*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1rk2_c03 RIBOKINASE user 5 4 RMSD = 1.06 A TRANSFORM 0.8366 -0.2493 0.4879 -0.4792 0.0989 0.8721 -0.2657 -0.9634 -0.0367 50.470 -0.331 232.340 D 252 ALA B 102 ALA.? D 253 ALA B 79 ALA.? D 254 GLY B 80 GLY.? D 255 ASP B 103 ASP.? ULMNm 4 1rk2_c02 RIBOKINASE user 5 4 RMSD = 1.06 A TRANSFORM 0.2952 -0.1243 0.9473 0.9184 -0.2367 -0.3172 0.2636 0.9636 0.0443 41.564 24.292 125.288 C 252 ALA B 102 ALA.? C 253 ALA B 79 ALA.? C 254 GLY B 80 GLY.? C 255 ASP B 103 ASP.? ULMNm 4 1rk2_c01 RIBOKINASE user 5 4 RMSD = 1.07 A TRANSFORM -0.9001 0.1691 0.4016 0.3769 -0.1604 0.9123 0.2186 0.9725 0.0806 -6.510 33.614 40.409 B 252 ALA B 102 ALA.? B 253 ALA B 79 ALA.? B 254 GLY B 80 GLY.? B 255 ASP B 103 ASP.? ULMNm 4 1rk2_c00 RIBOKINASE user 5 4 RMSD = 1.08 A TRANSFORM 0.4329 -0.0298 -0.9009 0.8706 -0.2456 0.4264 -0.2339 -0.9689 -0.0804 7.396 39.221 148.115 A 252 ALA B 102 ALA.? A 253 ALA B 79 ALA.? A 254 GLY B 80 GLY.? A 255 ASP B 103 ASP.? ULMNm 4 1rk2_c03 RIBOKINASE user 2 4 RMSD = 1.17 A TRANSFORM -0.1109 0.2075 0.9719 -0.7097 -0.7011 0.0687 0.6957 -0.6822 0.2250 29.262 55.386 199.701 D 252 ALA A 102 ALA.? D 253 ALA A 79 ALA.? D 254 GLY A 80 GLY.? D 255 ASP A 103 ASP.? ULMNm 4 1rk2_c02 RIBOKINASE user 2 4 RMSD = 1.17 A TRANSFORM -0.5547 -0.3230 0.7668 0.4480 0.6606 0.6024 -0.7011 0.6777 -0.2217 63.156 -31.006 158.302 C 252 ALA A 102 ALA.? C 253 ALA A 79 ALA.? C 254 GLY A 80 GLY.? C 255 ASP A 103 ASP.? ULMNm 4 1rk2_c01 RIBOKINASE user 2 4 RMSD = 1.17 A TRANSFORM -0.4576 -0.7256 -0.5139 -0.4994 -0.2684 0.8237 -0.7356 0.6336 -0.2395 48.643 49.350 76.832 B 252 ALA A 102 ALA.? B 253 ALA A 79 ALA.? B 254 GLY A 80 GLY.? B 255 ASP A 103 ASP.? ULMNm 4 1rk2_c00 RIBOKINASE user 2 4 RMSD = 1.19 A TRANSFORM 0.6779 0.7201 -0.1481 -0.0682 0.2622 0.9626 0.7320 -0.6424 0.2269 -44.872 14.568 112.395 A 252 ALA A 102 ALA.? A 253 ALA A 79 ALA.? A 254 GLY A 80 GLY.? A 255 ASP A 103 ASP.? ULMNm 4 1kfu_c00 M-CALPAIN LARGE SUBUNIT user 2 4 RMSD = 1.46 A TRANSFORM -0.0009 0.9300 0.3675 -0.0287 -0.3674 0.9296 0.9996 -0.0097 0.0270 -41.391 68.533 46.172 L 99 GLN B 34 GLN^? L 105 CYH B 43 CYH.? L 262 HIS B 126 HIS.? L 286 ASN B 122 ASN~? ULMNm 3 2odj_o00 PORIN D user 5 3 RMSD = 0.79 A TRANSFORM 0.8325 -0.5366 0.1377 0.5131 0.6531 -0.5569 0.2089 0.5343 0.8191 59.343 -15.305 23.552 A 156 HIS B 176 HIS~? A 208 ASP B 171 ASP.? A 296 SER B 151 SER.? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 0.80 A TRANSFORM 0.3124 0.1942 0.9299 -0.0155 0.9798 -0.1994 -0.9498 0.0478 0.3091 15.452 -28.256 68.555 A 156 HIS A 176 HIS~? A 208 ASP A 171 ASP.? A 296 SER A 151 SER.? ULMNm 3 2vmg_p00 FIBRONECTIN TYPE III DOMAIN PROTEIN user 1 3 RMSD = 0.85 A TRANSFORM 0.4676 -0.7588 -0.4533 -0.5902 -0.6498 0.4790 -0.6581 0.0435 -0.7517 3.769 52.285 10.912 A 82 HIS A 179 HIS~? A 166 SER A 174 SER.? A 168 HIS A 176 HIS~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 4 3 RMSD = 0.87 A TRANSFORM -0.9432 -0.3298 -0.0400 0.3297 -0.9143 -0.2351 0.0410 -0.2349 0.9711 66.073 71.320 81.058 A 316 ALA A 102 ALA.? A 317 GLY A 80 GLY.? A 318 ASP A 103 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 11 3 RMSD = 0.89 A TRANSFORM -0.2697 0.5084 0.8178 -0.7829 -0.6102 0.1212 0.5607 -0.6075 0.5626 2.823 65.904 102.629 A 316 ALA B 102 ALA.? A 317 GLY B 80 GLY.? A 318 ASP B 103 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 8 3 RMSD = 0.90 A TRANSFORM -0.6553 -0.7470 0.1116 0.7531 -0.6576 0.0203 0.0582 0.0974 0.9935 69.011 66.748 60.949 A 316 ALA B 64 ALA~? A 317 GLY B 63 GLY~? A 318 ASP B 171 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 9 3 RMSD = 0.90 A TRANSFORM 0.6299 0.7049 0.3261 0.6611 -0.2663 -0.7014 -0.4076 0.6574 -0.6338 -1.825 -14.065 -60.301 A 250 ALA B 64 ALA~? A 251 GLY B 63 GLY~? A 252 ASP B 171 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 9 3 RMSD = 0.91 A TRANSFORM -0.4999 0.3894 0.7736 -0.8539 -0.3710 -0.3650 0.1448 -0.8430 0.5180 9.829 -15.708 14.204 B 250 ALA B 64 ALA~? B 251 GLY B 63 GLY~? B 252 ASP B 171 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 9 3 RMSD = 0.92 A TRANSFORM 0.1640 0.6564 -0.7364 -0.4829 -0.5975 -0.6401 -0.8602 0.4606 0.2189 89.048 33.704 -30.806 A 316 ALA B 64 ALA~? A 317 GLY B 63 GLY~? A 318 ASP B 171 ASP.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.92 A TRANSFORM 0.6743 0.0524 -0.7366 -0.2519 0.9540 -0.1628 0.6942 0.2953 0.6564 -10.553 -131.591 -144.640 A 183 GLY A 80 GLY.? B 419 GLY A 101 GLY.? B 420 ALA A 100 ALA~? ULMNm 3 2odj_o01 PORIN D user 1 3 RMSD = 0.95 A TRANSFORM 0.9606 -0.0811 -0.2660 -0.0639 -0.9953 0.0726 -0.2707 -0.0527 -0.9612 -44.084 38.681 64.844 B 156 HIS A 176 HIS~? B 208 ASP A 171 ASP.? B 296 SER A 151 SER.? ULMNm 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 RMSD = 0.96 A TRANSFORM 0.6487 0.7494 -0.1324 0.7611 -0.6386 0.1139 0.0007 -0.1747 -0.9846 15.622 66.864 5.345 B 158 ASP B 216 ASP~? B 161 ARG B 215 ARG~? B 186 HIS B 207 HIS.? ULMNm 3 1qrz_c21 PLASMINOGEN user 3 3 RMSD = 0.98 A TRANSFORM 0.4264 -0.4002 0.8112 -0.8356 -0.5176 0.1839 0.3463 -0.7563 -0.5551 -0.731 15.889 29.724 B 603 HIS B 179 HIS~? B 646 ASP B 180 ASP~? B 739 GLY B 87 GLY.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 10 3 RMSD = 0.99 A TRANSFORM 0.3754 -0.2391 -0.8955 -0.9233 -0.0113 -0.3840 0.0817 0.9709 -0.2250 28.331 -31.138 -83.438 A 250 ALA B 79 ALA.? A 251 GLY B 80 GLY.? A 252 ASP B 103 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 10 3 RMSD = 0.99 A TRANSFORM 0.9790 -0.0669 0.1925 -0.1252 0.5476 0.8273 -0.1607 -0.8341 0.5277 33.423 -47.592 26.689 B 250 ALA B 79 ALA.? B 251 GLY B 80 GLY.? B 252 ASP B 103 ASP.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 9 3 RMSD = 1.00 A TRANSFORM -0.0158 0.8464 0.5322 -0.6169 -0.4271 0.6610 0.7869 -0.3179 0.5289 1.245 79.798 45.514 A 229 ALA B 37 ALA.? A 257 ALA B 39 ALA.? A 328 ASP B 69 ASP~? ULMNm 3 2odj_o01 PORIN D user 6 3 RMSD = 1.00 A TRANSFORM -0.1989 -0.5801 -0.7899 -0.6211 -0.5489 0.5594 -0.7581 0.6019 -0.2511 1.921 17.896 25.237 B 156 HIS B 176 HIS~? B 208 ASP B 171 ASP.? B 296 SER B 151 SER.? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.02 A TRANSFORM -0.2527 -0.3000 0.9199 0.1641 -0.9502 -0.2648 0.9535 0.0840 0.2894 -1.991 32.005 -34.751 B 603 HIS A 179 HIS~? B 646 ASP A 180 ASP~? B 739 GLY A 87 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.03 A TRANSFORM 0.1148 0.9378 -0.3277 0.0947 0.3180 0.9433 0.9889 -0.1393 -0.0523 -32.316 -69.248 -113.794 A 183 GLY B 87 GLY.? B 419 GLY B 89 GLY.? B 420 ALA B 90 ALA.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 5 3 RMSD = 1.03 A TRANSFORM 0.5323 0.6440 -0.5494 -0.6666 -0.0812 -0.7410 -0.5218 0.7607 0.3861 77.532 17.356 -34.361 A 316 ALA A 102 ALA.? A 317 GLY A 80 GLY.? A 318 ASP A 103 ASP.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.04 A TRANSFORM -0.2857 0.8004 -0.5271 -0.9236 -0.0833 0.3741 0.2555 0.5937 0.7630 -17.356 -29.807 -155.852 A 183 GLY A 87 GLY.? B 419 GLY A 89 GLY.? B 420 ALA A 90 ALA.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 10 3 RMSD = 1.05 A TRANSFORM -0.2265 0.7227 -0.6530 -0.6025 0.4229 0.6769 0.7653 0.5468 0.3396 72.036 -4.233 -32.905 A 316 ALA B 79 ALA.? A 317 GLY B 80 GLY.? A 318 ASP B 103 ASP.? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.05 A TRANSFORM -0.9790 -0.2039 0.0060 -0.1974 0.9545 0.2236 -0.0513 0.2177 -0.9747 46.197 -38.359 -24.625 C 603 HIS A 179 HIS~? C 646 ASP A 180 ASP~? C 739 GLY A 87 GLY.? ULMNm 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 RMSD = 1.06 A TRANSFORM -0.2808 -0.9353 0.2154 0.9486 -0.2363 0.2105 -0.1459 0.2634 0.9536 66.464 64.108 72.856 A 158 ASP B 216 ASP~? A 161 ARG B 215 ARG~? A 186 HIS B 207 HIS.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.06 A TRANSFORM 0.3385 -0.9406 -0.0247 0.5161 0.1637 0.8407 -0.7868 -0.2973 0.5409 70.538 12.209 97.343 A 316 ALA A 64 ALA~? A 317 GLY A 63 GLY~? A 318 ASP A 171 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 13 3 RMSD = 1.06 A TRANSFORM 0.0399 0.2235 -0.9739 -0.6147 0.7739 0.1524 0.7877 0.5926 0.1682 108.640 -41.925 -39.594 A 316 ALA B 102 ALA.? A 317 GLY B 80 GLY.? A 318 ASP B 103 ASP.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.06 A TRANSFORM -0.9536 0.2843 0.0994 -0.2661 -0.9499 0.1640 0.1411 0.1299 0.9814 56.369 111.179 15.432 A 229 ALA A 37 ALA.? A 257 ALA A 39 ALA.? A 328 ASP A 69 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 25 3 RMSD = 1.08 A TRANSFORM 0.5991 0.6899 -0.4064 -0.0263 -0.4903 -0.8712 -0.8002 0.5326 -0.2756 18.442 17.784 -35.680 A 67 ASP B 180 ASP~? A 68 ALA B 181 ALA~? A 72 LEU B 182 LEU~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 5 3 RMSD = 1.08 A TRANSFORM -0.2942 0.3814 0.8763 -0.8904 0.2237 -0.3963 -0.3472 -0.8969 0.2738 19.231 -30.410 24.446 B 250 ALA A 102 ALA.? B 251 GLY A 80 GLY.? B 252 ASP A 103 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 9 3 RMSD = 1.08 A TRANSFORM 0.0676 -0.6972 0.7137 0.6514 -0.5110 -0.5609 0.7557 0.5028 0.4196 80.921 50.621 24.404 A 316 ALA B 88 ALA.? A 317 GLY B 87 GLY.? A 318 ASP B 109 ASP^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 5 3 RMSD = 1.09 A TRANSFORM 0.8705 0.1719 0.4612 0.4900 -0.3901 -0.7795 0.0460 0.9046 -0.4238 10.551 -19.878 -75.268 A 250 ALA A 102 ALA.? A 251 GLY A 80 GLY.? A 252 ASP A 103 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.09 A TRANSFORM -0.6362 0.7224 0.2708 0.7712 0.6055 0.1965 -0.0220 0.3339 -0.9423 11.692 -75.229 -41.494 A 250 ALA A 64 ALA~? A 251 GLY A 63 GLY~? A 252 ASP A 171 ASP.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 18 3 RMSD = 1.09 A TRANSFORM 0.4895 0.8215 -0.2925 -0.6817 0.5696 0.4591 0.5438 -0.0253 0.8388 -11.130 -130.872 -109.103 A 420 ALA B 170 ALA^? B 182 GLY B 91 GLY~? B 183 GLY B 89 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 9 3 RMSD = 1.10 A TRANSFORM -0.2588 0.9567 -0.1334 -0.8062 -0.2900 -0.5157 -0.5321 -0.0259 0.8463 -9.288 -69.612 -98.053 A 420 ALA A 170 ALA^? B 182 GLY A 91 GLY~? B 183 GLY A 89 GLY.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.10 A TRANSFORM 0.1232 0.7839 -0.6085 0.8117 -0.4324 -0.3927 -0.5710 -0.4455 -0.6896 81.553 7.550 28.656 A 316 ALA A 64 ALA~? A 317 GLY A 63 GLY~? A 318 ASP A 171 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.10 A TRANSFORM -0.0634 -0.6928 0.7184 0.8235 0.3703 0.4298 -0.5638 0.6188 0.5470 79.485 -11.589 32.266 A 316 ALA A 88 ALA.? A 317 GLY A 87 GLY.? A 318 ASP A 109 ASP^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 13 3 RMSD = 1.11 A TRANSFORM 0.8975 0.0006 0.4409 -0.1590 0.9332 0.3223 -0.4113 -0.3594 0.8377 31.680 -87.957 -7.945 B 250 ALA B 102 ALA.? B 251 GLY B 80 GLY.? B 252 ASP B 103 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.11 A TRANSFORM -0.8878 -0.4482 -0.1046 0.4143 -0.6794 -0.6056 0.2004 -0.5810 0.7889 71.884 -8.891 -5.439 B 250 ALA A 64 ALA~? B 251 GLY A 63 GLY~? B 252 ASP A 171 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 13 3 RMSD = 1.11 A TRANSFORM 0.4737 -0.7393 -0.4786 -0.8280 -0.1886 -0.5281 0.3002 0.6464 -0.7015 76.828 -18.603 -64.157 A 250 ALA B 102 ALA.? A 251 GLY B 80 GLY.? A 252 ASP B 103 ASP.? ULMNm 3 2vmg_p00 FIBRONECTIN TYPE III DOMAIN PROTEIN user 2 3 RMSD = 1.11 A TRANSFORM -0.7716 -0.5625 -0.2971 -0.2327 -0.1850 0.9548 -0.5920 0.8058 0.0119 4.722 15.593 -45.126 A 82 HIS B 179 HIS~? A 166 SER B 174 SER.? A 168 HIS B 176 HIS~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 10 3 RMSD = 1.12 A TRANSFORM -0.1033 0.9835 -0.1487 0.9756 0.0710 -0.2078 -0.1938 -0.1665 -0.9668 6.978 -31.291 3.855 A 67 ASP A 180 ASP~? A 68 ALA A 181 ALA~? A 72 LEU A 182 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 30 3 RMSD = 1.13 A TRANSFORM 0.5950 0.4069 -0.6931 0.7098 -0.6705 0.2158 -0.3769 -0.6204 -0.6878 26.235 73.816 29.496 A 67 ASP B 226 ASP~? A 68 ALA B 228 ALA.? A 72 LEU B 229 LEU^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.14 A TRANSFORM 0.8240 0.5567 -0.1048 0.1523 -0.3960 -0.9055 -0.5457 0.7302 -0.4111 -30.398 -17.920 -54.395 A 250 ALA A 79 ALA.? A 251 GLY A 80 GLY.? A 252 ASP A 103 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.14 A TRANSFORM 0.0406 0.4837 0.8743 -0.9718 -0.1842 0.1470 0.2322 -0.8557 0.4626 7.301 13.352 18.334 B 250 ALA A 79 ALA.? B 251 GLY A 80 GLY.? B 252 ASP A 103 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 15 3 RMSD = 1.15 A TRANSFORM 0.2458 0.9664 -0.0748 0.3002 -0.0025 0.9539 0.9217 -0.2569 -0.2908 -3.102 33.373 -8.194 A 67 ASP A 226 ASP~? A 68 ALA A 228 ALA.? A 72 LEU A 229 LEU^? ULMNm 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 1 3 RMSD = 1.15 A TRANSFORM -0.1894 -0.2654 -0.9454 0.9009 0.3360 -0.2748 0.3905 -0.9037 0.1755 41.952 -23.716 74.419 16 ALA A 218 ALA~? 19 HIS A 176 HIS~? 22 HIS A 179 HIS~? ULMNm 3 3nwu_o02 SERINE PROTEASE HTRA1 user 3 3 RMSD = 1.16 A TRANSFORM -0.8779 0.4503 0.1626 0.0622 -0.2295 0.9713 0.4747 0.8629 0.1734 -80.765 81.326 -69.807 C 220 HIS B 207 HIS.? C 250 ASP B 216 ASP~? C 328 SER B 174 SER.? ULMNm 3 3nwu_o00 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.17 A TRANSFORM -0.5230 -0.8511 -0.0450 -0.8372 0.5031 0.2145 -0.1600 0.1499 -0.9757 0.733 13.277 -51.602 A 220 HIS B 207 HIS.? A 250 ASP B 216 ASP~? A 328 SER B 174 SER.? ULMNm 3 3nwu_o01 SERINE PROTEASE HTRA1 user 3 3 RMSD = 1.17 A TRANSFORM 0.0309 -0.1285 0.9912 -0.5770 -0.8120 -0.0872 0.8161 -0.5693 -0.0992 -20.805 93.008 18.553 B 220 HIS B 207 HIS.? B 250 ASP B 216 ASP~? B 328 SER B 174 SER.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 RMSD = 1.17 A TRANSFORM 0.7529 -0.3863 -0.5329 -0.1456 -0.8873 0.4376 -0.6419 -0.2519 -0.7243 -17.047 77.883 -2.075 A 49 ASP A 171 ASP.? A 147 THR A 206 THR.? A 294 ASP A 216 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.18 A TRANSFORM -0.2742 0.8596 -0.4311 -0.9405 -0.3333 -0.0664 -0.2007 0.3872 0.8999 -10.671 26.745 4.322 199 ASP B 180 ASP~? 218 GLU B 76 GLU~? 329 ASP B 226 ASP~? ULMNm 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 2 3 RMSD = 1.18 A TRANSFORM 0.0355 0.7310 0.6815 0.8699 -0.3583 0.3390 0.4919 0.5808 -0.6486 7.149 62.029 -36.664 166 ASP B 216 ASP~? 169 ARG B 215 ARG~? 193 HIS B 207 HIS.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 11 3 RMSD = 1.19 A TRANSFORM -0.7542 0.3192 -0.5738 -0.5017 -0.8439 0.1900 -0.4236 0.4312 0.7966 109.671 67.526 -20.854 A 316 ALA B 88 ALA.? A 317 GLY B 87 GLY.? A 318 ASP B 109 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 8 3 RMSD = 1.19 A TRANSFORM 0.3441 0.6271 0.6988 -0.6983 0.6684 -0.2560 -0.6276 -0.3999 0.6679 7.870 -121.715 -76.936 A 420 ALA A 170 ALA^? B 182 GLY A 89 GLY.? B 183 GLY A 87 GLY.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.19 A TRANSFORM 0.1361 -0.0506 -0.9894 0.3633 -0.9266 0.0973 -0.9217 -0.3727 -0.1078 126.131 60.926 39.295 A 316 ALA A 88 ALA.? A 317 GLY A 87 GLY.? A 318 ASP A 109 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 17 3 RMSD = 1.19 A TRANSFORM 0.9737 -0.1545 -0.1677 0.1704 0.9817 0.0848 0.1515 -0.1111 0.9822 54.193 -155.477 -103.861 A 420 ALA B 170 ALA^? B 182 GLY B 89 GLY.? B 183 GLY B 87 GLY.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 1.20 A TRANSFORM -0.1158 0.6130 -0.7816 -0.8403 -0.4800 -0.2519 -0.5296 0.6276 0.5707 82.774 60.374 -20.184 A 316 ALA A 79 ALA.? A 317 GLY A 80 GLY.? A 318 ASP A 103 ASP.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 11 3 RMSD = 1.21 A TRANSFORM 0.2891 0.8282 -0.4801 -0.1212 -0.4658 -0.8765 -0.9496 0.3116 -0.0343 -28.026 -3.289 -31.117 A 250 ALA B 88 ALA.? A 251 GLY B 87 GLY.? A 252 ASP B 109 ASP^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.21 A TRANSFORM -0.1597 0.9055 -0.3931 0.9467 0.0277 -0.3209 -0.2797 -0.4234 -0.8617 -25.451 -48.868 11.849 A 250 ALA A 88 ALA.? A 251 GLY A 87 GLY.? A 252 ASP A 109 ASP^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 11 3 RMSD = 1.22 A TRANSFORM 0.2125 0.6199 0.7553 -0.5554 -0.5593 0.6153 0.8040 -0.5503 0.2255 -7.045 16.004 -5.034 B 250 ALA B 88 ALA.? B 251 GLY B 87 GLY.? B 252 ASP B 109 ASP^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.23 A TRANSFORM -0.9487 0.1799 0.2600 -0.1463 -0.9788 0.1432 0.2802 0.0978 0.9549 36.529 37.544 -44.637 B 250 ALA A 88 ALA.? B 251 GLY A 87 GLY.? B 252 ASP A 109 ASP^? ULMNm 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 RMSD = 1.23 A TRANSFORM 0.1960 -0.9491 -0.2466 -0.6592 0.0587 -0.7497 0.7260 0.3095 -0.6141 133.805 16.856 -8.996 255 ASP B 196 ASP.? 262 LYS B 81 LYS.? 336 ARG B 261 ARG^? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 RMSD = 1.23 A TRANSFORM -0.4815 0.3211 0.8155 0.8430 0.4241 0.3308 -0.2397 0.8468 -0.4749 4.671 20.360 -19.667 B 1 SER B 118 SER~? B 69 ALA B 90 ALA.? B 241 ASN B 122 ASN~? ULMNm 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 RMSD = 1.24 A TRANSFORM 0.8407 -0.3594 0.4050 0.3960 -0.1020 -0.9126 0.3693 0.9276 0.0566 82.908 16.115 -46.092 255 ASP A 196 ASP.? 262 LYS A 81 LYS.? 336 ARG A 261 ARG^? ULMNm 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 3 3 RMSD = 1.24 A TRANSFORM -0.8655 -0.4930 0.0883 0.2326 -0.2396 0.9426 -0.4436 0.8364 0.3221 28.644 46.763 -20.930 18 ARG B 215 ARG~? 195 HIS B 207 HIS.? 199 ASP B 216 ASP~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.25 A TRANSFORM 0.2176 0.7895 -0.5739 0.3123 -0.6134 -0.7254 -0.9247 -0.0214 -0.3800 -63.139 2.477 170.324 C 70 ALA A 68 ALA~? C 126 LEU A 67 LEU~? C 158 GLU A 85 GLU^? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.25 A TRANSFORM 0.6306 0.7749 -0.0438 -0.0811 0.0097 -0.9967 -0.7718 0.6321 0.0690 -62.217 -28.413 137.425 C 70 ALA A 64 ALA~? C 126 LEU A 67 LEU~? C 158 GLU A 85 GLU^? ULMNm 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 3 3 RMSD = 1.25 A TRANSFORM -0.8523 0.4520 -0.2633 0.1455 -0.2786 -0.9493 -0.5024 -0.8474 0.1717 1.057 27.190 80.588 16 ALA B 218 ALA~? 19 HIS B 176 HIS~? 22 HIS B 179 HIS~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.25 A TRANSFORM -0.2655 0.4935 -0.8282 0.2064 -0.8100 -0.5489 -0.9418 -0.3166 0.1132 15.480 44.837 59.300 199 ASP A 180 ASP~? 218 GLU A 76 GLU~? 329 ASP A 226 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 18 3 RMSD = 1.25 A TRANSFORM -0.7656 -0.4842 0.4236 -0.6142 0.3542 -0.7052 0.1914 -0.8001 -0.5686 88.108 -39.245 51.821 A 67 ASP B 69 ASP~? A 68 ALA B 68 ALA~? A 72 LEU B 67 LEU~? ULMNm 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 2 3 RMSD = 1.26 A TRANSFORM 0.3769 0.7516 -0.5414 -0.8596 0.5015 0.0978 0.3450 0.4285 0.8351 -40.800 -36.192 31.504 150 ASP B 216 ASP~? 153 ARG B 215 ARG~? 177 HIS B 207 HIS.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.26 A TRANSFORM -0.4589 0.1340 0.8783 0.0040 0.9889 -0.1488 -0.8885 -0.0647 -0.4543 23.151 -29.983 168.936 A 70 ALA A 68 ALA~? A 126 LEU A 67 LEU~? A 158 GLU A 85 GLU^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.28 A TRANSFORM -0.1154 -0.9893 -0.0898 0.1927 0.0664 -0.9790 0.9745 -0.1303 0.1830 114.730 -27.312 -4.362 A 67 ASP A 69 ASP~? A 68 ALA A 68 ALA~? A 72 LEU A 67 LEU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.28 A TRANSFORM -0.3145 -0.3385 0.8869 0.5619 0.6866 0.4613 -0.7651 0.6434 -0.0257 46.493 -14.790 133.261 A 70 ALA A 64 ALA~? A 126 LEU A 67 LEU~? A 158 GLU A 85 GLU^? ULMNm 3 2odj_o01 PORIN D user 3 3 RMSD = 1.29 A TRANSFORM 0.8286 -0.1824 -0.5294 -0.2121 -0.9772 0.0047 -0.5182 0.1084 -0.8484 -38.473 42.335 67.739 B 156 HIS A 179 HIS~? B 208 ASP A 171 ASP.? B 296 SER A 154 SER~? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.29 A TRANSFORM 0.6098 -0.2252 -0.7599 0.6411 -0.4235 0.6400 -0.4659 -0.8775 -0.1139 3.687 130.132 82.933 C 137 ARG B 263 ARG^? C 141 THR B 198 THR.? C 235 ASP B 226 ASP~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.30 A TRANSFORM -0.8956 -0.4139 -0.1634 -0.4163 0.6496 0.6362 -0.1571 0.6377 -0.7541 59.403 19.854 -3.906 B 1 SER A 118 SER~? B 69 ALA A 90 ALA.? B 241 ASN A 122 ASN~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 11 3 RMSD = 1.32 A TRANSFORM -0.4837 -0.8517 0.2017 0.8378 -0.5172 -0.1748 0.2532 0.0844 0.9637 91.344 -70.931 -115.077 A 420 ALA B 64 ALA~? B 182 GLY B 89 GLY.? B 183 GLY B 91 GLY~? ULMNm 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 2 3 RMSD = 1.32 A TRANSFORM 0.1728 0.9598 0.2210 -0.9513 0.2208 -0.2150 -0.2552 -0.1731 0.9513 -69.981 42.663 88.906 A 197 ARG A 221 ARG~? A 201 HIS A 207 HIS.? A 204 HIS A 258 HIS^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 28 3 RMSD = 1.33 A TRANSFORM -0.5863 -0.7905 0.1771 0.1700 0.0937 0.9810 -0.7920 0.6053 0.0794 98.517 23.830 -42.326 A 67 ASP B 196 ASP.? A 68 ALA B 199 ALA.? A 72 LEU B 190 LEU~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.33 A TRANSFORM -0.1374 -0.4381 -0.8884 0.8084 -0.5679 0.1550 -0.5724 -0.6969 0.4322 52.929 -92.708 -66.184 A 420 ALA A 64 ALA~? B 182 GLY A 87 GLY.? B 183 GLY A 89 GLY.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 13 3 RMSD = 1.33 A TRANSFORM 0.2984 -0.9515 0.0751 -0.6283 -0.1366 0.7659 -0.7184 -0.2758 -0.6386 99.143 53.988 24.456 A 67 ASP A 196 ASP.? A 68 ALA A 199 ALA.? A 72 LEU A 190 LEU~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.33 A TRANSFORM -0.7966 -0.5950 -0.1069 0.0087 -0.1882 0.9821 -0.6044 0.7814 0.1551 20.065 63.865 24.717 A 241 ASP B 180 ASP~? A 265 GLU B 214 GLU~? A 369 ASP B 226 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.33 A TRANSFORM 0.3398 -0.9353 0.0990 0.6012 0.2970 0.7418 -0.7232 -0.1926 0.6632 85.165 -125.802 -85.939 A 420 ALA A 64 ALA~? B 182 GLY A 89 GLY.? B 183 GLY A 91 GLY~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 12 3 RMSD = 1.33 A TRANSFORM -0.2534 -0.9646 -0.0728 0.6679 -0.2289 0.7082 -0.6998 0.1308 0.7023 79.331 60.638 44.433 A 316 ALA B 170 ALA^? A 317 GLY B 63 GLY~? A 318 ASP B 171 ASP.? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.33 A TRANSFORM 0.0573 0.8504 -0.5231 0.4971 0.4301 0.7536 0.8658 -0.3032 -0.3981 -6.427 45.321 72.834 C 202 HIS B 211 HIS.? C 295 HIS B 258 HIS^? C 296 HIS B 207 HIS.? ULMNm 3 5cox_c07 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.34 A TRANSFORM -0.7261 0.1706 -0.6660 0.4386 0.8610 -0.2576 0.5295 -0.4792 -0.7000 16.612 -31.302 66.474 D 203 GLN A 46 GLN^? D 207 HIS A 126 HIS.? D 385 TYR A 33 TYR^? ULMNm 3 1lio_c01 ADENOSINE KINASE user 6 3 RMSD = 1.34 A TRANSFORM -0.7159 -0.0687 0.6948 -0.1053 -0.9731 -0.2047 0.6902 -0.2197 0.6894 80.880 59.290 54.556 A 316 ALA A 225 ALA~? A 317 GLY A 227 GLY.? A 318 ASP A 226 ASP~? ULMNm 3 5cox_c05 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.34 A TRANSFORM 0.7571 -0.1382 0.6385 -0.3834 -0.8854 0.2629 0.5290 -0.4439 -0.7233 64.002 99.616 3.345 B 203 GLN A 46 GLN^? B 207 HIS A 126 HIS.? B 385 TYR A 33 TYR^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 10 3 RMSD = 1.34 A TRANSFORM -0.9580 0.2222 -0.1812 -0.1685 -0.9476 -0.2714 -0.2320 -0.2295 0.9453 16.390 -53.697 -100.537 A 420 ALA B 64 ALA~? B 182 GLY B 87 GLY.? B 183 GLY B 89 GLY.? ULMNm 3 5cox_c04 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.35 A TRANSFORM -0.7686 0.1431 -0.6235 -0.5087 0.4544 0.7313 0.3880 0.8792 -0.2764 31.559 27.270 -68.483 A 203 GLN A 46 GLN^? A 207 HIS A 126 HIS.? A 385 TYR A 33 TYR^? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.35 A TRANSFORM -0.5995 0.2388 0.7639 -0.6487 0.4139 -0.6386 -0.4687 -0.8784 -0.0932 -4.211 31.527 83.344 A 137 ARG B 263 ARG^? A 141 THR B 198 THR.? A 235 ASP B 226 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 RMSD = 1.35 A TRANSFORM 0.2187 -0.8898 -0.4006 -0.7713 0.0939 -0.6295 0.5978 0.4467 -0.6657 79.380 -7.854 -42.340 A 67 ASP A 196 ASP.? A 68 ALA A 191 ALA.? A 72 LEU A 192 LEU.? ULMNm 3 5cox_c06 CYCLOOXYGENASE-2 user 1 3 RMSD = 1.35 A TRANSFORM 0.8026 -0.1409 0.5796 0.4832 -0.4160 -0.7703 0.3497 0.8984 -0.2658 50.625 36.963 -8.860 C 203 GLN A 46 GLN^? C 207 HIS A 126 HIS.? C 385 TYR A 33 TYR^? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.35 A TRANSFORM 0.2381 0.1469 -0.9601 0.2358 -0.9677 -0.0896 -0.9422 -0.2050 -0.2650 1.301 76.374 47.706 A 229 ALA A 68 ALA~? A 257 ALA A 66 ALA~? A 328 ASP A 171 ASP.? ULMNm 3 1lci_c00 LUCIFERASE user 4 3 RMSD = 1.36 A TRANSFORM -0.9896 -0.0174 -0.1428 -0.0193 0.9997 0.0114 0.1426 0.0140 -0.9897 -5.324 40.216 13.321 218 ARG B 215 ARG~? 245 HIS B 208 HIS.? 343 THR B 206 THR^? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.36 A TRANSFORM -0.0564 -0.8527 0.5193 0.1559 0.5062 0.8482 -0.9862 0.1288 0.1044 82.582 39.648 40.649 B 202 HIS B 211 HIS.? B 295 HIS B 258 HIS^? B 296 HIS B 207 HIS.? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.37 A TRANSFORM -0.9385 0.0733 0.3375 0.3300 0.4777 0.8142 -0.1015 0.8755 -0.4725 57.650 132.549 -14.491 D 202 HIS B 211 HIS.? D 295 HIS B 258 HIS^? D 296 HIS B 207 HIS.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 27 3 RMSD = 1.37 A TRANSFORM -0.8677 -0.4934 0.0599 -0.4856 0.8673 0.1092 -0.1059 0.0657 -0.9922 67.266 -67.353 -9.249 A 67 ASP B 196 ASP.? A 68 ALA B 191 ALA.? A 72 LEU B 192 LEU.? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.37 A TRANSFORM 0.9210 -0.3495 -0.1720 -0.3325 -0.4753 -0.8146 0.2030 0.8074 -0.5540 89.583 46.246 -9.211 A 202 HIS B 211 HIS.? A 295 HIS B 258 HIS^? A 296 HIS B 207 HIS.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 3 3 RMSD = 1.38 A TRANSFORM -0.1628 -0.9441 0.2867 -0.7332 0.3102 0.6051 -0.6602 -0.1117 -0.7427 88.888 36.600 53.352 A 316 ALA A 88 ALA.? A 317 GLY A 89 GLY.? A 318 ASP A 109 ASP^? ULMNm 3 2odj_o01 PORIN D user 8 3 RMSD = 1.38 A TRANSFORM -0.4822 -0.4298 -0.7634 -0.6628 -0.3909 0.6387 -0.5729 0.8139 -0.0964 -7.796 11.490 19.758 B 156 HIS B 179 HIS~? B 208 ASP B 171 ASP.? B 296 SER B 154 SER~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 10 3 RMSD = 1.38 A TRANSFORM -0.4221 -0.5942 0.6846 0.5567 0.4261 0.7131 -0.7155 0.6821 0.1510 70.577 13.821 -2.112 A 316 ALA B 88 ALA.? A 317 GLY B 89 GLY.? A 318 ASP B 109 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.39 A TRANSFORM 0.2380 0.6143 0.7523 -0.5211 -0.5729 0.6327 0.8196 -0.5426 0.1837 12.455 -45.932 -119.451 A 420 ALA A 107 ALA^? B 182 GLY A 89 GLY.? B 183 GLY A 87 GLY.? ULMNm 3 2cpu_c01 ALPHA-AMYLASE user 2 3 RMSD = 1.39 A TRANSFORM -0.8671 0.4951 -0.0544 0.3995 0.6263 -0.6695 -0.2974 -0.6022 -0.7409 -18.508 -16.905 71.468 A 197 ASP B 112 ASP~? A 233 GLU B 114 GLU~? A 300 ASN B 117 ASN~? ULMNm 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 RMSD = 1.40 A TRANSFORM 0.4963 0.1598 -0.8534 0.7767 -0.5209 0.3542 -0.3879 -0.8385 -0.3826 113.308 81.395 62.556 142 TRP B 148 TRP.? 223 ASP B 109 ASP^? 258 ALA B 64 ALA~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 17 3 RMSD = 1.40 A TRANSFORM -0.2739 -0.5398 -0.7960 0.0101 0.8260 -0.5636 0.9617 -0.1624 -0.2208 54.878 -62.551 24.157 A 67 ASP B 69 ASP~? A 68 ALA B 66 ALA~? A 72 LEU B 238 LEU^? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 1 3 RMSD = 1.40 A TRANSFORM -0.7925 0.0964 0.6022 0.0831 0.9953 -0.0501 -0.6042 0.0104 -0.7968 37.524 -58.337 -3.393 14 ASP A 216 ASP.? 16 HIS A 176 HIS~? 67 GLY A 89 GLY.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 6 3 RMSD = 1.40 A TRANSFORM 0.5170 0.5659 0.6422 -0.2064 -0.6458 0.7351 0.8308 -0.5126 -0.2171 -6.955 46.587 25.713 14 ASP B 216 ASP~? 16 HIS B 258 HIS^? 67 GLY B 87 GLY.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.40 A TRANSFORM -0.4925 -0.5607 -0.6656 -0.8555 0.4525 0.2519 0.1599 0.6934 -0.7026 86.692 14.255 -50.033 A 67 ASP A 69 ASP~? A 68 ALA A 66 ALA~? A 72 LEU A 67 LEU~? ULMNm 3 1j70_c00 ATP SULPHURYLASE user 2 3 RMSD = 1.41 A TRANSFORM 0.5349 0.7925 0.2930 -0.8019 0.5854 -0.1195 -0.2663 -0.1710 0.9486 -80.504 144.668 39.811 A 197 ARG A 221 ARG~? A 201 HIS A 207 HIS.? A 204 HIS A 258 HIS^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 RMSD = 1.42 A TRANSFORM -0.6336 -0.5128 -0.5793 -0.0381 0.7685 -0.6387 0.7727 -0.3827 -0.5064 90.574 -58.019 4.118 A 67 ASP A 69 ASP~? A 68 ALA A 68 ALA~? A 72 LEU A 71 LEU~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 19 3 RMSD = 1.42 A TRANSFORM -0.8724 0.3577 0.3332 0.0788 0.7756 -0.6263 -0.4825 -0.5201 -0.7048 31.770 -61.561 28.141 A 67 ASP B 69 ASP~? A 68 ALA B 68 ALA~? A 72 LEU B 71 LEU~? ULMNm 3 1j70_c02 ATP SULPHURYLASE user 2 3 RMSD = 1.42 A TRANSFORM -0.9132 -0.2710 -0.3044 0.3140 -0.9439 -0.1018 -0.2597 -0.1886 0.9471 70.685 39.453 67.063 C 197 ARG A 221 ARG~? C 201 HIS A 207 HIS.? C 204 HIS A 258 HIS^? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 RMSD = 1.42 A TRANSFORM -0.2031 0.3896 -0.8983 -0.8060 0.4543 0.3793 0.5559 0.8011 0.2218 -24.795 -20.364 -25.845 A 16 TYR B 146 TYR.? A 40 ASP B 153 ASP~? A 103 LEU B 155 LEU~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 7 3 RMSD = 1.42 A TRANSFORM 0.6897 0.4913 0.5319 -0.0785 -0.6795 0.7295 0.7198 -0.5449 -0.4300 -4.589 50.062 18.316 14 ASP B 216 ASP~? 16 HIS B 258 HIS^? 67 GLY B 89 GLY.? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 1.43 A TRANSFORM -0.9233 0.3529 -0.1513 -0.2484 -0.8494 -0.4657 -0.2929 -0.3925 0.8719 1.200 96.900 70.886 179 ASP A 150 ASP.? 214 ASP B 112 ASP~? 289 ASP A 153 ASP~? ULMNm 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 RMSD = 1.44 A TRANSFORM 0.5769 0.8027 -0.1509 0.1403 0.0846 0.9865 0.8046 -0.5903 -0.0638 70.051 47.018 31.152 142 TRP A 148 TRP.? 223 ASP A 109 ASP^? 258 ALA A 64 ALA~? ULMNm 3 1opm_c00 1.14.17.0003 user 2 3 RMSD = 1.44 A TRANSFORM 0.4413 0.1168 -0.8897 0.2876 0.9208 0.2635 0.8500 -0.3722 0.3728 5.208 -1.746 86.382 A 108 HIS B 258 HIS^? A 170 GLN B 256 GLN.? A 242 HIS B 211 HIS.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 1.45 A TRANSFORM 0.1823 -0.9825 0.0379 0.3756 0.0339 -0.9262 0.9087 0.1831 0.3752 91.597 -128.263 -159.104 A 420 ALA A 107 ALA^? B 182 GLY A 89 GLY.? B 183 GLY A 91 GLY~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 14 3 RMSD = 1.45 A TRANSFORM 0.4049 0.6540 -0.6390 0.3563 -0.7564 -0.5485 -0.8421 -0.0055 -0.5393 94.250 52.256 -25.204 A 316 ALA B 170 ALA^? A 317 GLY B 63 GLY~? A 318 ASP B 171 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 5 3 RMSD = 1.45 A TRANSFORM 0.6451 -0.6648 0.3768 -0.3274 0.2050 0.9224 -0.6904 -0.7184 -0.0854 51.562 43.405 104.200 A 316 ALA A 170 ALA^? A 317 GLY A 63 GLY~? A 318 ASP A 171 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 16 3 RMSD = 1.46 A TRANSFORM -0.9295 0.2935 0.2232 0.3686 0.7221 0.5854 0.0106 0.6265 -0.7794 32.295 -18.944 -45.377 A 67 ASP B 69 ASP~? A 68 ALA B 66 ALA~? A 72 LEU B 67 LEU~? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.46 A TRANSFORM -0.8201 -0.2425 -0.5183 -0.5128 0.7133 0.4778 0.2538 0.6576 -0.7093 9.324 37.744 -86.716 B 603 HIS A 207 HIS.? B 646 ASP A 216 ASP.? B 739 GLY A 63 GLY~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 RMSD = 1.47 A TRANSFORM -0.2106 0.5285 -0.8224 -0.4527 0.6929 0.5612 0.8664 0.4905 0.0933 43.580 21.384 96.870 A 50 ASP B 109 ASP^? A 327 GLU A 31 GLU^? A 339 ARG A 65 ARG~? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 RMSD = 1.47 A TRANSFORM 0.3374 -0.7498 0.5692 0.6644 0.6180 0.4202 -0.6668 0.2364 0.7067 30.450 16.951 62.195 A 53 SER A 151 SER.? A 54 PRO A 152 PRO~? A 96 ASP A 150 ASP.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 14 3 RMSD = 1.47 A TRANSFORM -0.9888 0.0963 0.1143 -0.1482 -0.7324 -0.6645 0.0197 -0.6740 0.7385 3.950 2.351 9.362 B 250 ALA B 170 ALA^? B 251 GLY B 63 GLY~? B 252 ASP B 171 ASP.? ULMNm 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 RMSD = 1.47 A TRANSFORM 0.2391 -0.1855 0.9531 0.7516 0.6568 -0.0608 -0.6148 0.7309 0.2964 74.559 -33.618 -19.018 A 94 GLU A 85 GLU^? A 198 CYH A 158 CYH~? A 206 CYH B 43 CYH.? ULMNm 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 RMSD = 1.47 A TRANSFORM 0.2391 -0.1855 0.9531 0.7516 0.6568 -0.0608 -0.6148 0.7309 0.2964 74.559 -33.618 -19.018 A 94 GLU A 85 GLU^? A 198 CYH A 158 CYH~? A 206 CYH B 43 CYH.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 14 3 RMSD = 1.47 A TRANSFORM 0.9846 -0.1671 -0.0509 -0.0034 -0.3093 0.9510 -0.1746 -0.9362 -0.3051 56.815 -68.875 -80.519 A 420 ALA B 107 ALA^? B 182 GLY B 89 GLY.? B 183 GLY B 87 GLY.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.47 A TRANSFORM -0.9067 0.2102 -0.3658 0.1391 0.9675 0.2112 0.3983 0.1406 -0.9064 -47.957 -50.079 -72.253 A 114 HIS A 179 HIS~? A 197 ASP A 180 ASP~? A 223 ALA A 225 ALA~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 RMSD = 1.48 A TRANSFORM -0.3268 0.2425 -0.9135 0.7943 -0.4533 -0.4045 -0.5122 -0.8577 -0.0445 -15.999 56.164 79.895 B 16 TYR B 146 TYR.? B 40 ASP B 153 ASP~? B 103 LEU B 155 LEU~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.48 A TRANSFORM -0.3888 0.9204 0.0403 -0.5038 -0.1758 -0.8458 -0.7714 -0.3492 0.5320 -1.082 -89.658 -77.458 A 420 ALA A 64 ALA~? B 182 GLY A 91 GLY~? B 183 GLY A 89 GLY.? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 RMSD = 1.48 A TRANSFORM -0.7027 -0.6631 0.2581 -0.7111 0.6666 -0.2236 -0.0238 -0.3406 -0.9399 65.194 -5.534 36.349 54 ASP A 171 ASP.? 158 THR A 204 THR^? 317 ASP A 69 ASP~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.48 A TRANSFORM 0.9121 -0.2091 0.3525 -0.1993 -0.9778 -0.0644 0.3582 -0.0115 -0.9336 -46.539 54.328 -63.882 B 114 HIS A 179 HIS~? B 197 ASP A 180 ASP~? B 223 ALA A 225 ALA~? ULMNm 3 1j70_c01 ATP SULPHURYLASE user 2 3 RMSD = 1.48 A TRANSFORM -0.1531 0.9782 0.1402 0.9470 0.1047 0.3037 0.2824 0.1792 -0.9424 -50.951 70.952 -24.219 B 197 ARG A 221 ARG~? B 201 HIS A 207 HIS.? B 204 HIS A 258 HIS^? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 RMSD = 1.48 A TRANSFORM -0.1756 -0.9786 0.1076 -0.6607 0.1981 0.7240 -0.7298 0.0561 -0.6813 44.639 23.241 -39.624 B 8 HIS A 126 HIS.? B 80 GLU A 125 GLU~? B 223 ARG B 65 ARG~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 14 3 RMSD = 1.48 A TRANSFORM -0.0847 0.9176 0.3883 0.9956 0.0937 -0.0041 -0.0402 0.3862 -0.9215 -18.033 -12.198 -49.533 A 250 ALA B 170 ALA^? A 251 GLY B 63 GLY~? A 252 ASP B 171 ASP.? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 5 3 RMSD = 1.48 A TRANSFORM -0.1222 -0.4008 -0.9080 -0.9173 0.3950 -0.0509 0.3790 0.8267 -0.4159 17.126 -1.457 15.089 A 223 HIS B 258 HIS^? A 262 HIS B 211 HIS.? A 312 ASP B 216 ASP~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 5 3 RMSD = 1.49 A TRANSFORM -0.1342 0.2586 -0.9566 0.8681 -0.4348 -0.2394 -0.4779 -0.8626 -0.1661 -26.591 58.176 125.552 B 223 HIS B 258 HIS^? B 262 HIS B 211 HIS.? B 312 ASP B 216 ASP~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 4 3 RMSD = 1.50 A TRANSFORM -0.4034 -0.9042 0.1401 0.0697 0.1223 0.9900 -0.9123 0.4092 0.0137 59.973 26.825 -33.989 274 HIS B 258 HIS^? 320 HIS B 211 HIS.? 375 ASP B 216 ASP~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 RMSD = 1.50 A TRANSFORM -0.8540 0.2611 -0.4500 -0.3251 -0.9431 0.0696 -0.4062 0.2057 0.8903 1.988 109.117 78.629 A 50 GLN B 74 GLN~? A 91 LEU B 71 LEU~? A 133 GLU B 76 GLU~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 3 3 RMSD = 1.50 A TRANSFORM 0.4452 -0.0940 -0.8905 0.2895 0.9562 0.0439 0.8473 -0.2773 0.4529 -11.013 -50.137 26.362 A 271 PRO A 152 PRO~? A 272 LEU A 155 LEU~? A 276 ARG A 157 ARG~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.50 A TRANSFORM 0.4790 -0.7419 0.4693 0.8590 0.2861 -0.4245 0.1807 0.6065 0.7743 46.285 -7.460 -22.757 A 603 HIS A 207 HIS.? A 646 ASP A 216 ASP.? A 739 GLY A 63 GLY~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 7 3 RMSD = 1.50 A TRANSFORM 0.4131 -0.5711 0.7094 0.2168 0.8182 0.5325 -0.8845 -0.0662 0.4618 69.346 2.977 85.711 A 316 ALA A 228 ALA.? A 317 GLY A 227 GLY.? A 318 ASP A 226 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 RMSD = 1.50 A TRANSFORM 0.6122 -0.3568 0.7057 0.7865 0.3673 -0.4966 -0.0820 0.8590 0.5054 81.328 -46.850 -11.979 A 67 ASP A 196 ASP.? A 68 ALA A 191 ALA.? A 72 LEU A 190 LEU~?