*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 2 3 RMSD = 0.48 A TRANSFORM 0.2289 -0.8733 -0.4300 0.7333 0.4452 -0.5138 -0.6402 0.1977 -0.7423 66.149 100.732 58.483 A 459 ASN A 29 ASN~? A 460 GLY A 30 GLY~? A 461 ASN A 33 ASN~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 5 3 RMSD = 0.51 A TRANSFORM 0.4158 0.7867 0.4563 0.6041 -0.6140 0.5081 -0.6799 -0.0644 0.7305 -40.986 39.502 -55.207 A 459 ASN B 29 ASN~? A 460 GLY B 30 GLY~? A 461 ASN B 33 ASN~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.62 A TRANSFORM -0.0626 -0.9393 0.3372 0.4175 -0.3315 -0.8460 -0.9065 -0.0879 -0.4129 29.177 -40.601 -91.198 A 420 ALA A 111 ALA~? B 182 GLY A 145 GLY~? B 183 GLY A 144 GLY~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 0.66 A TRANSFORM 0.0695 0.9292 -0.3629 0.4710 0.2901 0.8330 -0.8794 0.2289 0.4175 48.548 -189.741 -165.007 A 420 ALA B 111 ALA~? B 182 GLY B 145 GLY~? B 183 GLY B 144 GLY~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 6 3 RMSD = 0.69 A TRANSFORM -0.0085 -0.2008 -0.9796 -0.9987 0.0509 -0.0017 -0.0502 -0.9783 0.2010 118.522 110.141 -3.970 A 459 ASN B 33 ASN~? A 460 GLY B 30 GLY~? A 461 ASN B 29 ASN~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 3 3 RMSD = 0.71 A TRANSFORM 0.0289 0.2293 0.9729 -0.9847 0.1736 -0.0117 0.1716 0.9577 -0.2308 -49.216 107.745 -9.538 A 459 ASN A 33 ASN~? A 460 GLY A 30 GLY~? A 461 ASN A 29 ASN~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 0.85 A TRANSFORM 0.7669 0.6216 0.1597 -0.6124 0.6344 0.4717 -0.1920 0.4595 -0.8672 15.904 -139.978 -70.922 A 420 ALA B 130 ALA~? B 182 GLY A 144 GLY~? B 183 GLY A 145 GLY~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.85 A TRANSFORM 0.6913 -0.7100 -0.1342 -0.6691 -0.5589 -0.4898 -0.2728 -0.4284 0.8614 66.025 -37.441 -193.061 A 420 ALA A 130 ALA~? B 182 GLY B 144 GLY~? B 183 GLY B 145 GLY~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 0.90 A TRANSFORM -0.8265 0.5524 -0.1082 0.1860 0.0867 -0.9787 0.5313 0.8291 0.1744 41.591 -15.933 -168.741 A 420 ALA B 139 ALA~? B 182 GLY B 145 GLY~? B 183 GLY B 144 GLY~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 0.91 A TRANSFORM -0.8932 -0.4380 0.1013 0.1683 -0.1168 0.9788 0.4169 -0.8913 -0.1780 44.260 -170.755 -105.186 A 420 ALA A 139 ALA~? B 182 GLY A 145 GLY~? B 183 GLY A 144 GLY~? ULMNm 3 2phk_c03 MC-PEPTIDE user 6 3 RMSD = 0.91 A TRANSFORM 0.0515 0.3909 0.9190 0.5586 -0.7741 0.2979 -0.8278 -0.4980 0.2583 -61.919 -1.437 30.867 A 149 ASP B 52 ASP~? A 151 LYS B 48 LYS~? A 154 ASN B 49 ASN~? ULMNm 3 1zrz_c03 PROTEIN KINASE C, IOTA user 5 3 RMSD = 1.03 A TRANSFORM 0.5335 -0.5047 -0.6787 0.5234 -0.4333 0.7337 0.6644 0.7466 -0.0330 78.079 -35.143 -6.632 A 369 ASP B 46 ASP~? A 371 LYS B 154 LYS~? A 374 ASN B 153 ASN~? ULMNm 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 3 3 RMSD = 1.07 A TRANSFORM -0.8115 0.5624 0.1590 0.0515 0.3399 -0.9391 0.5821 0.7538 0.3048 22.474 71.328 11.803 C 348 HIS B 137 HIS~? C 378 CYH A 117 CYH~? C 380 GLY A 113 GLY~? ULMNm 3 1zrz_c03 PROTEIN KINASE C, IOTA user 2 3 RMSD = 1.08 A TRANSFORM 0.6071 0.4050 0.6836 0.5825 0.3584 -0.7296 0.5405 -0.8412 0.0183 -50.956 67.928 21.260 A 369 ASP A 46 ASP~? A 371 LYS A 154 LYS~? A 374 ASN A 153 ASN~? ULMNm 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 3 3 RMSD = 1.08 A TRANSFORM 0.4155 0.0612 -0.9075 -0.7249 0.6250 -0.2897 -0.5494 -0.7783 -0.3040 84.045 33.443 56.274 B 348 HIS B 137 HIS~? B 378 CYH A 117 CYH~? B 380 GLY A 113 GLY~? ULMNm 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 3 3 RMSD = 1.09 A TRANSFORM -0.9775 0.2110 -0.0056 -0.2105 -0.9722 0.1029 -0.0163 -0.1017 -0.9947 27.598 12.456 91.130 A 167 LYS A 152 LYS~? A 169 LYS A 149 LYS~? A 327 GLU B 11 GLU.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 9 3 RMSD = 1.09 A TRANSFORM -0.1117 -0.4408 0.8906 -0.2919 0.8713 0.3946 0.9499 0.2158 0.2260 -80.334 -48.590 -69.097 A 49 ASP B 99 ASP~? A 147 THR B 42 THR.? A 294 ASP B 89 ASP~? ULMNm 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.10 A TRANSFORM -0.9032 -0.4061 -0.1392 -0.0013 -0.3218 0.9468 0.4293 -0.8553 -0.2901 66.540 -68.343 92.936 C 348 HIS A 137 HIS~? C 378 CYH B 117 CYH~? C 380 GLY B 113 GLY~? ULMNm 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.10 A TRANSFORM 0.4074 -0.1161 0.9059 -0.8245 -0.4733 0.3101 -0.3927 0.8732 0.2885 -59.657 7.206 -25.538 B 348 HIS A 137 HIS~? B 378 CYH B 117 CYH~? B 380 GLY B 113 GLY~? ULMNm 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 3 3 RMSD = 1.11 A TRANSFORM -0.4077 -0.0636 0.9109 0.7280 -0.6249 0.2821 -0.5513 -0.7781 -0.3011 -42.130 -32.956 56.039 A 348 HIS B 137 HIS~? A 378 CYH A 117 CYH~? A 380 GLY A 113 GLY~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 RMSD = 1.11 A TRANSFORM -0.0275 0.4546 -0.8903 -0.4484 -0.8016 -0.3955 0.8934 -0.3883 -0.2258 45.848 49.818 -20.274 A 49 ASP A 99 ASP~? A 147 THR A 42 THR.? A 294 ASP A 89 ASP~? ULMNm 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 3 3 RMSD = 1.13 A TRANSFORM 0.8579 -0.4973 -0.1293 -0.0453 -0.3239 0.9450 0.5118 0.8049 0.3004 18.218 -71.263 13.123 D 348 HIS B 137 HIS~? D 378 CYH A 117 CYH~? D 380 GLY A 113 GLY~? ULMNm 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.13 A TRANSFORM -0.3992 0.1170 -0.9093 0.8276 0.4729 -0.3025 -0.3946 0.8733 0.2856 102.062 -7.945 -25.296 A 348 HIS A 137 HIS~? A 378 CYH B 117 CYH~? A 380 GLY B 113 GLY~? ULMNm 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 1 3 RMSD = 1.16 A TRANSFORM 0.9364 0.3329 0.1111 0.0046 0.3048 -0.9524 0.3510 -0.8923 -0.2839 -18.335 70.015 95.199 D 348 HIS A 137 HIS~? D 378 CYH B 117 CYH~? D 380 GLY B 113 GLY~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.24 A TRANSFORM -0.3826 0.4008 -0.8324 -0.6972 -0.7165 -0.0245 0.6062 -0.5710 -0.5536 59.434 52.931 80.492 C 1 ALA A 79 ALA.? C 74 ASN A 29 ASN~? C 75 GLY A 30 GLY~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.27 A TRANSFORM -0.3809 -0.8830 0.2741 0.7034 -0.0843 0.7058 0.6001 -0.4617 -0.6533 18.403 10.956 169.063 A 1 ALA A 79 ALA.? A 74 ASN A 29 ASN~? A 75 GLY A 30 GLY~? ULMNm 3 1zrz_c03 PROTEIN KINASE C, IOTA user 6 3 RMSD = 1.29 A TRANSFORM 0.5389 0.1644 -0.8262 0.7127 -0.6118 0.3431 0.4490 0.7737 0.4469 76.364 3.152 -47.050 A 369 ASP B 52 ASP~? A 371 LYS B 48 LYS~? A 374 ASN B 49 ASN~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.30 A TRANSFORM 0.4170 0.4510 -0.7891 -0.7731 0.6325 -0.0471 -0.4779 -0.6298 -0.6124 12.524 35.438 183.703 D 1 ALA A 79 ALA.? D 74 ASN A 29 ASN~? D 75 GLY A 30 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.30 A TRANSFORM 0.4488 -0.8318 0.3267 0.7441 0.1454 -0.6520 -0.4948 -0.5357 -0.6842 40.777 37.705 96.124 B 1 ALA A 79 ALA.? B 74 ASN A 29 ASN~? B 75 GLY A 30 GLY~? ULMNm 3 1vom_c00 MYOSIN user 2 3 RMSD = 1.31 A TRANSFORM -0.4519 -0.7858 0.4222 -0.0067 0.4763 0.8793 0.8920 -0.3945 0.2205 49.283 -57.904 -45.338 233 ASN B 151 ASN~? 457 GLY B 145 GLY~? 459 GLU A 127 GLU~? ULMNm 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 RMSD = 1.34 A TRANSFORM -0.5906 0.6194 -0.5172 0.7900 0.3131 -0.5272 0.1646 0.7199 0.6742 62.525 53.178 -46.703 A 243 THR B 23 THR~? A 345 PHE B 133 PHE~? A 352 CYH B 117 CYH~? ULMNm 3 1vom_c00 MYOSIN user 1 3 RMSD = 1.34 A TRANSFORM -0.3051 0.8543 -0.4209 -0.0903 -0.4659 -0.8802 0.9480 0.2305 -0.2193 84.376 104.212 -22.344 233 ASN A 151 ASN~? 457 GLY A 145 GLY~? 459 GLU B 127 GLU~? ULMNm 3 1xqd_c02 CYTOCHROME P450 55A1 user 1 3 RMSD = 1.36 A TRANSFORM -0.6925 -0.5074 0.5129 0.7208 -0.4572 0.5209 0.0298 -0.7304 -0.6823 1.853 -16.158 93.071 A 243 THR A 23 THR~? A 345 PHE A 133 PHE~? A 352 CYH A 117 CYH~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.37 A TRANSFORM -0.6329 -0.6771 -0.3755 -0.1699 -0.3517 0.9206 0.7554 -0.6464 -0.1076 63.139 57.515 17.271 193 ASP A 99 ASP~? 231 ASP A 82 ASP.? 294 ASP A 46 ASP~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 1 3 RMSD = 1.38 A TRANSFORM 0.5305 0.3431 -0.7751 0.4583 0.6532 0.6028 -0.7131 0.6750 -0.1893 50.191 29.157 10.951 A 459 ASN A 28 ASN~? A 460 GLY A 30 GLY~? A 461 ASN A 29 ASN~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.39 A TRANSFORM -0.5812 0.7455 0.3264 0.1645 -0.2852 0.9443 -0.7970 -0.6024 -0.0431 -28.531 -59.729 160.702 A 70 ALA B 79 ALA.? A 126 LEU B 76 LEU.? A 158 GLU B 66 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.41 A TRANSFORM 0.4196 -0.6309 0.6527 0.3427 -0.5557 -0.7575 -0.8406 -0.5414 0.0170 -63.058 61.360 156.527 C 70 ALA B 79 ALA.? C 126 LEU B 76 LEU.? C 158 GLU B 66 GLU~? ULMNm 3 1wbf_p00 PROTEIN (AGGLUTININ) user 6 3 RMSD = 1.41 A TRANSFORM 0.7621 0.6464 0.0362 0.5432 -0.6689 0.5075 -0.3522 0.3671 0.8609 -29.789 -61.721 -53.888 A 44 ASN B 33 ASN~? A 213 PRO B 81 PRO.? A 219 ASN B 62 ASN~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 4 3 RMSD = 1.42 A TRANSFORM 0.4423 -0.4346 0.7846 0.3133 -0.7448 -0.5892 -0.8404 -0.5064 0.1933 -60.491 154.270 4.472 A 459 ASN B 28 ASN~? A 460 GLY B 30 GLY~? A 461 ASN B 29 ASN~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.45 A TRANSFORM -0.0165 0.9401 -0.3405 0.8453 -0.1688 -0.5070 0.5341 0.2962 0.7918 29.883 104.303 35.534 A 1 ALA B 79 ALA.? A 74 ASN B 29 ASN~? A 75 GLY B 30 GLY~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 RMSD = 1.45 A TRANSFORM 0.5865 -0.7099 -0.3900 -0.2166 -0.6014 0.7690 0.7805 0.3665 0.5065 13.532 -24.036 7.771 B 34 SER B 26 SER~? B 37 ASN B 28 ASN~? B 45 THR B 105 THR~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 9 3 RMSD = 1.49 A TRANSFORM 0.9145 0.3160 0.2528 0.1779 0.2472 -0.9525 0.3634 -0.9160 -0.1699 -11.407 162.785 70.253 A 228 ASP B 46 ASP~? A 261 ASP B 109 ASP~? A 329 ASP B 99 ASP~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.50 A TRANSFORM 0.6747 0.5842 0.4510 -0.0505 0.6462 -0.7615 0.7363 -0.4910 -0.4655 -79.830 73.890 104.525 B 34 SER A 26 SER~? B 37 ASN A 28 ASN~? B 45 THR A 105 THR~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.50 A TRANSFORM 0.7457 0.6403 -0.1842 0.4789 -0.3230 0.8163 -0.4631 0.6969 0.5475 46.824 -72.137 -24.396 B 1 ALA B 79 ALA.? B 74 ASN B 29 ASN~? B 75 GLY B 30 GLY~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 4 3 RMSD = 1.50 A TRANSFORM 0.8490 -0.4653 -0.2505 0.1305 -0.2747 0.9526 0.5120 0.8415 0.1725 45.458 18.759 6.745 A 228 ASP A 46 ASP~? A 261 ASP A 109 ASP~? A 329 ASP A 99 ASP~?