*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1hwt_d00 GENE REGULATION/DNA user 3 3 RMSD = 0.58 A TRANSFORM -0.0196 -0.8148 -0.5794 0.5373 0.4802 -0.6933 0.8431 -0.3249 0.4284 61.476 22.245 25.807 C 70 ARG B 53 ARG~? C 71 LYS B 55 LYS~? C 72 VAL B 56 VAL~? ULMNm 3 1hwt_d00 GENE REGULATION/DNA user 1 3 RMSD = 0.73 A TRANSFORM 0.2289 -0.5918 0.7729 -0.7467 0.4026 0.5295 -0.6245 -0.6984 -0.3498 47.635 43.594 64.134 C 70 ARG A 53 ARG~? C 71 LYS A 55 LYS~? C 72 VAL A 56 VAL~? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 5 3 RMSD = 1.11 A TRANSFORM 0.6333 -0.4289 0.6441 0.0723 0.8615 0.5026 -0.7705 -0.2718 0.5766 -27.997 27.048 122.809 B 130 SER A 92 SER~? B 166 PHE A 62 PHE.? B 182 PHE A 17 PHE.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 10 3 RMSD = 1.11 A TRANSFORM 0.2666 0.8391 -0.4743 0.9368 -0.1099 0.3322 0.2266 -0.5328 -0.8153 -23.870 -9.731 41.588 141 ASP B 44 ASP~? 166 GLY B 33 GLY.? 169 GLU B 66 GLU^? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 RMSD = 1.14 A TRANSFORM 0.8088 -0.4790 -0.3411 -0.2715 -0.8187 0.5059 -0.5216 -0.3166 -0.7923 -10.359 83.057 56.147 A 53 SER A 20 SER~? A 54 PRO A 19 PRO~? A 96 ASP A 21 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.15 A TRANSFORM 0.9762 0.2133 0.0395 -0.1567 0.8193 -0.5516 -0.1500 0.5323 0.8332 14.554 -107.322 -167.356 A 420 ALA B 79 ALA^? B 182 GLY B 32 GLY~? B 183 GLY B 33 GLY.? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 5 3 RMSD = 1.15 A TRANSFORM 0.0127 0.5028 -0.8643 -0.0762 -0.8613 -0.5023 -0.9970 0.0723 0.0274 -42.346 74.619 70.435 D 130 SER A 92 SER~? D 166 PHE A 62 PHE.? D 182 PHE A 17 PHE.? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 9 3 RMSD = 1.17 A TRANSFORM -0.0380 -0.2166 -0.9755 0.4382 -0.8810 0.1785 -0.8981 -0.4207 0.1284 11.074 72.965 70.102 C 130 SER B 92 SER~? C 166 PHE B 62 PHE.? C 182 PHE B 17 PHE.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.17 A TRANSFORM -0.9774 -0.2050 0.0523 -0.1861 0.9506 0.2483 -0.1006 0.2329 -0.9673 62.464 -114.379 -154.101 A 420 ALA A 79 ALA^? B 182 GLY A 32 GLY~? B 183 GLY A 33 GLY.? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 4 3 RMSD = 1.19 A TRANSFORM 0.0054 0.0207 0.9998 -0.0686 -0.9974 0.0210 0.9976 -0.0687 -0.0040 -3.062 85.574 27.305 C 130 SER A 92 SER~? C 166 PHE A 62 PHE.? C 182 PHE A 17 PHE.? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 9 3 RMSD = 1.19 A TRANSFORM 0.6131 0.4327 0.6610 -0.4293 0.8848 -0.1811 -0.6632 -0.1727 0.7282 -68.531 28.355 87.802 A 130 SER B 92 SER~? A 166 PHE B 62 PHE.? A 182 PHE B 17 PHE.? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 4 3 RMSD = 1.20 A TRANSFORM -0.6525 0.0234 -0.7574 0.0612 0.9979 -0.0219 0.7553 -0.0607 -0.6526 -29.926 16.093 64.360 A 130 SER A 92 SER~? A 166 PHE A 62 PHE.? A 182 PHE A 17 PHE.? ULMNm 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 4 3 RMSD = 1.24 A TRANSFORM -0.5233 0.8240 -0.2174 0.8519 0.5125 -0.1081 0.0224 -0.2417 -0.9701 -12.780 -4.341 108.500 A 159 LYS B 70 LYS.? A 193 GLU B 66 GLU^? A 217 VAL B 68 VAL^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.25 A TRANSFORM -0.9899 -0.1218 0.0731 0.1410 -0.9039 0.4038 0.0169 0.4100 0.9119 59.184 -89.334 -169.043 A 420 ALA B 79 ALA^? B 182 GLY B 33 GLY.? B 183 GLY B 32 GLY~? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 10 3 RMSD = 1.25 A TRANSFORM -0.4419 -0.7642 -0.4698 -0.3881 0.6350 -0.6679 0.8087 -0.1128 -0.5772 4.198 45.502 94.376 B 130 SER B 92 SER~? B 166 PHE B 62 PHE.? B 182 PHE B 17 PHE.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.25 A TRANSFORM -0.3513 0.8981 -0.2648 0.0827 -0.2519 -0.9642 -0.9326 -0.3606 0.0142 -28.788 -4.822 29.863 141 ASP A 44 ASP~? 166 GLY A 33 GLY.? 169 GLU A 80 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.26 A TRANSFORM -0.4255 0.8847 0.1903 -0.9045 -0.4088 -0.1215 -0.0297 -0.2238 0.9742 -17.787 33.383 31.557 141 ASP A 44 ASP~? 166 GLY A 32 GLY~? 169 GLU A 66 GLU^? ULMNm 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 RMSD = 1.28 A TRANSFORM -0.0276 0.2652 0.9638 -0.3263 -0.9138 0.2421 0.9449 -0.3078 0.1117 -18.600 70.834 30.827 B 105 ASN A 3 ASN~? B 106 PRO A 4 PRO~? B 108 TYR B 25 TYR~? ULMNm 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 RMSD = 1.29 A TRANSFORM 0.0302 -0.2491 -0.9680 0.3131 0.9221 -0.2275 0.9493 -0.2962 0.1058 59.005 6.087 4.035 A 105 ASN A 3 ASN~? A 106 PRO A 4 PRO~? A 108 TYR B 25 TYR~? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 10 3 RMSD = 1.30 A TRANSFORM -0.1805 0.6550 0.7337 0.3968 -0.6341 0.6637 0.9000 0.4110 -0.1455 -48.661 55.975 28.053 D 130 SER B 92 SER~? D 166 PHE B 62 PHE.? D 182 PHE B 17 PHE.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 11 3 RMSD = 1.31 A TRANSFORM -0.0046 0.9990 -0.0435 -0.1518 0.0423 0.9875 0.9884 0.0112 0.1515 -37.716 -15.533 -17.335 141 ASP B 44 ASP~? 166 GLY B 33 GLY.? 169 GLU B 80 GLU.? ULMNm 3 1cns_c00 CHITINASE user 6 3 RMSD = 1.32 A TRANSFORM -0.3824 -0.7939 -0.4727 -0.6365 -0.1445 0.7576 -0.6698 0.5906 -0.4501 -0.867 16.580 64.404 A 67 GLU B 96 GLU~? A 89 GLU B 13 GLU~? A 120 SER B 16 SER.? ULMNm 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 3 3 RMSD = 1.34 A TRANSFORM 0.0529 -0.0028 -0.9986 0.7478 -0.6627 0.0415 -0.6619 -0.7489 -0.0330 -5.149 46.808 71.448 B 105 ASN B 3 ASN~? B 106 PRO B 4 PRO~? B 108 TYR A 25 TYR~? ULMNm 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 3 3 RMSD = 1.35 A TRANSFORM -0.0623 0.0155 0.9979 -0.7372 0.6733 -0.0565 -0.6728 -0.7392 -0.0305 45.830 29.768 44.937 A 105 ASN B 3 ASN~? A 106 PRO B 4 PRO~? A 108 TYR A 25 TYR~? ULMNm 3 1cns_c00 CHITINASE user 2 3 RMSD = 1.37 A TRANSFORM 0.5406 -0.4745 0.6947 0.7789 -0.0298 -0.6265 0.3180 0.8797 0.3534 -30.254 -7.903 35.610 A 67 GLU A 96 GLU~? A 89 GLU A 13 GLU~? A 120 SER A 16 SER.? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 RMSD = 1.39 A TRANSFORM -0.6374 -0.5723 0.5159 0.4739 -0.8191 -0.3232 0.6075 0.0384 0.7934 15.159 72.933 21.269 A 53 SER B 20 SER~? A 54 PRO B 19 PRO~? A 96 ASP B 21 ASP~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.41 A TRANSFORM 0.8098 0.2984 -0.5052 -0.4583 0.8592 -0.2272 0.3663 0.4155 0.8326 56.693 106.165 142.486 B 141 GLY A 61 GLY.? B 144 GLU A 88 GLU~? B 164 GLU A 80 GLU.? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.41 A TRANSFORM -0.7575 -0.2203 0.6146 0.4510 -0.8572 0.2486 0.4721 0.4654 0.7487 87.362 79.304 140.598 F 141 GLY A 61 GLY.? F 144 GLU A 88 GLU~? F 164 GLU A 80 GLU.? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.41 A TRANSFORM 0.1679 -0.1713 0.9708 -0.6344 0.7350 0.2394 -0.7546 -0.6561 0.0148 65.044 108.029 169.150 C 141 GLY A 61 GLY.? C 144 GLU A 88 GLU~? C 164 GLU A 80 GLU.? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.42 A TRANSFORM 0.4311 0.8584 0.2780 0.8532 -0.4881 0.1838 0.2935 0.1579 -0.9428 63.867 70.961 150.327 E 141 GLY A 61 GLY.? E 144 GLU A 88 GLU~? E 164 GLU A 80 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.43 A TRANSFORM 0.1166 0.3115 -0.9431 0.2490 -0.9284 -0.2758 -0.9615 -0.2027 -0.1858 -24.964 34.781 19.371 141 ASP A 44 ASP~? 166 GLY B 6 GLY~? 169 GLU B 13 GLU~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.43 A TRANSFORM -0.2958 0.0269 -0.9549 0.6591 -0.7178 -0.2244 -0.6914 -0.6958 0.1946 83.883 76.335 167.103 D 141 GLY A 61 GLY.? D 144 GLU A 88 GLU~? D 164 GLU A 80 GLU.? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 RMSD = 1.48 A TRANSFORM 0.7986 -0.5458 0.2537 0.0322 0.4597 0.8875 -0.6010 -0.7006 0.3847 74.275 5.315 81.404 A 170 SER B 26 SER~? A 239 VAL B 22 VAL~? A 413 ASN A 3 ASN~? ULMNm 3 1oqz_c01 GLUTARYL ACYLASE user 2 3 RMSD = 1.48 A TRANSFORM -0.7868 0.5593 -0.2608 0.0206 0.4462 0.8947 0.6168 0.6986 -0.3626 30.563 -28.447 -27.052 B 170 SER B 26 SER~? B 239 VAL B 22 VAL~? B 413 ASN A 3 ASN~?