*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 2 3 RMSD = 0.69 A TRANSFORM -0.3206 0.2065 -0.9244 -0.3404 -0.9359 -0.0910 -0.8839 0.2855 0.3703 24.178 40.816 -10.428 A 66 HIS A 49 HIS.? A 110 GLY A 50 GLY.? A 140 TYR A 78 TYR.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 0.78 A TRANSFORM -0.8882 0.1596 0.4307 -0.4440 -0.5391 -0.7157 0.1180 -0.8269 0.5498 -7.546 -33.281 -105.997 A 183 GLY B 63 GLY.? B 419 GLY B 86 GLY.? B 420 ALA B 89 ALA.? ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 5 3 RMSD = 0.80 A TRANSFORM 0.3186 -0.0927 0.9433 -0.6006 -0.7897 0.1253 0.7333 -0.6065 -0.3073 24.983 30.968 43.002 A 66 HIS B 49 HIS.? A 110 GLY B 50 GLY.? A 140 TYR B 78 TYR.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 0.86 A TRANSFORM 0.3974 0.5158 0.7590 -0.9168 0.2578 0.3048 -0.0385 -0.8170 0.5753 -8.840 -103.050 -110.128 A 183 GLY B 63 GLY.? B 419 GLY B 85 GLY.? B 420 ALA B 89 ALA.? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.04 A TRANSFORM -0.4663 0.8846 0.0059 0.8843 0.4660 0.0285 0.0224 0.0185 -0.9996 -25.834 -0.851 20.745 A 317 GLU A 37 GLU^? A 319 ASP A 21 ASP^? A 359 ARG A 23 ARG.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.04 A TRANSFORM -0.2531 0.7060 -0.6615 0.7025 -0.3360 -0.6273 -0.6651 -0.6235 -0.4109 -2.335 -63.235 -112.719 A 183 GLY A 63 GLY~? B 419 GLY A 85 GLY~? B 420 ALA A 89 ALA~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.05 A TRANSFORM -0.4398 -0.1619 0.8834 0.7989 -0.5200 0.3024 0.4103 0.8387 0.3581 -5.981 28.254 -38.249 141 ASP B 21 ASP^? 166 GLY A 47 GLY.? 169 GLU A 42 GLU~? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 2 3 RMSD = 1.05 A TRANSFORM -0.8736 -0.3962 0.2827 0.0387 0.5226 0.8517 -0.4852 0.7550 -0.4412 7.098 -18.250 1.143 C 66 HIS A 49 HIS.? C 110 GLY A 50 GLY.? C 140 TYR A 78 TYR.? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 2 3 RMSD = 1.08 A TRANSFORM -0.3342 0.9027 0.2711 0.3016 0.3750 -0.8766 -0.8929 -0.2112 -0.3976 -23.717 31.960 23.455 B 66 HIS A 49 HIS.? B 110 GLY A 50 GLY.? B 140 TYR A 78 TYR.? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 5 3 RMSD = 1.17 A TRANSFORM 0.1517 -0.9679 -0.2004 0.4475 0.2481 -0.8592 0.8813 0.0406 0.4708 41.562 10.559 32.172 C 66 HIS B 49 HIS.? C 110 GLY B 50 GLY.? C 140 TYR B 78 TYR.? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 5 3 RMSD = 1.19 A TRANSFORM 0.9488 0.1871 -0.2543 0.1206 0.5297 0.8395 0.2918 -0.8273 0.4801 19.131 9.793 49.237 B 66 HIS B 49 HIS.? B 110 GLY B 50 GLY.? B 140 TYR B 78 TYR.? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 RMSD = 1.20 A TRANSFORM -0.0262 -0.8845 0.4658 -0.6722 -0.3293 -0.6631 0.7399 -0.3305 -0.5859 92.744 22.522 9.447 A 261 GLY A 85 GLY~? B 17 GLN A 67 GLN~? B 140 GLU A 84 GLU.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.23 A TRANSFORM 0.7119 -0.6049 -0.3567 0.5624 0.7953 -0.2263 0.4206 -0.0395 0.9064 119.052 85.015 145.504 B 141 GLY A 50 GLY.? B 144 GLU B 37 GLU^? B 164 GLU A 37 GLU^? ULMNm 3 1hwt_d00 GENE REGULATION/DNA user 3 3 RMSD = 1.25 A TRANSFORM 0.3779 -0.6027 0.7028 -0.1345 -0.7868 -0.6024 0.9161 0.1331 -0.3783 44.459 67.767 53.418 C 70 ARG B 2 ARG.? C 71 LYS B 3 LYS^? C 72 VAL B 4 VAL^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.27 A TRANSFORM 0.0106 0.1976 -0.9802 -0.2882 -0.9381 -0.1922 -0.9575 0.2845 0.0470 88.208 120.864 118.586 D 141 GLY A 50 GLY.? D 144 GLU B 37 GLU^? D 164 GLU A 37 GLU^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.28 A TRANSFORM -0.6277 0.6072 0.4871 -0.5719 -0.7843 0.2407 0.5282 -0.1275 0.8395 25.660 99.449 152.784 F 141 GLY A 50 GLY.? F 144 GLU B 37 GLU^? F 164 GLU A 37 GLU^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.29 A TRANSFORM -0.1944 -0.1478 0.9697 0.3168 0.9261 0.2047 -0.9283 0.3470 -0.1332 51.935 64.778 120.943 C 141 GLY A 50 GLY.? C 144 GLU B 37 GLU^? C 164 GLU A 37 GLU^? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 4 3 RMSD = 1.29 A TRANSFORM -0.7201 -0.5008 -0.4802 0.0912 -0.7544 0.6500 -0.6878 0.4243 0.5890 81.330 34.300 -41.020 A 261 GLY B 85 GLY.? B 17 GLN B 67 GLN~? B 140 GLU B 84 GLU.? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.30 A TRANSFORM 0.9152 0.0580 0.3988 -0.0517 -0.9645 0.2589 0.3997 -0.2575 -0.8797 85.503 118.177 191.094 E 141 GLY A 50 GLY.? E 144 GLU B 37 GLU^? E 164 GLU A 37 GLU^? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 3 3 RMSD = 1.30 A TRANSFORM 0.9975 -0.0089 -0.0708 0.0054 0.9987 -0.0501 0.0711 0.0496 0.9962 21.682 -27.377 2.854 A 317 GLU B 37 GLU^? A 319 ASP B 21 ASP^? A 359 ARG B 23 ARG.? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.32 A TRANSFORM 0.0731 -0.0993 0.9924 0.7218 0.6919 0.0161 -0.6882 0.7151 0.1223 9.994 -10.483 5.820 B 317 GLU A 37 GLU^? B 319 ASP A 21 ASP^? B 359 ARG A 23 ARG.? ULMNm 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 3 3 RMSD = 1.33 A TRANSFORM -0.7123 -0.6910 -0.1230 -0.5698 0.6716 -0.4736 0.4098 -0.2672 -0.8721 52.084 24.842 68.065 A 232 HIS B 49 HIS.? A 262 GLU A 37 GLU^? A 358 GLU B 37 GLU^? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 1.34 A TRANSFORM 0.0966 0.7317 -0.6747 -0.4503 -0.5724 -0.6852 -0.8876 0.3700 0.2742 -11.574 48.546 9.961 A 156 HIS A 49 HIS.? A 208 ASP A 21 ASP^? A 296 SER B 66 SER~? ULMNm 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 RMSD = 1.36 A TRANSFORM -0.1202 -0.9890 -0.0867 0.8728 -0.1469 0.4655 -0.4731 -0.0197 0.8808 67.936 60.393 37.613 A 232 HIS A 49 HIS.? A 262 GLU B 37 GLU^? A 358 GLU A 37 GLU^? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 7 3 RMSD = 1.37 A TRANSFORM -0.6958 0.0621 -0.7155 -0.5586 -0.6730 0.4848 -0.4514 0.7370 0.5030 9.747 15.661 121.452 C 70 ALA A 69 ALA~? C 126 LEU A 73 LEU~? C 158 GLU A 76 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 15 3 RMSD = 1.37 A TRANSFORM 0.5214 -0.4729 0.7103 -0.1872 -0.8755 -0.4455 0.8325 0.0994 -0.5450 28.417 35.131 163.950 C 70 ALA B 69 ALA~? C 126 LEU B 73 LEU~? C 158 GLU B 76 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.37 A TRANSFORM -0.1457 -0.5984 0.7878 0.8498 0.3321 0.4094 -0.5066 0.7291 0.4602 -17.797 -12.290 123.255 B 70 ALA A 69 ALA~? B 126 LEU A 73 LEU~? B 158 GLU A 76 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 12 3 RMSD = 1.37 A TRANSFORM -0.4058 -0.5191 -0.7522 -0.3005 0.8531 -0.4266 0.8631 0.0529 -0.5022 -9.418 -35.316 167.242 B 70 ALA B 69 ALA~? B 126 LEU B 73 LEU~? B 158 GLU B 76 GLU~? ULMNm 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.38 A TRANSFORM 0.0200 -0.8823 0.4703 0.3453 0.4475 0.8249 -0.9383 0.1459 0.3136 108.734 26.214 24.728 A 581 GLU A 61 GLU.? A 596 ARG A 23 ARG.? A 647 ARG A 28 ARG.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.38 A TRANSFORM -0.9605 0.1242 0.2489 0.2173 0.8938 0.3923 -0.1737 0.4309 -0.8855 73.068 73.673 136.981 B 141 GLY B 50 GLY.? B 144 GLU A 37 GLU^? B 164 GLU B 37 GLU^? ULMNm 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.39 A TRANSFORM 0.5407 0.1365 -0.8301 0.8313 -0.2381 0.5023 -0.1290 -0.9616 -0.2422 23.897 75.135 103.787 B 581 GLU A 61 GLU.? B 596 ARG A 23 ARG.? B 647 ARG A 28 ARG.? ULMNm 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.39 A TRANSFORM 0.0115 0.8867 -0.4622 -0.0537 -0.4610 -0.8857 -0.9985 0.0350 0.0423 -84.211 -11.598 18.076 D 581 GLU A 61 GLU.? D 596 ARG A 23 ARG.? D 647 ARG A 28 ARG.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 6 3 RMSD = 1.40 A TRANSFORM 0.7889 0.6142 -0.0189 -0.3401 0.4107 -0.8460 -0.5119 0.6738 0.5329 -28.811 25.147 122.654 A 70 ALA A 69 ALA~? A 126 LEU A 73 LEU~? A 158 GLU A 76 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 14 3 RMSD = 1.40 A TRANSFORM -0.0248 0.9996 -0.0156 0.5712 0.0270 0.8203 0.8204 0.0115 -0.5717 -51.200 33.016 167.052 A 70 ALA B 69 ALA~? A 126 LEU B 73 LEU~? A 158 GLU B 76 GLU~? ULMNm 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.40 A TRANSFORM -0.5297 0.7735 0.3479 0.8409 0.5326 0.0961 -0.1109 0.3434 -0.9326 -15.190 14.047 1.887 C 581 GLU A 61 GLU.? C 596 ARG A 23 ARG.? C 647 ARG A 28 ARG.? ULMNm 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.41 A TRANSFORM 0.5654 -0.7461 -0.3516 -0.7354 -0.6491 0.1947 -0.3735 0.1484 -0.9157 38.597 9.645 2.385 E 581 GLU A 61 GLU.? E 596 ARG A 23 ARG.? E 647 ARG A 28 ARG.? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.43 A TRANSFORM 0.0081 -0.0134 0.9999 -0.5596 -0.8287 -0.0066 0.8287 -0.5595 -0.0143 80.614 112.982 165.545 D 141 GLY B 50 GLY.? D 144 GLU A 37 GLU^? D 164 GLU B 37 GLU^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.43 A TRANSFORM 0.1439 -0.0999 -0.9845 0.5345 0.8452 -0.0077 0.8328 -0.5251 0.1750 68.232 71.358 165.864 C 141 GLY B 50 GLY.? C 144 GLU A 37 GLU^? C 164 GLU B 37 GLU^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.43 A TRANSFORM 0.9272 -0.0400 -0.3724 -0.2021 -0.8906 -0.4075 -0.3153 0.4531 -0.8338 69.592 111.510 137.110 F 141 GLY B 50 GLY.? F 144 GLU A 37 GLU^? F 164 GLU B 37 GLU^? ULMNm 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 3 3 RMSD = 1.44 A TRANSFORM 0.4669 0.7517 0.4657 0.5478 -0.6593 0.5150 0.6942 0.0147 -0.7196 10.972 111.910 61.016 B 232 HIS B 49 HIS.? B 262 GLU A 37 GLU^? B 358 GLU B 37 GLU^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 4 3 RMSD = 1.45 A TRANSFORM -0.4802 0.8020 -0.3553 -0.6654 -0.5969 -0.4483 -0.5716 0.0212 0.8202 51.950 104.766 159.269 E 141 GLY B 50 GLY.? E 144 GLU A 37 GLU^? E 164 GLU B 37 GLU^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.45 A TRANSFORM -0.6379 0.6914 0.3393 0.7330 0.4098 0.5430 0.2364 0.5951 -0.7681 -8.901 -120.878 -129.399 A 420 ALA B 89 ALA.? B 182 GLY B 63 GLY.? B 183 GLY B 86 GLY.? ULMNm 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 4 3 RMSD = 1.45 A TRANSFORM 0.1110 0.1882 -0.9758 0.6510 0.7282 0.2145 0.7509 -0.6591 -0.0417 33.878 19.515 66.440 C 581 GLU B 7 GLU.? C 596 ARG B 5 ARG.? C 647 ARG B 2 ARG.? ULMNm 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 RMSD = 1.46 A TRANSFORM 0.3234 0.9062 -0.2724 -0.8481 0.1499 -0.5082 -0.4197 0.3954 0.8170 9.759 77.743 25.347 B 232 HIS A 49 HIS.? B 262 GLU B 37 GLU^? B 358 GLU A 37 GLU^? ULMNm 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 RMSD = 1.46 A TRANSFORM -0.5427 -0.1328 0.8293 -0.7554 0.5087 -0.4129 -0.3671 -0.8506 -0.3765 0.433 -80.709 80.949 F 581 GLU A 61 GLU.? F 596 ARG A 23 ARG.? F 647 ARG A 28 ARG.? ULMNm 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 RMSD = 1.46 A TRANSFORM 0.0196 0.9796 0.2001 0.9181 0.0615 -0.3914 -0.3958 0.1914 -0.8982 -14.589 59.196 44.149 A 232 HIS A 49 HIS.? A 262 GLU A 37 GLU^? A 358 GLU B 37 GLU^? ULMNm 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 RMSD = 1.47 A TRANSFORM 0.1586 -0.9710 0.1792 -0.8989 -0.0669 0.4330 -0.4084 -0.2297 -0.8834 82.268 78.557 65.234 B 232 HIS A 49 HIS.? B 262 GLU A 37 GLU^? B 358 GLU B 37 GLU^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.48 A TRANSFORM 0.8921 -0.4275 -0.1462 0.0969 0.4972 -0.8622 0.4413 0.7550 0.4850 52.630 -125.912 -148.194 A 420 ALA A 89 ALA~? B 182 GLY A 63 GLY~? B 183 GLY A 86 GLY~? ULMNm 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 RMSD = 1.48 A TRANSFORM -0.8072 0.2571 -0.5313 0.3034 -0.5913 -0.7472 -0.5063 -0.7643 0.3993 -27.420 -9.360 54.272 F 581 GLU B 7 GLU.? F 596 ARG B 5 ARG.? F 647 ARG B 2 ARG.? ULMNm 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 RMSD = 1.48 A TRANSFORM 0.8099 -0.2594 0.5260 -0.1355 0.7898 0.5982 -0.5706 -0.5558 0.6046 52.180 14.842 57.348 B 581 GLU B 7 GLU.? B 596 ARG B 5 ARG.? B 647 ARG B 2 ARG.? ULMNm 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 RMSD = 1.48 A TRANSFORM -0.8932 0.0694 0.4443 -0.0658 0.9572 -0.2817 -0.4448 -0.2808 -0.8504 33.394 8.930 48.502 A 581 GLU B 7 GLU.? A 596 ARG B 5 ARG.? A 647 ARG B 2 ARG.? ULMNm 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 RMSD = 1.48 A TRANSFORM 0.8990 -0.0533 -0.4346 0.1988 -0.8347 0.5136 -0.3901 -0.5482 -0.7398 -9.485 -1.298 47.687 D 581 GLU B 7 GLU.? D 596 ARG B 5 ARG.? D 647 ARG B 2 ARG.? ULMNm 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 RMSD = 1.49 A TRANSFORM -0.0944 -0.1654 0.9817 -0.8440 -0.5097 -0.1671 0.5280 -0.8443 -0.0915 -9.917 -16.756 61.375 E 581 GLU B 7 GLU.? E 596 ARG B 5 ARG.? E 647 ARG B 2 ARG.?