*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1d4c_c02 FLAVOCYTOCHROME C FUMARATE REDUCTASEuser 1 4 RMSD = 1.42 A TRANSFORM -0.1663 0.9616 0.2185 0.8295 0.2562 -0.4963 0.5332 -0.0988 0.8402 17.545 71.915 -0.815 C 364 HIS B 95 HIS~? C 401 ARG B 98 ARG~? C 503 HIS B 99 HIS~? C 544 ARG B 107 ARG.? ULMNm 4 1d4c_c01 FLAVOCYTOCHROME C FUMARATE REDUCTASEuser 1 4 RMSD = 1.50 A TRANSFORM -0.1630 0.9264 0.3394 0.8114 0.3216 -0.4880 0.5612 -0.1958 0.8042 75.776 73.112 54.650 B 364 HIS B 95 HIS~? B 401 ARG B 98 ARG~? B 503 HIS B 99 HIS~? B 544 ARG B 107 ARG.? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 RMSD = 0.73 A TRANSFORM 0.6627 0.1541 -0.7328 0.7431 -0.0138 0.6691 -0.0930 0.9880 0.1237 5.508 49.650 91.411 C 14 ASP B 119 ASP~? C 16 HIS B 95 HIS~? C 67 GLY B 124 GLY~? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 RMSD = 0.74 A TRANSFORM 0.6293 0.3545 -0.6916 -0.7439 0.0174 -0.6680 0.2248 -0.9349 -0.2746 7.212 -18.425 73.363 A 14 ASP B 119 ASP~? A 16 HIS B 95 HIS~? A 67 GLY B 124 GLY~? ULMNm 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 4 3 RMSD = 0.76 A TRANSFORM 0.2924 -0.0416 0.9554 -0.6158 -0.7725 0.1548 -0.7316 0.6336 0.2516 27.762 14.869 5.813 166 ASP B 119 ASP~? 169 ARG B 122 ARG~? 193 HIS B 95 HIS~? ULMNm 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 RMSD = 0.79 A TRANSFORM 0.3481 -0.6292 -0.6950 -0.7300 -0.6470 0.2201 0.5881 -0.4307 0.6845 12.673 26.263 62.652 A 158 ASP B 119 ASP~? A 161 ARG B 122 ARG~? A 186 HIS B 95 HIS~? ULMNm 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 4 3 RMSD = 0.81 A TRANSFORM -0.5783 0.7072 0.4068 0.8108 0.5534 0.1906 0.0904 -0.4401 0.8934 10.392 5.952 24.520 150 ASP B 119 ASP~? 153 ARG B 122 ARG~? 177 HIS B 95 HIS~? ULMNm 3 1pyl_c01 RIBONUCLEASE user 8 3 RMSD = 0.82 A TRANSFORM 0.3352 0.8574 0.3905 0.9036 -0.1751 -0.3910 0.2669 -0.4839 0.8334 28.178 -4.420 10.027 B 56 GLU B 113 GLU~? B 67 ARG B 45 ARG.? B 86 HIS B 99 HIS~? ULMNm 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 RMSD = 0.88 A TRANSFORM 0.0412 0.6933 -0.7194 0.9859 0.0887 0.1420 -0.1623 0.7151 0.6799 94.531 40.741 38.496 A 966 SER A 103 SER~? A 967 ARG A 107 ARG.? A 975 TYR A 49 TYR^? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 4 3 RMSD = 0.93 A TRANSFORM -0.6313 0.3115 0.7102 -0.6099 -0.7651 -0.2065 -0.4791 0.5635 -0.6730 49.360 12.685 24.310 B 158 ASP B 119 ASP~? B 161 ARG B 122 ARG~? B 186 HIS B 95 HIS~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 0.94 A TRANSFORM 0.1798 0.8296 0.5286 -0.8108 0.4292 -0.3979 0.5570 0.3570 -0.7499 34.266 28.515 49.550 A 194 SER B 103 SER~? A 292 ASP A 51 ASP.? A 322 HIS B 67 HIS^? ULMNm 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 1 3 RMSD = 0.95 A TRANSFORM -0.2334 0.7223 -0.6510 0.9683 0.1118 -0.2232 0.0884 0.6825 0.7256 3.998 2.628 26.331 150 ASP B 119 ASP~? 153 ARG A 98 ARG~? 177 HIS B 95 HIS~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.96 A TRANSFORM -0.9320 0.3522 0.0859 0.0856 0.4443 -0.8918 0.3522 0.8238 0.4442 46.019 -115.592 -120.246 A 420 ALA A 87 ALA~? B 182 GLY B 124 GLY~? B 183 GLY B 125 GLY~? ULMNm 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 RMSD = 0.97 A TRANSFORM 0.4206 0.7941 0.4388 -0.8005 0.0972 0.5914 -0.4270 0.6000 -0.6765 26.857 19.453 0.025 166 ASP B 119 ASP~? 169 ARG A 98 ARG~? 193 HIS B 95 HIS~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.01 A TRANSFORM 0.8252 -0.4552 -0.3344 -0.5057 -0.3317 -0.7964 -0.2517 -0.8263 0.5039 -7.537 17.287 39.076 B 317 GLU A 19 GLU~? B 319 ASP A 20 ASP~? B 359 ARG B 117 ARG~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 RMSD = 1.02 A TRANSFORM 0.1351 0.7696 -0.6241 0.9739 0.0126 0.2264 -0.1821 0.6384 0.7478 40.794 77.536 16.113 B 194 SER B 103 SER~? B 292 ASP A 51 ASP.? B 322 HIS B 67 HIS^? ULMNm 3 1k12_p00 LECTIN user 6 3 RMSD = 1.04 A TRANSFORM -0.5495 -0.4679 0.6922 -0.6946 0.7163 -0.0672 0.4644 0.5178 0.7185 -5.346 23.538 15.189 A 52 HIS B 95 HIS~? A 79 ARG B 123 ARG~? A 86 ARG B 122 ARG~? ULMNm 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.06 A TRANSFORM -0.0074 -0.9073 0.4204 -0.8649 0.2168 0.4527 0.5018 0.3603 0.7864 18.671 29.518 65.316 A 158 ASP B 119 ASP~? A 161 ARG A 98 ARG~? A 186 HIS B 95 HIS~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 9 3 RMSD = 1.10 A TRANSFORM 0.2702 0.7292 0.6287 0.8833 0.0720 -0.4632 0.3830 -0.6805 0.6246 0.534 30.646 3.083 A 14 GLU B 96 GLU~? A 61 GLU B 102 GLU~? A 162 HIS B 95 HIS~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 RMSD = 1.11 A TRANSFORM -0.6087 0.7608 -0.2252 0.6063 0.2630 -0.7505 0.5117 0.5934 0.6214 49.524 89.574 39.205 229 ASP B 108 ASP~? 264 GLU B 48 GLU^? 328 ASP B 114 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.12 A TRANSFORM -0.6137 0.5537 -0.5629 -0.0914 -0.7579 -0.6459 0.7843 0.3449 -0.5157 66.068 -112.251 -116.193 A 420 ALA A 57 ALA.? B 182 GLY A 60 GLY.? B 183 GLY A 59 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.12 A TRANSFORM 0.3411 -0.8910 0.2995 0.8771 0.4163 0.2395 0.3381 -0.1810 -0.9235 42.038 -101.343 -143.509 A 420 ALA B 120 ALA~? B 182 GLY B 125 GLY~? B 183 GLY B 124 GLY~? ULMNm 3 1kim_c00 THYMIDINE KINASE user 5 3 RMSD = 1.12 A TRANSFORM -0.9793 0.0259 -0.2007 0.0668 0.9776 -0.1995 -0.1911 0.2088 0.9591 53.809 76.114 54.782 A 83 GLU B 37 GLU.? A 163 ARG B 117 ARG~? A 222 ARG B 45 ARG.? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.13 A TRANSFORM 0.2526 -0.9673 0.0222 0.8128 0.1997 -0.5472 -0.5249 -0.1563 -0.8367 31.989 -1.266 59.381 A 198 GLY A 106 GLY~? A 228 SER A 103 SER~? A 549 ASP A 51 ASP.? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.13 A TRANSFORM -0.0052 0.9843 -0.1766 -0.3444 0.1641 0.9244 -0.9388 -0.0657 -0.3381 25.863 43.492 34.629 A 194 SER B 74 SER~? A 292 ASP A 84 ASP~? A 322 HIS B 29 HIS^? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.13 A TRANSFORM 0.2656 -0.6900 0.6733 0.4842 -0.5085 -0.7120 -0.8336 -0.5152 -0.1990 -17.240 47.611 38.659 D 603 HIS B 67 HIS^? D 646 ASP B 51 ASP.? D 739 GLY B 47 GLY^? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.15 A TRANSFORM 0.7224 -0.5102 -0.4667 0.2730 0.8306 -0.4853 -0.6353 -0.2232 -0.7393 124.976 87.429 129.133 B1198 GLY A 106 GLY~? B1228 SER A 103 SER~? B1549 ASP A 51 ASP.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.15 A TRANSFORM -0.7178 0.6738 0.1756 0.5298 0.3648 0.7656 -0.4518 -0.6426 0.6188 44.876 -71.351 -151.918 A 183 GLY A 60 GLY.? B 419 GLY A 59 GLY.? B 420 ALA A 57 ALA.? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 1 3 RMSD = 1.16 A TRANSFORM 0.9297 -0.1594 0.3321 -0.3666 -0.4899 0.7910 -0.0366 0.8571 0.5139 30.887 94.408 12.894 313 ASP B 109 ASP~? 315 GLU B 113 GLU~? 390 TYR B 49 TYR^? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.16 A TRANSFORM 0.1980 0.9733 0.1158 -0.9787 0.1898 0.0786 -0.0546 0.1289 -0.9902 4.711 43.643 57.222 C 603 HIS B 67 HIS^? C 646 ASP B 51 ASP.? C 739 GLY B 47 GLY^? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 RMSD = 1.17 A TRANSFORM -0.8655 0.4019 -0.2990 0.4353 0.3081 -0.8459 0.2479 0.8623 0.4416 49.720 90.663 41.463 229 ASP B 108 ASP~? 264 GLU B 96 GLU~? 328 ASP B 114 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.17 A TRANSFORM 0.1415 0.9796 0.1424 -0.9899 0.1393 0.0259 -0.0056 0.1446 -0.9895 6.506 45.029 -5.585 A 603 HIS B 67 HIS^? A 646 ASP B 51 ASP.? A 739 GLY B 47 GLY^? ULMNm 3 1pyl_c00 RIBONUCLEASE user 6 3 RMSD = 1.18 A TRANSFORM 0.2943 -0.7072 -0.6428 0.6502 0.6411 -0.4077 -0.7004 0.2980 -0.6485 23.256 1.314 20.159 A 56 GLU B 113 GLU~? A 67 ARG B 45 ARG.? A 86 HIS B 99 HIS~? ULMNm 3 1kim_c00 THYMIDINE KINASE user 7 3 RMSD = 1.19 A TRANSFORM 0.4800 -0.5161 0.7094 0.1375 0.8429 0.5202 0.8664 0.1522 -0.4755 51.244 85.879 58.904 A 83 GLU B 102 GLU~? A 163 ARG B 98 ARG~? A 222 ARG B 107 ARG.? ULMNm 3 1bqc_c01 BETA-MANNANASE user 4 3 RMSD = 1.19 A TRANSFORM 0.9294 0.1043 0.3540 -0.2426 -0.5502 0.7990 -0.2781 0.8285 0.4860 43.884 18.091 23.635 A 50 ARG A 98 ARG~? A 128 GLU B 102 GLU~? A 225 GLU A 102 GLU~? ULMNm 3 1itx_c00 GLYCOSYL HYDROLASE user 1 3 RMSD = 1.20 A TRANSFORM 0.0400 -0.7573 -0.6518 -0.7838 -0.4284 0.4496 0.6197 -0.4929 0.6107 13.066 3.141 27.599 A 202 ASP B 109 ASP~? A 204 GLU B 113 GLU~? A 279 TYR B 49 TYR^? ULMNm 3 1ndo_c00 NAPTHALENE 1,2-DIOXYGENASE user 1 3 RMSD = 1.21 A TRANSFORM 0.8185 -0.1709 0.5485 -0.5240 0.1693 0.8347 0.2355 0.9706 -0.0490 25.877 36.799 75.605 A 205 ASP B 119 ASP~? A 208 HIS B 95 HIS~? C 104 HIS B 99 HIS~? ULMNm 3 1fob_c00 BETA-1,4-GALACTANASE user 4 3 RMSD = 1.21 A TRANSFORM 0.7843 0.5823 -0.2140 0.4834 -0.3575 0.7991 -0.3888 0.7301 0.5619 19.565 32.395 115.004 A 45 ARG A 98 ARG~? A 136 GLU B 102 GLU~? A 246 GLU A 102 GLU~? ULMNm 3 1ndo_c02 NAPTHALENE 1,2-DIOXYGENASE user 1 3 RMSD = 1.22 A TRANSFORM 0.6424 0.4275 0.6360 0.1038 0.7738 -0.6249 0.7593 -0.4674 -0.4527 43.349 64.395 34.695 C 205 ASP B 119 ASP~? C 208 HIS B 95 HIS~? E 104 HIS B 99 HIS~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.22 A TRANSFORM -0.9329 0.3447 0.1041 -0.0636 0.1269 -0.9899 0.3544 0.9301 0.0964 32.920 56.238 16.815 B 194 SER B 74 SER~? B 292 ASP A 84 ASP~? B 322 HIS B 29 HIS^? ULMNm 3 1ndo_c01 NAPTHALENE 1,2-DIOXYGENASE user 1 3 RMSD = 1.23 A TRANSFORM 0.9541 0.2756 0.1169 0.2979 -0.9130 -0.2788 -0.0299 -0.3008 0.9532 42.075 12.200 32.606 A 104 HIS B 99 HIS~? E 205 ASP B 119 ASP~? E 208 HIS B 95 HIS~? ULMNm 3 1fhl_c00 BETA-1,4-GALACTANASE user 4 3 RMSD = 1.23 A TRANSFORM 0.7909 0.5866 -0.1741 0.4679 -0.3964 0.7899 -0.3943 0.7062 0.5880 19.602 32.516 115.334 A 45 ARG A 98 ARG~? A 136 GLU B 102 GLU~? A 246 GLU A 102 GLU~? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.26 A TRANSFORM 0.4909 -0.6241 0.6079 0.3500 -0.4977 -0.7936 -0.7978 -0.6023 0.0259 -13.537 48.745 -23.553 B 603 HIS B 67 HIS^? B 646 ASP B 51 ASP.? B 739 GLY B 47 GLY^? ULMNm 3 1c54_c00 RIBONUCLEASE SA user 5 3 RMSD = 1.27 A TRANSFORM 0.3894 -0.0652 0.9188 -0.4038 -0.9086 0.1067 -0.8278 0.4126 0.3801 -2.766 -3.769 -14.780 A 54 GLU A 102 GLU~? A 65 ARG B 122 ARG~? A 85 HIS B 95 HIS~? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.29 A TRANSFORM -0.3474 0.9111 -0.2219 -0.8611 -0.2163 0.4602 -0.3712 -0.3510 -0.8597 45.202 17.847 20.789 B 158 ASP B 119 ASP~? B 161 ARG A 98 ARG~? B 186 HIS B 95 HIS~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.29 A TRANSFORM 0.7993 -0.0473 0.5990 -0.3515 0.7718 0.5299 0.4874 0.6341 -0.6003 22.445 26.778 51.033 A 316 ALA A 105 ALA~? A 317 GLY A 106 GLY~? A 318 ASP A 108 ASP.? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.31 A TRANSFORM -0.3610 -0.9242 -0.1244 -0.1685 0.1959 -0.9660 -0.9172 0.3278 0.2265 10.929 41.256 85.005 A 241 ASP B 114 ASP~? A 279 GLU A 15 GLU~? A 369 ASP B 108 ASP~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 1 3 RMSD = 1.31 A TRANSFORM 0.3670 0.7471 -0.5542 0.6241 0.2441 0.7423 -0.6898 0.6183 0.3767 36.428 30.708 110.782 B 223 HIS A 67 HIS^? B 262 HIS A 100 HIS~? B 312 ASP A 51 ASP.? ULMNm 3 1k12_p00 LECTIN user 1 3 RMSD = 1.32 A TRANSFORM -0.0180 -0.7964 -0.6045 -0.6118 -0.4695 0.6366 0.7908 -0.3813 0.4788 -20.933 23.910 6.984 A 52 HIS A 95 HIS~? A 79 ARG A 98 ARG~? A 86 ARG B 122 ARG~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 4 3 RMSD = 1.33 A TRANSFORM -0.8952 -0.4362 0.0912 0.4085 -0.8851 -0.2231 -0.1780 0.1625 -0.9705 76.643 34.149 113.883 B 382 ARG A 98 ARG~? B 451 GLU B 102 GLU~? B 540 GLU A 102 GLU~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.35 A TRANSFORM -0.7623 0.3564 0.5403 -0.2730 -0.9339 0.2308 -0.5869 -0.0284 -0.8092 25.933 -20.662 5.097 274 HIS A 67 HIS^? 320 HIS A 100 HIS~? 375 ASP A 51 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.35 A TRANSFORM -0.4916 0.5857 0.6445 0.1299 -0.6825 0.7193 -0.8611 -0.4373 -0.2594 10.446 2.685 4.881 141 ASP B 114 ASP~? 166 GLY A 27 GLY^? 169 GLU A 11 GLU~? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.36 A TRANSFORM 0.0840 0.9964 -0.0128 -0.5697 0.0374 -0.8210 0.8176 -0.0763 -0.5708 50.311 40.506 60.684 A 223 HIS A 67 HIS^? A 262 HIS A 100 HIS~? A 312 ASP A 51 ASP.? ULMNm 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 RMSD = 1.36 A TRANSFORM -0.6220 -0.6164 0.4829 -0.4109 0.7819 0.4689 0.6666 -0.0932 0.7396 2.118 -6.431 74.951 A 263 HIS A 95 HIS~? D 59 GLU B 102 GLU~? D 128 HIS B 95 HIS~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.37 A TRANSFORM 0.3996 -0.8068 -0.4353 -0.9131 -0.3923 -0.1111 0.0811 -0.4419 0.8934 3.915 9.821 11.401 B 99 ARG A 23 ARG~? B 101 ASP A 20 ASP~? B 132 ASP B 114 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.37 A TRANSFORM -0.3885 0.8002 0.4568 0.9211 0.3236 0.2165 -0.0254 -0.5049 0.8628 19.082 15.493 10.943 A 99 ARG A 23 ARG~? A 101 ASP A 20 ASP~? A 132 ASP B 114 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.37 A TRANSFORM 0.7760 0.2296 0.5874 -0.6159 0.4766 0.6274 0.1359 0.8486 -0.5112 8.123 27.364 14.657 A 99 ARG B 117 ARG~? A 101 ASP B 114 ASP~? A 132 ASP A 20 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.37 A TRANSFORM -0.7807 -0.2046 -0.5905 0.6204 -0.3674 -0.6929 0.0752 0.9073 -0.4137 15.102 -1.380 16.322 B 99 ARG B 117 ARG~? B 101 ASP B 114 ASP~? B 132 ASP A 20 ASP~? ULMNm 3 1opm_c00 1.14.17.0003 user 1 3 RMSD = 1.39 A TRANSFORM 0.6198 0.7813 0.0729 0.7044 -0.5131 -0.4905 0.3458 -0.3554 0.8684 47.735 16.036 29.962 A 108 HIS A 67 HIS^? A 170 GLN A 26 GLN.? A 242 HIS A 100 HIS~? ULMNm 3 1ig8_c00 HEXOKINASE PII user 2 3 RMSD = 1.40 A TRANSFORM -0.5833 -0.7179 0.3800 -0.4443 -0.1096 -0.8891 -0.6800 0.6874 0.2551 12.124 79.486 9.832 A 158 SER A 103 SER~? A 173 ARG B 107 ARG.? A 211 ASP A 51 ASP.? ULMNm 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.41 A TRANSFORM -0.4637 -0.1328 0.8760 0.8455 -0.3618 0.3927 -0.2648 -0.9228 -0.2800 22.258 34.622 13.519 C 581 GLU A 91 GLU~? C 596 ARG B 122 ARG~? C 647 ARG A 98 ARG~? ULMNm 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 7 3 RMSD = 1.41 A TRANSFORM -0.2173 -0.7568 -0.6165 -0.6220 0.5941 -0.5101 -0.7523 -0.2726 0.5998 9.714 -26.995 56.911 A 263 HIS B 100 HIS~? D 59 GLU B 19 GLU~? D 128 HIS B 67 HIS^? ULMNm 3 1ab4_c00 GYRASE A user 9 3 RMSD = 1.42 A TRANSFORM 0.0666 0.8574 -0.5103 0.2975 0.4711 0.8304 -0.9524 0.2072 0.2237 54.591 71.618 28.154 32 ARG B 107 ARG.? 78 HIS B 99 HIS~? 122 TYR B 72 TYR~? ULMNm 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 4 3 RMSD = 1.42 A TRANSFORM 0.8371 -0.0022 -0.5470 0.1887 -0.9375 0.2925 0.5134 0.3481 0.7844 15.631 -0.275 25.743 18 ARG B 122 ARG~? 195 HIS B 95 HIS~? 199 ASP B 119 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.43 A TRANSFORM -0.7088 -0.6895 -0.1486 0.5194 -0.3677 -0.7714 -0.4773 0.6240 -0.6188 17.827 17.506 18.909 A 99 ARG B 117 ARG~? A 101 ASP A 20 ASP~? A 132 ASP B 114 ASP~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.43 A TRANSFORM -0.3950 0.7900 0.4689 0.9187 0.3396 0.2018 -0.0001 -0.5105 0.8599 18.936 15.560 10.855 A 99 ARG A 23 ARG~? A 101 ASP A 20 ASP~? A 132 ASP B 114 ASP~? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.43 A TRANSFORM -0.7906 -0.2224 -0.5705 0.6094 -0.3768 -0.6976 0.0598 0.8992 -0.4334 15.120 -1.547 16.407 B 99 ARG B 117 ARG~? B 101 ASP B 114 ASP~? B 132 ASP A 20 ASP~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.43 A TRANSFORM 0.7827 0.2338 0.5769 -0.6121 0.4577 0.6449 0.1132 0.8578 -0.5013 7.945 27.262 14.974 A 99 ARG B 117 ARG~? A 101 ASP B 114 ASP~? A 132 ASP A 20 ASP~? ULMNm 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.43 A TRANSFORM -0.0548 -0.9036 0.4249 -0.1988 -0.4072 -0.8915 -0.9785 0.1333 0.1573 -47.157 -35.344 23.547 D 581 GLU A 91 GLU~? D 596 ARG B 122 ARG~? D 647 ARG A 98 ARG~? ULMNm 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.44 A TRANSFORM 0.3939 -0.8031 -0.4471 0.9037 0.4272 0.0289 -0.1678 0.4154 -0.8940 24.378 63.573 61.020 B 581 GLU A 91 GLU~? B 596 ARG B 122 ARG~? B 647 ARG A 98 ARG~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7786 0.4488 0.4387 -0.6260 0.6046 0.4925 0.0442 0.6581 -0.7517 70.400 87.996 159.706 F 141 GLY A 47 GLY^? F 144 GLU A 96 GLU~? F 164 GLU A 48 GLU^? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.44 A TRANSFORM 0.4066 -0.7877 -0.4628 -0.9095 -0.3966 -0.1241 0.0858 -0.4715 0.8777 3.956 9.564 11.255 B 99 ARG A 23 ARG~? B 101 ASP A 20 ASP~? B 132 ASP B 114 ASP~? ULMNm 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.44 A TRANSFORM 0.0749 0.9040 -0.4209 0.4740 0.3391 0.8126 -0.8773 0.2603 0.4031 71.755 48.054 35.893 A 581 GLU A 91 GLU~? A 596 ARG B 122 ARG~? A 647 ARG A 98 ARG~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 RMSD = 1.44 A TRANSFORM -0.3149 0.6998 -0.6412 0.9313 0.0975 -0.3510 0.1831 0.7076 0.6824 5.068 5.742 8.556 141 ASP B 119 ASP~? 166 GLY A 24 GLY.? 169 GLU A 62 GLU~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 RMSD = 1.45 A TRANSFORM 0.7034 0.7006 0.1198 -0.5687 0.4536 0.6862 -0.4264 0.5507 -0.7175 5.382 8.846 19.528 B 99 ARG B 117 ARG~? B 101 ASP A 20 ASP~? B 132 ASP B 114 ASP~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.45 A TRANSFORM -0.0776 -0.9581 0.2758 -0.9179 0.1767 0.3554 0.3892 0.2256 0.8931 70.607 88.246 146.824 D 141 GLY A 47 GLY^? D 144 GLU A 96 GLU~? D 164 GLU A 48 GLU^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.45 A TRANSFORM 0.1373 0.9861 -0.0939 0.9082 -0.1631 -0.3855 0.3955 0.0324 0.9179 74.362 96.910 146.349 C 141 GLY A 47 GLY^? C 144 GLU A 96 GLU~? C 164 GLU A 48 GLU^? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 RMSD = 1.45 A TRANSFORM 0.7243 0.6762 0.1344 -0.5546 0.4556 0.6963 -0.4096 0.5789 -0.7051 5.158 8.508 19.428 B 99 ARG B 117 ARG~? B 101 ASP A 20 ASP~? B 132 ASP B 114 ASP~? ULMNm 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.45 A TRANSFORM 0.4889 0.1176 -0.8644 -0.7144 0.6225 -0.3194 -0.5005 -0.7737 -0.3884 2.213 -15.473 6.517 E 581 GLU A 91 GLU~? E 596 ARG B 122 ARG~? E 647 ARG A 98 ARG~? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 3 3 RMSD = 1.45 A TRANSFORM -0.0924 0.8220 0.5620 -0.1123 -0.5694 0.8143 -0.9894 -0.0121 -0.1449 56.119 8.806 49.477 412 GLU A 102 GLU~? 516 HIS A 95 HIS~? 559 HIS A 99 HIS~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.45 A TRANSFORM 0.0623 0.0927 -0.9937 -0.8492 0.5281 -0.0040 -0.5244 -0.8441 -0.1117 81.096 91.544 153.020 E 141 GLY A 47 GLY^? E 144 GLU A 96 GLU~? E 164 GLU A 48 GLU^? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 6 3 RMSD = 1.46 A TRANSFORM 0.5433 0.1345 0.8287 -0.4136 0.9019 0.1248 0.7306 0.4106 -0.5456 30.568 16.748 22.020 C 197 ARG B 107 ARG.? C 201 HIS A 95 HIS~? C 204 HIS A 99 HIS~? ULMNm 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.46 A TRANSFORM -0.4005 0.7999 0.4470 -0.8094 -0.5375 0.2366 -0.4295 0.2671 -0.8627 0.076 -57.149 43.344 F 581 GLU A 91 GLU~? F 596 ARG B 122 ARG~? F 647 ARG A 98 ARG~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 RMSD = 1.46 A TRANSFORM -0.7200 -0.6787 -0.1449 0.5209 -0.3907 -0.7589 -0.4585 0.6219 -0.6348 17.793 17.414 18.896 A 99 ARG B 117 ARG~? A 101 ASP A 20 ASP~? A 132 ASP B 114 ASP~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.46 A TRANSFORM -0.7475 -0.3667 -0.5539 0.6481 -0.5855 -0.4870 0.1458 0.7230 -0.6753 75.896 97.517 159.060 B 141 GLY A 47 GLY^? B 144 GLU A 96 GLU~? B 164 GLU A 48 GLU^? ULMNm 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 RMSD = 1.46 A TRANSFORM 0.9205 -0.1902 0.3413 0.1014 -0.7272 -0.6789 -0.3773 -0.6595 0.6501 91.682 18.477 32.038 C 29 HIS B 67 HIS^? C 50 GLU B 15 GLU~? C 113 GLN B 26 GLN.? ULMNm 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 RMSD = 1.46 A TRANSFORM -0.9584 0.1882 -0.2145 0.2722 0.8282 -0.4899 -0.0854 0.5279 0.8450 20.582 -24.134 4.667 B 29 HIS B 67 HIS^? B 50 GLU B 15 GLU~? B 113 GLN B 26 GLN.? ULMNm 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 RMSD = 1.46 A TRANSFORM -0.9584 0.1882 -0.2145 0.2722 0.8282 -0.4899 -0.0854 0.5279 0.8450 20.582 -24.134 4.667 B 29 HIS B 67 HIS^? B 50 GLU B 15 GLU~? B 113 GLN B 26 GLN.? ULMNm 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 RMSD = 1.46 A TRANSFORM -0.9289 0.1158 -0.3517 -0.2861 -0.8275 0.4831 0.2351 -0.5494 -0.8018 22.699 18.226 36.672 D 29 HIS B 67 HIS^? D 50 GLU B 15 GLU~? D 113 GLN B 26 GLN.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.47 A TRANSFORM -0.4360 0.2652 -0.8600 0.7884 0.5734 -0.2228 -0.4341 0.7751 0.4591 16.256 30.131 88.672 A 241 ASP A 20 ASP~? A 265 GLU A 96 GLU~? A 369 ASP B 114 ASP~? ULMNm 3 1c82_c02 HYALURONATE LYASE user 1 3 RMSD = 1.47 A TRANSFORM -0.7495 0.3017 0.5893 0.3275 -0.6045 0.7261 -0.5753 -0.7372 -0.3543 0.034 -12.785 31.066 A 399 HIS B 100 HIS~? A 408 TYR B 49 TYR^? A 480 ARG B 117 ARG~? ULMNm 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 RMSD = 1.47 A TRANSFORM 0.9689 -0.1089 0.2223 -0.0751 0.7262 0.6834 0.2359 0.6788 -0.6954 89.658 -22.957 -1.404 A 29 HIS B 67 HIS^? A 50 GLU B 15 GLU~? A 113 GLN B 26 GLN.? ULMNm 3 1kim_c00 THYMIDINE KINASE user 4 3 RMSD = 1.47 A TRANSFORM 0.9415 -0.0404 0.3345 0.0722 -0.9455 -0.3175 -0.3291 -0.3231 0.8873 49.710 82.839 56.957 A 83 GLU B 37 GLU.? A 163 ARG B 45 ARG.? A 222 ARG B 117 ARG~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 1 3 RMSD = 1.47 A TRANSFORM 0.1253 0.0265 -0.9918 0.9880 0.0876 0.1271 -0.0903 0.9958 0.0152 -5.414 2.342 -21.657 14 ASP B 51 ASP.? 16 HIS B 67 HIS^? 67 GLY B 73 GLY~? ULMNm 3 1qrz_c22 PLASMINOGEN user 3 3 RMSD = 1.48 A TRANSFORM 0.7915 0.2579 0.5541 -0.4043 0.9009 0.1581 0.4584 0.3492 -0.8173 5.262 -10.303 10.536 C 603 HIS B 99 HIS~? C 646 ASP B 114 ASP~? C 739 GLY B 53 GLY.? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.48 A TRANSFORM -0.1705 -0.1749 -0.9697 0.0162 0.9835 -0.1802 -0.9852 0.0464 0.1648 12.003 62.398 67.364 D 203 GLN A 26 GLN.? D 207 HIS A 67 HIS^? D 385 TYR A 49 TYR^? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 6 3 RMSD = 1.48 A TRANSFORM 0.3056 -0.9173 -0.2555 -0.5872 0.0297 -0.8089 -0.7495 -0.3972 0.5296 -21.310 105.719 21.255 B 197 ARG B 107 ARG.? B 201 HIS A 95 HIS~? B 204 HIS A 99 HIS~? ULMNm 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 RMSD = 1.48 A TRANSFORM 0.5058 -0.7616 0.4052 -0.7218 -0.6308 -0.2848 -0.4725 0.1484 0.8688 62.234 66.197 -23.061 A 325 ARG A 23 ARG~? A 342 ASP B 108 ASP~? A 531 ARG A 107 ARG.? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.48 A TRANSFORM 0.0847 0.2574 0.9626 -0.9945 0.0811 0.0659 0.0611 0.9629 -0.2628 62.901 42.313 84.002 C 203 GLN A 26 GLN.? C 207 HIS A 67 HIS^? C 385 TYR A 49 TYR^? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.49 A TRANSFORM -0.1323 -0.2279 -0.9647 0.9908 -0.0589 -0.1219 0.0291 0.9719 -0.2336 21.948 24.669 24.810 A 203 GLN A 26 GLN.? A 207 HIS A 67 HIS^? A 385 TYR A 49 TYR^? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.49 A TRANSFORM -0.0721 0.6188 0.7822 -0.7847 0.4489 -0.4275 0.6157 0.6446 -0.4532 0.935 -13.872 12.494 C 603 HIS B 99 HIS~? C 646 ASP B 109 ASP~? C 739 GLY B 24 GLY.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 6 3 RMSD = 1.49 A TRANSFORM -0.6926 -0.6439 -0.3251 -0.1104 0.5400 -0.8344 -0.7128 0.5421 0.4451 13.470 41.042 83.572 A 241 ASP B 114 ASP~? A 265 GLU A 62 GLU~? A 369 ASP B 108 ASP~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.49 A TRANSFORM 0.7284 -0.1642 0.6652 -0.2996 0.7968 0.5247 0.6162 0.5815 -0.5312 66.701 67.702 149.667 F 141 GLY B 47 GLY^? F 144 GLU B 48 GLU^? F 164 GLU B 96 GLU~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.49 A TRANSFORM -0.6217 0.2401 -0.7455 0.3125 -0.7968 -0.5172 0.7182 0.5545 -0.4203 78.596 117.504 148.454 B 141 GLY B 47 GLY^? B 144 GLU B 48 GLU^? B 164 GLU B 96 GLU~? ULMNm 3 1qrz_c21 PLASMINOGEN user 4 3 RMSD = 1.49 A TRANSFORM -0.1746 -0.2781 0.9445 0.4464 -0.8774 -0.1758 -0.8776 -0.3909 -0.2774 -49.078 4.204 -8.127 B 603 HIS B 99 HIS~? B 646 ASP B 114 ASP~? B 739 GLY B 53 GLY.? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.50 A TRANSFORM 0.1504 0.2232 0.9631 -0.0448 -0.9716 0.2321 -0.9876 0.0781 0.1361 73.175 6.342 7.527 B 203 GLN A 26 GLN.? B 207 HIS A 67 HIS^? B 385 TYR A 49 TYR^? ULMNm 3 1c54_c00 RIBONUCLEASE SA user 8 3 RMSD = 1.50 A TRANSFORM 0.0764 0.3838 0.9202 -0.7826 -0.5488 0.2938 -0.6178 0.7427 -0.2585 -3.957 -4.512 -17.210 A 54 GLU B 102 GLU~? A 65 ARG A 98 ARG~? A 85 HIS B 95 HIS~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.50 A TRANSFORM 0.3932 0.1498 -0.9071 -0.3670 0.9302 -0.0054 -0.8430 -0.3351 -0.4208 83.864 72.757 165.848 E 141 GLY B 47 GLY^? E 144 GLU B 48 GLU^? E 164 GLU B 96 GLU~?