*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1hzd_c03 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.36 A TRANSFORM -0.6212 0.6522 0.4344 -0.7379 -0.6735 -0.0440 0.2639 -0.3478 0.8997 -35.050 40.652 -20.541 D 141 ALA A 86 ALA^? D 186 GLY A 82 GLY^? D 189 GLU A 81 GLU^? D 209 GLU A 88 GLU^? ULMNm 4 1hzd_c01 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.37 A TRANSFORM -0.8914 -0.0247 0.4525 0.1771 0.9001 0.3980 -0.4172 0.4350 -0.7980 -2.799 -65.794 52.714 B 141 ALA A 86 ALA^? B 186 GLY A 82 GLY^? B 189 GLU A 81 GLU^? B 209 GLU A 88 GLU^? ULMNm 4 1hzd_c02 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.38 A TRANSFORM 0.4830 -0.8753 0.0239 0.4409 0.2667 0.8570 -0.7565 -0.4035 0.5147 46.736 -66.980 14.602 C 141 ALA A 86 ALA^? C 186 GLY A 82 GLY^? C 189 GLU A 81 GLU^? C 209 GLU A 88 GLU^? ULMNm 4 1hzd_c04 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.38 A TRANSFORM 0.5083 -0.5411 0.6699 -0.0771 -0.8034 -0.5904 0.8577 0.2484 -0.4501 -7.156 71.605 27.552 E 141 ALA A 86 ALA^? E 186 GLY A 82 GLY^? E 189 GLU A 81 GLU^? E 209 GLU A 88 GLU^? ULMNm 4 1hzd_c00 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.39 A TRANSFORM -0.0704 0.3825 -0.9213 0.8370 0.5251 0.1540 0.5427 -0.7603 -0.3571 52.712 -40.532 69.629 A 141 ALA A 86 ALA^? A 186 GLY A 82 GLY^? A 189 GLU A 81 GLU^? A 209 GLU A 88 GLU^? ULMNm 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 1 4 RMSD = 1.40 A TRANSFORM 0.2530 0.9475 0.1956 -0.5605 0.3084 -0.7686 -0.7885 0.0848 0.6091 26.778 118.555 16.695 A 193 ALA A 9 ALA.? A 194 GLY A 8 GLY^? B 457 ALA A 107 ALA~? B 458 ALA A 106 ALA.? ULMNm 4 1hzd_c05 AU-BINDING PROTEIN-ENOYL-COA HYDRATAuser 1 4 RMSD = 1.41 A TRANSFORM 0.6202 0.4597 -0.6356 -0.6393 -0.1733 -0.7492 -0.4546 0.8710 0.1864 25.054 59.013 -25.209 F 141 ALA A 86 ALA^? F 186 GLY A 82 GLY^? F 189 GLU A 81 GLU^? F 209 GLU A 88 GLU^? ULMNm 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 2 4 RMSD = 1.41 A TRANSFORM 0.0624 -0.8518 -0.5201 0.8536 -0.2246 0.4701 -0.5172 -0.4733 0.7131 81.116 96.042 25.568 A 457 ALA A 107 ALA~? A 458 ALA A 106 ALA.? B 193 ALA A 9 ALA.? B 194 GLY A 8 GLY^? ULMNm 4 2bgw_d00 HYDROLASE user 2 4 RMSD = 1.50 A TRANSFORM 0.2787 -0.4027 -0.8719 0.8288 -0.3577 0.4302 -0.4851 -0.8425 0.2341 72.500 50.693 41.529 A 86 ALA A 80 ALA^? A 87 GLU A 81 GLU^? A 123 TYR A 87 TYR^? A 182 ARG A 90 ARG^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 0.91 A TRANSFORM -0.8718 -0.1890 0.4519 0.0894 0.8456 0.5262 -0.4816 0.4992 -0.7203 -2.487 -22.618 27.342 141 ASP A 96 ASP.? 166 GLY A 27 GLY^? 169 GLU A 7 GLU^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.08 A TRANSFORM -0.8314 -0.1012 -0.5464 -0.3366 -0.6906 0.6401 -0.4422 0.7161 0.5401 65.809 -60.922 -148.940 A 183 GLY A 8 GLY^? B 419 GLY A 10 GLY.? B 420 ALA A 107 ALA~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 7 3 RMSD = 1.09 A TRANSFORM 0.0294 0.0573 -0.9979 0.9742 -0.2249 0.0158 -0.2236 -0.9727 -0.0624 -2.321 5.455 168.707 B 70 ALA A 94 ALA.? B 126 LEU A 75 LEU.? B 158 GLU A 39 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 7 3 RMSD = 1.10 A TRANSFORM 0.8214 -0.2603 0.5075 -0.5295 -0.0171 0.8481 -0.2121 -0.9654 -0.1519 -19.358 6.677 169.414 A 70 ALA A 94 ALA.? A 126 LEU A 75 LEU.? A 158 GLU A 39 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.11 A TRANSFORM -0.8715 0.0939 0.4813 -0.4672 0.1393 -0.8731 -0.1490 -0.9858 -0.0776 -10.136 21.030 168.144 C 70 ALA A 94 ALA.? C 126 LEU A 75 LEU.? C 158 GLU A 39 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.17 A TRANSFORM -0.8301 -0.3528 -0.4319 -0.4991 0.8154 0.2933 0.2487 0.4590 -0.8529 24.216 12.632 169.222 A 70 ALA A 94 ALA.? A 126 LEU A 93 LEU^? A 158 GLU A 39 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.18 A TRANSFORM 0.4434 0.5437 0.7126 -0.8768 0.4281 0.2190 -0.1860 -0.7219 0.6665 -40.718 13.631 -4.795 141 ASP A 30 ASP.? 166 GLY A 24 GLY^? 169 GLU A 17 GLU.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 10 3 RMSD = 1.18 A TRANSFORM -0.0093 0.8889 0.4581 0.9861 -0.0679 0.1518 0.1660 0.4531 -0.8758 -26.831 -19.585 171.914 C 70 ALA A 94 ALA.? C 126 LEU A 93 LEU^? C 158 GLU A 39 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.19 A TRANSFORM 0.8668 -0.4848 -0.1166 -0.4681 -0.7108 -0.5250 0.1717 0.5097 -0.8431 -29.134 40.199 170.744 B 70 ALA A 94 ALA.? B 126 LEU A 93 LEU^? B 158 GLU A 39 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.24 A TRANSFORM -0.2183 -0.9316 0.2907 -0.8389 0.3314 0.4317 -0.4985 -0.1496 -0.8539 5.060 17.372 182.733 A 70 ALA A 94 ALA.? A 126 LEU A 76 LEU^? A 158 GLU A 39 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.25 A TRANSFORM 0.7863 0.1641 -0.5956 0.2267 -0.9735 0.0312 -0.5747 -0.1595 -0.8027 -22.436 21.333 183.781 B 70 ALA A 94 ALA.? B 126 LEU A 76 LEU^? B 158 GLU A 39 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.27 A TRANSFORM -0.6269 0.7497 0.2119 0.5605 0.6229 -0.5456 -0.5411 -0.2233 -0.8108 -12.737 -4.114 184.015 C 70 ALA A 94 ALA.? C 126 LEU A 76 LEU^? C 158 GLU A 39 GLU~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.34 A TRANSFORM 0.7930 0.5982 -0.1156 0.0456 -0.2475 -0.9678 -0.6075 0.7622 -0.2235 57.478 156.489 140.616 B 141 GLY A 82 GLY^? B 144 GLU A 81 GLU^? B 164 GLU A 88 GLU^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.35 A TRANSFORM -0.8718 -0.4862 0.0598 -0.0702 0.2449 0.9670 -0.4849 0.8388 -0.2476 87.386 29.124 139.302 F 141 GLY A 82 GLY^? F 144 GLU A 81 GLU^? F 164 GLU A 88 GLU^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.35 A TRANSFORM -0.8260 0.4778 0.2992 -0.4548 -0.2512 -0.8545 -0.3331 -0.8418 0.4247 40.765 150.761 158.578 C 141 GLY A 82 GLY^? C 144 GLU A 81 GLU^? C 164 GLU A 88 GLU^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.36 A TRANSFORM 0.7574 -0.6225 -0.1970 0.4511 0.2808 0.8471 -0.4720 -0.7305 0.4935 104.789 33.626 151.143 D 141 GLY A 82 GLY^? D 144 GLU A 81 GLU^? D 164 GLU A 88 GLU^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.37 A TRANSFORM -0.0603 0.7313 -0.6794 0.1617 0.6788 0.7163 0.9850 -0.0667 -0.1592 86.603 27.931 162.971 E 141 GLY A 82 GLY^? E 144 GLU A 81 GLU^? E 164 GLU A 88 GLU^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.38 A TRANSFORM -0.8812 -0.2534 0.3991 -0.4543 0.2197 -0.8634 0.1311 -0.9421 -0.3087 0.391 40.486 22.023 141 ASP A 96 ASP.? 166 GLY A 14 GLY^? 169 GLU A 7 GLU^? ULMNm 3 2f61_c00 ACID BETA-GLUCOSIDASE user 1 3 RMSD = 1.38 A TRANSFORM 0.8292 0.4851 -0.2776 0.4321 -0.8714 -0.2322 -0.3545 0.0726 -0.9322 -5.880 71.837 35.080 A 235 GLU A 81 GLU^? A 340 GLU A 88 GLU^? A 342 CYH A 102 CYH^? ULMNm 3 3hde_o02 LYSOZYME user 1 3 RMSD = 1.40 A TRANSFORM -0.7472 0.1823 0.6391 0.5568 0.6967 0.4523 -0.3628 0.6938 -0.6221 15.794 -38.511 16.027 C 35 GLU A 7 GLU^? C 44 ASP A 30 ASP.? C 50 THR A 28 THR.? ULMNm 3 3hde_o01 LYSOZYME user 1 3 RMSD = 1.41 A TRANSFORM 0.5756 0.2300 0.7847 0.4161 0.7437 -0.5232 -0.7039 0.6277 0.3324 -50.574 -19.381 -30.028 B 35 GLU A 7 GLU^? B 44 ASP A 30 ASP.? B 50 THR A 28 THR.? ULMNm 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.47 A TRANSFORM 0.8599 -0.3480 0.3735 0.3673 -0.0865 -0.9261 0.3546 0.9335 0.0534 23.779 46.519 -16.335 A 46 ASP A 42 ASP~? A 100 ARG A 45 ARG~? A 116 GLN A 49 GLN~? ULMNm 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 RMSD = 1.48 A TRANSFORM 0.0824 0.7654 -0.6383 -0.6585 0.5226 0.5416 0.7481 0.3757 0.5470 20.346 4.932 -5.648 A 243 THR A 36 THR~? A 345 PHE A 121 PHE.? A 352 CYH A 44 CYH~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.48 A TRANSFORM -0.3900 -0.9162 0.0922 -0.8429 0.3149 -0.4364 0.3708 -0.2479 -0.8950 12.456 45.740 180.203 A 70 ALA A 74 ALA.? A 126 LEU A 76 LEU^? A 158 GLU A 39 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.48 A TRANSFORM 0.9550 0.1633 0.2477 0.0862 -0.9516 0.2949 0.2838 -0.2603 -0.9229 -50.831 13.457 183.925 B 70 ALA A 74 ALA.? B 126 LEU A 76 LEU^? B 158 GLU A 39 GLU~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 RMSD = 1.49 A TRANSFORM -0.8029 -0.5870 0.1042 -0.5529 0.6678 -0.4982 0.2229 -0.4576 -0.8608 75.280 31.917 43.998 A 229 ALA A 106 ALA.? A 257 ALA A 105 ALA.? A 328 ASP A 85 ASP.?