.2015 -0.8843 0.7685 0.4386 0.4659 12.320 2.301 -38.281 C 35 GLU B 207 GLU~? C 44 ASP A 95 ASP~? C 50 THR A 94 THR~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.42 A TRANSFORM -0.8454 -0.3826 0.3727 -0.3501 0.9239 0.1542 0.4033 0.0001 0.9151 20.776 -18.854 109.089 C 70 ALA B 162 ALA.? C 126 LEU B 163 LEU.? C 158 GLU B 35 GLU^? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.42 A TRANSFORM 0.1286 0.9912 -0.0314 0.9333 -0.1317 -0.3342 0.3354 -0.0136 0.9420 -53.547 -5.525 111.227 B 70 ALA B 162 ALA.? B 126 LEU B 163 LEU.? B 158 GLU B 35 GLU^? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.42 A TRANSFORM -0.3158 0.3876 -0.8660 -0.6113 0.6150 0.4981 -0.7257 -0.6867 -0.0428 51.373 22.372 58.339 A 194 SER A 158 SER.? A 292 ASP B 22 ASP~? A 322 HIS A 19 HIS^? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.42 A TRANSFORM 0.7587 -0.6079 -0.2344 -0.5491 -0.7902 0.2721 0.3506 0.0777 0.9333 -5.729 51.607 107.464 A 70 ALA B 162 ALA.? A 126 LEU B 163 LEU.? A 158 GLU B 35 GLU^? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.42 A TRANSFORM 0.5726 0.4137 -0.7077 -0.8050 0.4470 -0.3901 -0.1550 -0.7931 -0.5890 41.022 47.933 45.022 199 ASP A 89 ASP~? 242 GLU A 29 GLU.? 329 ASP A 95 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.42 A TRANSFORM -0.6835 -0.5655 0.4615 0.5525 -0.8140 -0.1792 -0.4770 -0.1325 -0.8689 -10.223 19.129 52.429 A 603 HIS A 114 HIS^? A 646 ASP A 119 ASP.? A 739 GLY A 151 GLY^? ULMNm 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 RMSD = 1.43 A TRANSFORM 0.7234 -0.1230 0.6794 -0.6149 -0.5623 0.5529 -0.3140 0.8177 0.4824 -38.160 32.160 -3.013 B 124 ALA B 193 ALA~? B 126 ARG B 200 ARG~? B 138 GLU B 190 GLU~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 RMSD = 1.43 A TRANSFORM -0.1808 0.5700 -0.8015 0.3442 0.8001 0.4913 -0.9213 0.1871 0.3408 37.549 74.188 17.040 193 ASP A 119 ASP.? 231 ASP B 59 ASP.? 294 ASP A 89 ASP~? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 8 3 RMSD = 1.43 A TRANSFORM 0.6703 0.6944 -0.2619 -0.6122 0.7168 0.3339 -0.4195 0.0635 -0.9055 8.357 37.405 168.852 A 109 ASP B 100 ASP.? A 182 GLU B 103 GLU~? A 286 ASN B 48 ASN^? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.44 A TRANSFORM -0.8788 -0.4677 0.0947 0.3364 -0.4665 0.8180 0.3384 -0.7507 -0.5673 41.577 -7.968 83.674 E 124 ALA B 193 ALA~? E 126 ARG B 200 ARG~? E 138 GLU B 190 GLU~? ULMNm 3 2dbt_c00 CHITINASE C user 4 3 RMSD = 1.44 A TRANSFORM -0.7632 0.2516 0.5952 0.2325 0.9663 -0.1103 0.6029 -0.0542 0.7960 77.560 -7.176 -22.757 A 147 GLU B 207 GLU~? A 156 GLU B 209 GLU~? A 194 ASN B 196 ASN~? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.44 A TRANSFORM 0.5075 -0.5352 0.6753 -0.2685 -0.8429 -0.4662 -0.8188 -0.0552 0.5715 45.388 45.254 17.363 B 158 ASP A 152 ASP^? B 161 ARG A 110 ARG.? B 186 HIS A 19 HIS^? ULMNm 3 3hde_o00 LYSOZYME user 4 3 RMSD = 1.44 A TRANSFORM 0.6968 -0.1672 -0.6976 -0.6795 -0.4655 -0.5671 0.2299 -0.8691 0.4379 -6.431 15.125 -15.341 A 35 GLU B 209 GLU~? A 44 ASP A 95 ASP~? A 50 THR A 94 THR~? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 7 3 RMSD = 1.44 A TRANSFORM 0.9861 0.1285 -0.1057 -0.1219 0.9903 0.0673 -0.1133 0.0534 -0.9921 -3.571 30.227 162.995 A 109 ASP B 100 ASP.? A 182 GLU B 102 GLU~? A 286 ASN B 48 ASN^? ULMNm 3 3hde_o00 LYSOZYME user 2 3 RMSD = 1.44 A TRANSFORM -0.2359 0.5903 0.7719 -0.5011 -0.7545 0.4238 -0.8326 0.2868 -0.4738 -45.063 -11.996 10.229 A 35 GLU A 209 GLU~? A 44 ASP B 95 ASP~? A 50 THR B 94 THR~? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.45 A TRANSFORM -0.8892 -0.4510 0.0773 -0.3092 0.4676 -0.8281 -0.3374 0.7602 0.5552 41.967 9.675 -1.495 C 124 ALA B 193 ALA~? C 126 ARG B 200 ARG~? C 138 GLU B 190 GLU~? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.45 A TRANSFORM 0.1390 0.5956 -0.7911 -0.9095 -0.2392 -0.3399 0.3917 -0.7668 -0.5085 -16.183 49.013 81.294 F 124 ALA B 193 ALA~? F 126 ARG B 200 ARG~? F 138 GLU B 190 GLU~? ULMNm 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.45 A TRANSFORM -0.5331 0.1401 -0.8344 0.0890 -0.9714 -0.2200 0.8414 0.1916 -0.5054 30.065 54.735 64.544 A 158 ASP A 152 ASP^? A 161 ARG A 110 ARG.? A 186 HIS A 19 HIS^? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 15 3 RMSD = 1.45 A TRANSFORM -0.4577 0.7198 -0.5219 0.3356 0.6834 0.6483 -0.8234 -0.1216 0.5544 -0.152 -44.712 38.389 C 124 ALA B 210 ALA~? C 126 ARG B 212 ARG~? C 138 GLU B 207 GLU~? ULMNm 3 1bqc_c01 BETA-MANNANASE user 1 3 RMSD = 1.45 A TRANSFORM 0.8739 -0.2694 -0.4047 -0.1133 0.6967 -0.7083 -0.4728 -0.6648 -0.5783 50.136 9.558 77.460 A 50 ARG A 135 ARG.? A 128 GLU A 142 GLU^? A 225 GLU A 140 GLU.? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 RMSD = 1.46 A TRANSFORM -0.7179 0.5188 -0.4641 -0.6691 -0.6981 0.2547 0.1919 -0.4934 -0.8484 80.678 20.947 53.218 B 158 ASP B 152 ASP^? B 161 ARG B 110 ARG.? B 186 HIS B 19 HIS^? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.46 A TRANSFORM -0.0289 0.6915 0.7218 0.6745 -0.5194 0.5246 -0.7377 -0.5021 0.4514 -6.521 13.998 43.757 A 317 GLU A 102 GLU~? A 319 ASP A 104 ASP~? A 359 ARG A 116 ARG.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 5 3 RMSD = 1.46 A TRANSFORM -0.1215 -0.9892 -0.0823 -0.7917 0.0466 0.6091 0.5987 -0.1391 0.7888 49.362 58.337 -13.235 B 194 SER B 158 SER.? B 292 ASP A 22 ASP~? B 322 HIS B 19 HIS^? ULMNm 3 1kim_c00 THYMIDINE KINASE user 11 3 RMSD = 1.46 A TRANSFORM -0.6107 -0.3877 0.6904 -0.6603 -0.2319 -0.7143 -0.4371 0.8921 0.1144 61.153 126.614 31.961 A 83 GLU B 172 GLU~? A 163 ARG B 191 ARG~? A 222 ARG A 165 ARG~? ULMNm 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 RMSD = 1.46 A TRANSFORM 0.9949 0.0927 0.0404 0.1011 -0.9078 -0.4070 0.0010 -0.4090 0.9125 19.612 46.069 -4.022 166 ASP A 152 ASP^? 169 ARG A 110 ARG.? 193 HIS A 19 HIS^? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 RMSD = 1.47 A TRANSFORM -0.7563 0.6542 0.0036 0.6229 0.7185 0.3096 -0.2000 -0.2364 0.9509 62.460 -17.320 101.579 B 382 ARG A 135 ARG.? B 451 GLU A 142 GLU^? B 540 GLU A 140 GLU.? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 8 3 RMSD = 1.47 A TRANSFORM 0.8585 -0.4101 -0.3078 0.2710 0.8725 -0.4066 -0.4353 -0.2657 -0.8602 -18.629 17.446 96.457 54 ASP B 42 ASP.? 158 THR B 40 THR^? 317 ASP B 100 ASP.? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.47 A TRANSFORM 0.7120 -0.1309 0.6899 0.6232 0.5703 -0.5351 0.3234 -0.8109 -0.4876 -37.721 -30.685 84.816 D 124 ALA B 193 ALA~? D 126 ARG B 200 ARG~? D 138 GLU B 190 GLU~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 RMSD = 1.48 A TRANSFORM -0.7201 0.5382 0.4379 0.4806 0.8421 -0.2446 0.5004 -0.0344 0.8651 83.071 25.318 97.294 A 50 ASP A 95 ASP~? A 327 GLU B 74 GLU~? A 339 ARG B 71 ARG~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 RMSD = 1.48 A TRANSFORM 0.0432 0.7716 -0.6346 -0.9984 0.0570 0.0013 -0.0371 -0.6335 -0.7728 -3.342 11.273 4.628 A 49 ASP A 152 ASP^? A 147 THR A 123 THR^? A 294 ASP A 111 ASP.? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 6 3 RMSD = 1.48 A TRANSFORM -0.0781 0.9837 0.1621 0.9136 0.1357 -0.3832 0.3990 -0.1182 0.9093 -5.517 57.562 73.629 B 109 ASP B 100 ASP.? B 182 GLU B 103 GLU~? B 286 ASN B 48 ASN^? ULMNm 3 3hde_o01 LYSOZYME user 7 3 RMSD = 1.48 A TRANSFORM -0.1166 0.0310 -0.9927 0.9924 -0.0356 -0.1177 0.0390 0.9989 0.0266 12.368 -34.269 -51.178 B 35 GLU B 207 GLU~? B 44 ASP A 95 ASP~? B 50 THR A 94 THR~? ULMNm 3 1bvz_c08 ALPHA-AMYLASE II user 3 3 RMSD = 1.48 A TRANSFORM 0.2997 -0.6495 -0.6988 -0.0239 0.7271 -0.6861 -0.9537 -0.2223 -0.2024 69.548 79.746 98.060 A 325 ASP B 104 ASP~? A 354 GLU B 102 GLU~? A 421 ASP B 95 ASP~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 RMSD = 1.49 A TRANSFORM 0.2520 -0.6202 -0.7428 -0.9230 0.0765 -0.3770 -0.2907 -0.7807 0.5532 25.182 29.824 66.016 B 317 GLU A 102 GLU~? B 319 ASP A 100 ASP.? B 359 ARG A 71 ARG~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 RMSD = 1.49 A TRANSFORM -0.4676 0.2616 0.8444 -0.7070 -0.6841 -0.1796 -0.5306 0.6809 -0.5048 14.194 50.746 -0.767 A 229 ALA A 124 ALA^? A 257 ALA A 150 ALA^? A 328 ASP A 152 ASP^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.49 A TRANSFORM -0.2431 0.9540 -0.1754 0.9465 0.2729 0.1721 -0.2120 0.1242 0.9693 35.349 -14.236 0.016 A 67 ASP A 119 ASP.? A 68 ALA A 118 ALA.? A 72 LEU A 115 LEU^? ULMNm 3 3hde_o02 LYSOZYME user 4 3 RMSD = 1.50 A TRANSFORM 0.8699 -0.4875 0.0748 0.0821 0.2927 0.9527 0.4864 0.8226 -0.2946 7.812 -45.935 -18.097 C 35 GLU A 207 GLU~? C 44 ASP B 95 ASP~? C 50 THR B 94 THR~? ULMNm 3 1req_c10 METHYLMALONYL-COA MUTASE user 2 3 RMSD = 1.50 A TRANSFORM 0.8214 0.5044 -0.2664 0.5444 -0.5538 0.6300 -0.1702 0.6625 0.7295 67.147 42.619 -17.120 A 608 ASP B 152 ASP^? A 610 HIS B 19 HIS^? A 661 HIS B 114 HIS^? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 RMSD = 1.50 A TRANSFORM 0.2961 0.4808 0.8253 0.4558 -0.8305 0.3202 -0.8394 -0.2813 0.4651 0.744 26.091 18.523 199 ASP B 89 ASP~? 242 GLU B 29 GLU.? 329 ASP B 95 ASP~?