*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 0.92 A TRANSFORM 0.3012 0.2005 -0.9322 0.9080 -0.3587 0.2163 -0.2911 -0.9116 -0.2901 88.113 141.152 185.772 B 141 GLY A 46 GLY~? B 144 GLU A 49 GLU~? B 164 GLU A 33 GLU.? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.00 A TRANSFORM -0.3358 -0.3419 0.8777 -0.9126 0.3487 -0.2133 -0.2331 -0.8726 -0.4291 63.217 44.284 188.210 F 141 GLY A 46 GLY~? F 144 GLU A 49 GLU~? F 164 GLU A 33 GLU.? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.00 A TRANSFORM 0.3587 -0.7562 -0.5472 -0.7015 0.1683 -0.6925 0.6158 0.6323 -0.4701 127.421 66.490 155.443 E 141 GLY A 46 GLY~? E 144 GLU A 49 GLU~? E 164 GLU A 33 GLU.? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.00 A TRANSFORM -0.7614 -0.6475 0.0311 0.5745 -0.6519 0.4949 -0.3002 0.3947 0.8684 71.264 137.381 112.883 C 141 GLY A 46 GLY~? C 144 GLU A 49 GLU~? C 164 GLU A 33 GLU.? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.02 A TRANSFORM 0.6814 0.7203 0.1295 -0.5698 0.6333 -0.5237 -0.4593 0.2831 0.8420 66.612 48.748 112.159 D 141 GLY A 46 GLY~? D 144 GLU A 49 GLU~? D 164 GLU A 33 GLU.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.19 A TRANSFORM 0.2848 -0.8898 0.3567 -0.2755 -0.4324 -0.8586 0.9181 0.1463 -0.3682 127.537 131.782 159.660 B 141 GLY A 46 GLY~? B 144 GLU A 33 GLU.? B 164 GLU A 49 GLU~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.28 A TRANSFORM 0.6883 -0.5146 -0.5113 0.5939 -0.0051 0.8046 -0.4166 -0.8574 0.3021 121.994 85.883 199.016 E 141 GLY A 46 GLY~? E 144 GLU A 33 GLU.? E 164 GLU A 49 GLU~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.29 A TRANSFORM -0.1431 0.8957 -0.4210 0.2778 0.4446 0.8516 0.9499 0.0049 -0.3125 20.273 52.867 168.361 F 141 GLY A 46 GLY~? F 144 GLU A 33 GLU.? F 164 GLU A 49 GLU~? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 RMSD = 1.30 A TRANSFORM -0.4811 0.7822 0.3958 -0.2692 -0.5615 0.7825 0.8343 0.2699 0.4807 22.292 35.592 4.698 A 261 GLY A 46 GLY~? B 17 GLN A 34 GLN.? B 140 GLU A 33 GLU.? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.31 A TRANSFORM 0.7487 0.6612 -0.0472 -0.0937 0.0351 -0.9950 -0.6562 0.7494 0.0882 39.088 105.691 96.410 C 141 GLY A 46 GLY~? C 144 GLU A 33 GLU.? C 164 GLU A 49 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.31 A TRANSFORM 0.2217 0.9359 -0.2738 0.9749 -0.2180 0.0441 -0.0185 -0.2767 -0.9608 -23.878 28.447 22.496 141 ASP A 48 ASP~? 166 GLY A 20 GLY.? 169 GLU A 62 GLU~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.32 A TRANSFORM -0.8601 -0.5041 0.0787 0.1222 -0.0537 0.9911 -0.4953 0.8620 0.1078 95.394 80.673 90.799 D 141 GLY A 46 GLY~? D 144 GLU A 33 GLU.? D 164 GLU A 49 GLU~? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.38 A TRANSFORM -0.3044 -0.9119 0.2754 -0.4075 0.3860 0.8276 -0.8610 0.1397 -0.4891 60.571 40.211 70.735 A 50 GLN A 8 GLN.? A 91 LEU A 9 LEU.? A 133 GLU A 15 GLU.? ULMNm 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 3 3 RMSD = 1.40 A TRANSFORM -0.9192 -0.0873 -0.3840 -0.3521 -0.2543 0.9008 -0.1763 0.9632 0.2030 127.074 32.485 -11.440 142 TRP A 47 TRP~? 223 ASP A 23 ASP~? 258 ALA A 53 ALA~? ULMNm 3 1mas_c01 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 1 3 RMSD = 1.41 A TRANSFORM -0.9188 0.1546 0.3632 -0.3127 -0.8466 -0.4306 0.2410 -0.5092 0.8262 -36.087 4.715 71.710 B 10 ASP A 121 ASP.? B 168 ASN A 40 ASN.? B 241 HIS A 118 HIS^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.42 A TRANSFORM 0.4180 -0.1401 0.8976 -0.7568 0.4929 0.4293 -0.5026 -0.8587 0.1000 54.136 88.224 155.148 C 141 GLY A 12 GLY.? C 144 GLU A 15 GLU.? C 164 GLU A 14 GLU.? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.42 A TRANSFORM -0.5056 -0.4643 0.7272 0.7281 -0.6818 0.0710 0.4628 0.5653 0.6828 62.455 88.063 137.405 F 141 GLY A 12 GLY.? F 144 GLU A 15 GLU.? F 164 GLU A 14 GLU.? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.42 A TRANSFORM 0.3310 -0.0589 0.9418 0.4168 0.9045 -0.0899 -0.8466 0.4223 0.3239 37.600 19.895 57.691 A 50 GLN A 8 GLN.? A 91 LEU A 9 LEU.? A 133 GLU A 15 GLU.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.43 A TRANSFORM 0.5555 0.5526 -0.6213 -0.7306 0.6812 -0.0474 0.3970 0.4803 0.7821 80.706 96.895 135.945 B 141 GLY A 12 GLY.? B 144 GLU A 15 GLU.? B 164 GLU A 14 GLU.? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.43 A TRANSFORM -0.4903 -0.0356 -0.8708 0.7774 -0.4697 -0.4185 -0.3941 -0.8821 0.2579 92.290 96.384 151.793 D 141 GLY A 12 GLY.? D 144 GLU A 15 GLU.? D 164 GLU A 14 GLU.? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.43 A TRANSFORM 0.2044 0.9411 0.2695 0.9786 -0.2026 -0.0348 0.0218 0.2709 -0.9624 65.718 87.968 170.665 E 141 GLY A 12 GLY.? E 144 GLU A 15 GLU.? E 164 GLU A 14 GLU.? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.44 A TRANSFORM 0.5920 0.6161 0.5196 0.0916 0.5891 -0.8029 -0.8007 0.5229 0.2923 47.008 24.534 31.537 C1050 GLN A 8 GLN.? C1091 LEU A 9 LEU.? C1133 GLU A 15 GLU.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.46 A TRANSFORM 0.6322 -0.5562 -0.5394 -0.6620 -0.7495 -0.0031 -0.4026 0.3591 -0.8420 33.532 34.845 65.805 A 241 ASP A 95 ASP.? A 265 GLU A 14 GLU.? A 369 ASP A 121 ASP.? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.48 A TRANSFORM -0.5180 -0.8116 0.2702 -0.3018 -0.1221 -0.9455 0.8004 -0.5713 -0.1817 108.813 54.751 69.169 B 550 GLN A 8 GLN.? B 591 LEU A 9 LEU.? B 633 GLU A 15 GLU.? ULMNm 3 1mas_c00 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 1 3 RMSD = 1.49 A TRANSFORM 0.0522 -0.8638 -0.5011 -0.9762 -0.1499 0.1566 -0.2104 0.4810 -0.8511 18.572 -32.660 -11.189 A 10 ASP A 121 ASP.? A 168 ASN A 40 ASN.? A 241 HIS A 118 HIS^?