*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 17 3 RMSD = 0.69 A TRANSFORM -0.7999 0.2993 -0.5201 -0.3509 -0.9364 0.0009 0.4868 -0.1832 -0.8541 -6.168 14.308 -25.309 141 ASP D 448 ASP.? 166 GLY D 414 GLY.? 169 GLU D 363 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 12 3 RMSD = 0.81 A TRANSFORM -0.0612 0.9521 0.2996 0.7706 -0.1457 0.6204 -0.6343 -0.2688 0.7248 20.498 53.619 62.751 A 228 ASP C 426 ASP.? A 260 ASP A 349 ASP.? A 329 ASP A 430 ASP.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 0.92 A TRANSFORM -0.1267 0.5893 0.7979 -0.4710 0.6722 -0.5712 0.8730 0.4482 -0.1924 55.376 33.228 -24.838 199 ASP C 426 ASP.? 242 GLU D 342 GLU^? 329 ASP A 430 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 5 3 RMSD = 0.93 A TRANSFORM 0.7257 -0.6608 -0.1916 0.5743 0.7352 -0.3601 -0.3788 -0.1513 -0.9130 23.311 33.945 38.137 A 228 ASP A 426 ASP.? A 260 ASP C 349 ASP.? A 329 ASP C 430 ASP.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 5 3 RMSD = 0.98 A TRANSFORM 0.6914 -0.7216 -0.0346 -0.4713 -0.4142 -0.7787 -0.5475 -0.5547 0.6265 32.680 -7.643 50.994 B 56 GLU C 436 GLU^? B 67 ARG C 368 ARG.? B 86 HIS C 381 HIS~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 0.98 A TRANSFORM -0.1573 0.9340 -0.3208 0.9821 0.1139 -0.1500 0.1036 0.3386 0.9352 21.303 26.052 -60.510 D 465 GLY A 374 GLY.? D 501 ASP B 315 ASP.? E 367 TYR A 418 TYR^? ULMNm 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 RMSD = 0.99 A TRANSFORM 0.5301 -0.6350 0.5619 -0.8469 -0.4293 0.3138 -0.0419 0.6422 0.7654 10.569 64.407 44.334 D 57 GLU A 363 GLU~? D 226 THR A 420 THR^? D 229 LYS A 403 LYS^? ULMNm 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 RMSD = 0.99 A TRANSFORM 0.6079 0.2574 -0.7512 -0.4881 0.8673 -0.0978 -0.6264 -0.4260 -0.6528 11.658 42.927 88.910 C 57 GLU A 363 GLU~? C 226 THR A 420 THR^? C 229 LYS A 403 LYS^? ULMNm 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 RMSD = 0.99 A TRANSFORM 0.2786 -0.8746 -0.3967 0.8551 0.4140 -0.3122 -0.4373 0.2523 -0.8632 27.714 79.050 73.606 B 57 GLU A 363 GLU~? B 226 THR A 420 THR^? B 229 LYS A 403 LYS^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 12 3 RMSD = 0.99 A TRANSFORM 0.6015 -0.7908 0.1134 0.6732 0.5782 0.4610 0.4301 0.2010 -0.8801 43.166 17.180 -49.372 D 465 GLY B 374 GLY.? D 501 ASP B 315 ASP.? E 367 TYR B 418 TYR^? ULMNm 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 RMSD = 0.99 A TRANSFORM 0.8332 0.5108 0.2119 0.5036 -0.8591 0.0908 -0.2284 -0.0311 0.9731 -11.254 100.122 51.516 A 57 GLU A 363 GLU~? A 226 THR A 420 THR^? A 229 LYS A 403 LYS^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 10 3 RMSD = 1.00 A TRANSFORM -0.1268 -0.9355 -0.3299 -0.8985 0.2492 -0.3614 -0.4203 -0.2506 0.8721 51.240 35.936 -14.666 A 465 GLY B 374 GLY.? A 501 ASP B 315 ASP.? B 367 TYR B 418 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 1.01 A TRANSFORM -0.8579 0.5123 -0.0394 -0.4956 -0.8047 0.3267 -0.1357 -0.2998 -0.9443 30.113 47.596 -4.739 A 465 GLY A 374 GLY.? A 501 ASP B 315 ASP.? B 367 TYR A 418 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 14 3 RMSD = 1.02 A TRANSFORM -0.4743 -0.8543 0.2124 -0.8803 0.4638 -0.1002 0.0129 0.2345 0.9720 19.234 12.475 41.062 141 ASP C 448 ASP.? 166 GLY C 414 GLY.? 169 GLU C 363 GLU~? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 RMSD = 1.03 A TRANSFORM 0.8365 -0.4529 -0.3085 0.4641 0.2864 0.8382 0.2912 0.8443 -0.4497 27.293 73.287 -3.282 A 225 HIS B 381 HIS.? A 259 TYR B 421 TYR^? A 552 ASP C 349 ASP.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 11 3 RMSD = 1.04 A TRANSFORM 0.4946 -0.6961 0.5203 0.4793 0.7179 0.5048 0.7250 0.0003 -0.6888 37.321 14.659 -47.832 D 465 GLY B 374 GLY.? D 501 ASP A 315 ASP.? E 367 TYR B 418 TYR^? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 5 3 RMSD = 1.05 A TRANSFORM 0.7521 -0.6558 -0.0653 0.4142 0.3933 0.8209 0.5126 0.6444 -0.5674 32.237 69.882 4.200 A 225 HIS B 381 HIS.? A 259 TYR B 421 TYR^? A 552 ASP C 430 ASP.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 15 3 RMSD = 1.08 A TRANSFORM 0.4716 -0.7702 0.4294 0.5815 0.6376 0.5053 0.6630 -0.0114 -0.7486 43.551 34.000 -83.612 D 465 GLY C 374 GLY.? D 501 ASP D 315 ASP.? E 367 TYR C 418 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 9 3 RMSD = 1.09 A TRANSFORM -0.0285 -0.9946 -0.1001 -0.6991 0.0914 -0.7092 -0.7145 -0.0497 0.6979 49.613 42.045 -16.397 A 465 GLY B 374 GLY.? A 501 ASP A 315 ASP.? B 367 TYR B 418 TYR^? ULMNm 3 1pyl_c00 RIBONUCLEASE user 4 3 RMSD = 1.09 A TRANSFORM -0.7591 0.3544 -0.5461 0.3873 -0.4284 -0.8164 0.5232 0.8312 -0.1879 12.707 -17.928 -14.906 A 56 GLU C 436 GLU^? A 67 ARG C 368 ARG.? A 86 HIS C 381 HIS~? ULMNm 3 1pyl_c01 RIBONUCLEASE user 7 3 RMSD = 1.11 A TRANSFORM -0.0437 0.9835 0.1758 -0.8492 -0.1292 0.5120 -0.5262 0.1269 -0.8408 41.379 38.850 -2.539 B 56 GLU D 436 GLU^? B 67 ARG D 368 ARG.? B 86 HIS D 381 HIS.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 12 3 RMSD = 1.13 A TRANSFORM -0.1255 -0.9791 -0.1602 -0.7441 0.1997 -0.6375 -0.6562 -0.0392 0.7536 36.749 25.716 19.113 A 465 GLY C 374 GLY.? A 501 ASP D 315 ASP.? B 367 TYR C 418 TYR^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 5 3 RMSD = 1.16 A TRANSFORM -0.3653 0.6977 -0.6162 0.3884 0.7158 0.5803 -0.8460 0.0273 0.5325 12.984 47.599 -16.985 D 465 GLY A 399 GLY.? D 501 ASP C 387 ASP~? E 367 TYR D 418 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 5 3 RMSD = 1.17 A TRANSFORM -0.5715 -0.1189 -0.8119 0.0562 -0.9928 0.1059 0.8187 -0.0149 -0.5741 10.217 39.756 -49.131 A 465 GLY A 399 GLY.? A 501 ASP C 387 ASP~? B 367 TYR D 418 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.17 A TRANSFORM 0.1664 0.9448 -0.2824 -0.8665 0.2768 0.4154 -0.4706 -0.1756 -0.8647 -28.994 34.060 8.039 141 ASP C 349 ASP.? 166 GLY A 399 GLY.? 169 GLU A 394 GLU~? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 RMSD = 1.19 A TRANSFORM -0.9238 0.0576 -0.3786 0.3578 0.4820 -0.7998 -0.1364 0.8743 0.4658 55.494 -26.881 12.587 A 261 GLY C 414 GLY.? B 17 GLN C 409 GLN^? B 140 GLU C 411 GLU.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 19 3 RMSD = 1.20 A TRANSFORM -0.6507 0.2601 0.7134 -0.7219 0.0796 -0.6874 0.2356 0.9623 -0.1360 53.115 86.565 -0.427 A 228 ASP C 430 ASP.? A 260 ASP C 350 ASP.? A 329 ASP A 426 ASP.? ULMNm 3 1pyl_c00 RIBONUCLEASE user 6 3 RMSD = 1.20 A TRANSFORM -0.4448 -0.8452 0.2963 -0.3047 0.4539 0.8374 0.8422 -0.2822 0.4594 42.376 42.605 8.755 A 56 GLU D 436 GLU^? A 67 ARG D 368 ARG.? A 86 HIS D 381 HIS.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 3 3 RMSD = 1.21 A TRANSFORM 0.8219 -0.5696 -0.0049 -0.3262 -0.4636 -0.8238 -0.4670 -0.6787 0.5669 43.372 20.415 28.918 B 56 GLU B 436 GLU^? B 67 ARG B 368 ARG.? B 86 HIS B 381 HIS.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 2 3 RMSD = 1.22 A TRANSFORM -0.1557 0.9732 0.1690 -0.8661 -0.2168 0.4504 -0.4749 0.0762 -0.8767 26.119 11.490 24.527 B 56 GLU A 436 GLU^? B 67 ARG A 368 ARG.? B 86 HIS A 381 HIS.? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 RMSD = 1.24 A TRANSFORM -0.7257 -0.6879 0.0106 0.1973 -0.1933 0.9611 0.6591 -0.6996 -0.2760 68.558 3.771 9.546 A 261 GLY A 414 GLY.? B 17 GLN A 409 GLN^? B 140 GLU A 411 GLU.? ULMNm 3 1pyl_c00 RIBONUCLEASE user 1 3 RMSD = 1.24 A TRANSFORM -0.3736 -0.8893 0.2636 -0.4110 0.4135 0.8124 0.8315 -0.1952 0.5201 33.148 3.067 1.017 A 56 GLU A 436 GLU^? A 67 ARG A 368 ARG.? A 86 HIS A 381 HIS.? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 RMSD = 1.25 A TRANSFORM -0.5869 -0.7708 -0.2479 -0.0806 0.3603 -0.9294 -0.8056 0.5255 0.2735 85.713 -58.425 -6.666 B 37 ASP C 357 ASP.? B 56 ILE C 343 ILE^? B 82 TYR C 354 TYR^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.27 A TRANSFORM -0.9885 0.1104 -0.1038 -0.1362 -0.3466 0.9281 -0.0665 -0.9315 -0.3576 82.820 -27.066 -7.932 B 37 ASP A 357 ASP.? B 56 ILE A 343 ILE^? B 82 TYR A 354 TYR^? ULMNm 3 3hde_o00 LYSOZYME user 4 3 RMSD = 1.27 A TRANSFORM -0.3766 -0.2589 0.8895 0.6600 -0.7487 0.0616 -0.6500 -0.6102 -0.4529 39.445 -33.781 6.032 A 35 GLU D 330 GLU~? A 44 ASP D 315 ASP.? A 50 THR D 318 THR.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.27 A TRANSFORM -0.4181 -0.8739 0.2477 -0.9065 0.3841 -0.1752 -0.0580 0.2978 0.9529 13.235 4.003 0.845 141 ASP B 448 ASP.? 166 GLY B 414 GLY.? 169 GLU B 363 GLU~? ULMNm 3 1pyl_c00 RIBONUCLEASE user 2 3 RMSD = 1.28 A TRANSFORM -0.7744 0.2256 -0.5911 0.5168 -0.3133 -0.7967 0.3649 0.9225 -0.1260 25.017 17.172 -10.676 A 56 GLU B 436 GLU^? A 67 ARG B 368 ARG.? A 86 HIS B 381 HIS.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 18 3 RMSD = 1.29 A TRANSFORM -0.0122 0.5297 0.8481 -0.6312 -0.6620 0.4043 -0.7756 0.5303 -0.3424 27.908 106.968 39.497 A 228 ASP C 430 ASP.? A 260 ASP A 402 ASP.? A 329 ASP A 426 ASP.? ULMNm 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 5 3 RMSD = 1.30 A TRANSFORM -0.5042 0.0302 0.8630 -0.7685 0.4401 -0.4644 0.3938 0.8974 0.1987 43.915 48.310 26.034 13 ASP C 357 ASP.? 41 HIS C 338 HIS~? 224 GLN D 427 GLN.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.31 A TRANSFORM -0.9892 0.1095 -0.0974 -0.1319 -0.3763 0.9171 -0.0638 -0.9200 -0.3866 79.865 -10.057 19.961 A 37 ASP A 357 ASP.? A 56 ILE A 343 ILE^? A 82 TYR A 354 TYR^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 7 3 RMSD = 1.31 A TRANSFORM 0.0480 0.6412 0.7659 -0.3223 -0.7158 0.6195 -0.9454 0.2766 -0.1723 27.587 100.841 53.410 A 228 ASP C 426 ASP.? A 261 ASP A 402 ASP.? A 329 ASP A 430 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 4 3 RMSD = 1.31 A TRANSFORM 0.7310 -0.3133 -0.6062 -0.5063 0.3466 -0.7896 -0.4575 -0.8842 -0.0948 12.888 73.342 61.615 A 228 ASP A 426 ASP.? A 261 ASP C 402 ASP.? A 329 ASP C 430 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 8 3 RMSD = 1.32 A TRANSFORM 0.6358 -0.2497 -0.7304 -0.7415 0.0651 -0.6678 -0.2143 -0.9661 0.1438 9.061 86.696 55.580 A 228 ASP A 430 ASP.? A 260 ASP C 402 ASP.? A 329 ASP C 426 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 3 3 RMSD = 1.32 A TRANSFORM 0.1314 -0.5074 -0.8516 -0.7723 -0.5910 0.2329 0.6215 -0.6271 0.4695 34.448 108.931 25.977 A 228 ASP A 426 ASP.? A 261 ASP A 350 ASP.? A 329 ASP C 430 ASP.? ULMNm 3 2dbt_c00 CHITINASE C user 3 3 RMSD = 1.32 A TRANSFORM -0.7244 0.6719 0.1543 0.6478 0.7400 -0.1811 0.2359 0.0312 0.9713 74.942 0.689 -9.412 A 147 GLU A 342 GLU^? A 156 GLU A 436 GLU^? A 194 ASN B 324 ASN.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 13 3 RMSD = 1.34 A TRANSFORM -0.9984 -0.0482 0.0284 -0.0435 0.9880 0.1485 0.0352 -0.1470 0.9885 28.242 -0.379 40.383 141 ASP C 440 ASP^? 166 GLY D 323 GLY.? 169 GLU C 330 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.35 A TRANSFORM 0.4963 -0.5608 -0.6628 0.8675 0.2911 0.4033 0.0333 0.7751 -0.6309 15.076 -19.505 -23.181 141 ASP B 357 ASP.? 166 GLY B 374 GLY.? 169 GLU B 378 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 6 3 RMSD = 1.35 A TRANSFORM 0.7873 -0.4512 -0.4202 0.1706 0.8143 -0.5548 -0.5925 -0.3651 -0.7181 15.563 43.333 50.625 A 228 ASP A 426 ASP.? A 260 ASP C 350 ASP.? A 329 ASP C 430 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.36 A TRANSFORM -0.6406 -0.6976 -0.3210 0.7169 -0.6931 0.0757 0.2753 0.1816 -0.9440 26.370 6.993 9.783 141 ASP A 440 ASP^? 166 GLY B 323 GLY.? 169 GLU A 330 GLU~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.37 A TRANSFORM -0.2773 0.7293 -0.6255 0.1613 0.6772 0.7179 -0.9471 -0.0982 0.3054 10.657 53.869 -15.720 D 465 GLY A 399 GLY.? D 501 ASP C 387 ASP~? E 367 TYR D 437 TYR^? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 6 3 RMSD = 1.37 A TRANSFORM 0.7424 0.0122 0.6699 0.4571 -0.7403 -0.4931 -0.4899 -0.6722 0.5551 -11.452 103.874 20.781 A 459 ASN A 356 ASN.? A 460 GLY B 323 GLY.? A 461 ASN B 324 ASN.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.37 A TRANSFORM -0.2087 -0.8287 0.5193 -0.6579 0.5119 0.5523 0.7236 0.2264 0.6521 34.013 37.198 -42.796 A 465 GLY A 429 GLY.? A 501 ASP D 357 ASP.? B 367 TYR A 355 TYR^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 20 3 RMSD = 1.38 A TRANSFORM -0.1511 -0.9884 0.0158 -0.8859 0.1425 0.4415 0.4386 -0.0528 0.8971 41.211 89.801 -46.752 D 465 GLY C 429 GLY.? D 501 ASP A 387 ASP~? E 367 TYR C 326 TYR^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 7 3 RMSD = 1.38 A TRANSFORM 0.4134 -0.9074 -0.0760 0.5567 0.3179 -0.7675 -0.7206 -0.2750 -0.6365 30.158 30.520 -22.128 D 465 GLY A 429 GLY.? D 501 ASP D 357 ASP.? E 367 TYR A 355 TYR^? ULMNm 3 1bu7_c02 CYTOCHROME P450 user 1 3 RMSD = 1.38 A TRANSFORM 0.4273 -0.7851 -0.4484 0.5309 -0.1836 0.8273 0.7319 0.5915 -0.3384 47.719 42.231 26.286 A 268 THR A 369 THR~? A 393 PHE A 352 PHE^? A 400 CYH A 380 CYH~? ULMNm 3 1bu7_c03 CYTOCHROME P450 user 3 3 RMSD = 1.38 A TRANSFORM 0.3692 -0.7282 -0.5774 -0.7233 -0.6152 0.3135 0.5835 -0.3019 0.7539 28.271 166.607 73.379 B 268 THR C 369 THR~? B 393 PHE C 352 PHE^? B 400 CYH C 380 CYH~? ULMNm 3 1bu7_c03 CYTOCHROME P450 user 1 3 RMSD = 1.38 A TRANSFORM -0.4938 0.7104 0.5015 -0.7662 -0.0827 -0.6373 0.4113 0.6989 -0.5851 36.546 149.520 47.658 B 268 THR A 369 THR~? B 393 PHE A 352 PHE^? B 400 CYH A 380 CYH~? ULMNm 3 1bu7_c02 CYTOCHROME P450 user 3 3 RMSD = 1.38 A TRANSFORM -0.4484 0.7428 0.4972 0.4430 0.6678 -0.5982 0.7763 0.0480 0.6285 53.484 16.210 43.934 A 268 THR C 369 THR~? A 393 PHE C 352 PHE^? A 400 CYH C 380 CYH~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 18 3 RMSD = 1.39 A TRANSFORM 0.6734 0.6504 -0.3513 -0.3942 0.7180 0.5736 -0.6254 0.2478 -0.7400 -30.083 111.974 -4.044 A 459 ASN C 356 ASN.? A 460 GLY D 323 GLY.? A 461 ASN D 324 ASN.? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 12 3 RMSD = 1.39 A TRANSFORM -0.9573 0.0944 0.2733 0.2770 0.5703 0.7733 0.0829 -0.8160 0.5721 14.615 47.046 86.156 B 34 SER D 358 SER.? B 37 ASN D 356 ASN.? B 45 THR D 369 THR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 17 3 RMSD = 1.39 A TRANSFORM 0.6157 -0.7323 -0.2908 0.6655 0.6809 -0.3057 -0.4219 0.0053 -0.9066 -6.376 -8.152 -19.241 A 465 GLY C 429 GLY.? A 501 ASP A 387 ASP~? B 367 TYR C 326 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 15 3 RMSD = 1.39 A TRANSFORM -0.7235 -0.6171 -0.3094 0.6653 -0.7429 -0.0741 0.1841 0.2594 -0.9481 16.281 -7.998 -27.046 141 ASP D 440 ASP^? 166 GLY C 323 GLY.? 169 GLU D 330 GLU~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 RMSD = 1.40 A TRANSFORM -0.5557 0.4251 0.7145 0.6363 0.7706 0.0363 0.5351 -0.4748 0.6987 17.155 31.103 28.076 179 ASP C 430 ASP.? 214 ASP A 357 ASP.? 289 ASP A 426 ASP.? ULMNm 3 3hde_o01 LYSOZYME user 3 3 RMSD = 1.40 A TRANSFORM 0.9106 0.1512 0.3847 -0.3856 0.6457 0.6590 0.1488 0.7485 -0.6463 -40.831 4.938 -60.762 B 35 GLU D 330 GLU~? B 44 ASP D 315 ASP.? B 50 THR D 318 THR.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 14 3 RMSD = 1.40 A TRANSFORM -0.9664 -0.2078 0.1510 -0.2143 0.9764 -0.0276 0.1417 0.0590 0.9881 63.132 34.980 -22.557 D 465 GLY C 374 GLY.? D 501 ASP C 387 ASP~? E 367 TYR D 437 TYR^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 8 3 RMSD = 1.40 A TRANSFORM -0.4969 0.3097 0.8107 -0.8662 -0.1203 -0.4850 0.0527 0.9432 -0.3281 52.582 96.611 6.220 A 228 ASP C 426 ASP.? A 261 ASP C 350 ASP.? A 329 ASP A 430 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.40 A TRANSFORM -0.9903 -0.1286 -0.0529 -0.1329 0.9874 0.0861 -0.0411 -0.0923 0.9949 17.857 -14.738 3.417 141 ASP B 440 ASP^? 166 GLY A 323 GLY.? 169 GLU B 330 GLU~? ULMNm 3 3hde_o02 LYSOZYME user 3 3 RMSD = 1.41 A TRANSFORM 0.1978 -0.3220 0.9259 0.9564 0.2704 -0.1102 0.2149 -0.9073 -0.3614 47.273 -50.387 -9.920 C 35 GLU C 330 GLU~? C 44 ASP C 315 ASP.? C 50 THR C 318 THR.? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 11 3 RMSD = 1.42 A TRANSFORM 0.6501 0.6813 -0.3365 -0.5275 0.7234 0.4454 -0.5469 0.1120 -0.8297 -15.013 80.484 17.562 A 459 ASN B 356 ASN.? A 460 GLY A 323 GLY.? A 461 ASN A 324 ASN.? ULMNm 3 3hde_o02 LYSOZYME user 2 3 RMSD = 1.42 A TRANSFORM 0.1641 -0.1661 0.9723 0.8709 0.4872 -0.0638 0.4632 -0.8573 -0.2247 12.683 -40.543 7.336 C 35 GLU B 330 GLU~? C 44 ASP B 315 ASP.? C 50 THR B 318 THR.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 39 3 RMSD = 1.42 A TRANSFORM -0.3187 0.1189 0.9404 -0.5964 0.7460 -0.2964 0.7367 0.6553 0.1669 65.343 33.959 -2.163 I 303 TYR D 418 TYR^? I 306 VAL D 419 VAL^? I 308 VAL D 404 VAL^? ULMNm 3 1bu7_c03 CYTOCHROME P450 user 4 3 RMSD = 1.42 A TRANSFORM -0.4221 0.6501 0.6318 -0.7937 0.0718 -0.6041 0.4381 0.7564 -0.4857 72.215 133.154 28.757 B 268 THR D 369 THR~? B 393 PHE D 352 PHE^? B 400 CYH D 380 CYH~? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 34 3 RMSD = 1.42 A TRANSFORM 0.4121 -0.0612 -0.9091 0.8609 -0.3006 0.4105 0.2984 0.9518 0.0712 -7.768 30.332 -10.257 I 303 TYR C 437 TYR^? I 306 VAL C 419 VAL^? I 308 VAL C 404 VAL^? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 23 3 RMSD = 1.43 A TRANSFORM 0.8009 -0.0836 0.5930 0.3159 -0.7823 -0.5369 -0.5088 -0.6173 0.6001 3.375 74.493 43.124 A 459 ASN D 356 ASN.? A 460 GLY C 323 GLY.? A 461 ASN C 324 ASN.? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 RMSD = 1.44 A TRANSFORM 0.4749 -0.2153 -0.8533 0.0019 0.9699 -0.2436 -0.8800 -0.1141 -0.4610 6.680 38.923 73.307 179 ASP A 315 ASP.? 214 ASP C 430 ASP.? 289 ASP B 315 ASP.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 9 3 RMSD = 1.44 A TRANSFORM -0.0834 0.2478 0.9652 0.4629 0.8674 -0.1827 0.8825 -0.4316 0.1871 18.147 14.724 -0.362 I 303 TYR A 437 TYR^? I 306 VAL A 419 VAL^? I 308 VAL A 404 VAL^? ULMNm 3 1bu7_c02 CYTOCHROME P450 user 4 3 RMSD = 1.44 A TRANSFORM 0.3518 -0.7292 -0.5870 0.5462 -0.3493 0.7613 0.7602 0.5885 -0.2754 14.041 65.574 11.481 A 268 THR D 369 THR~? A 393 PHE D 352 PHE^? A 400 CYH D 380 CYH~? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7649 -0.4795 -0.4302 0.5907 0.2559 0.7652 0.2568 0.8394 -0.4790 31.173 74.170 -2.045 A 225 HIS B 381 HIS.? A 259 TYR B 421 TYR^? A 552 ASP C 350 ASP.? ULMNm 3 1myr_c00 MYROSINASE user 1 3 RMSD = 1.44 A TRANSFORM -0.5933 -0.7063 -0.3862 -0.0964 -0.4140 0.9051 0.7992 -0.5743 -0.1776 60.224 132.324 35.389 187 GLN A 400 GLN.? 328 ASN A 398 ASN~? 409 GLU A 394 GLU~? ULMNm 3 1myr_c00 MYROSINASE user 2 3 RMSD = 1.44 A TRANSFORM -0.9969 -0.0547 0.0557 -0.0695 0.2982 -0.9520 -0.0355 0.9529 0.3011 47.837 133.908 13.245 187 GLN B 400 GLN.? 328 ASN B 398 ASN~? 409 GLU B 394 GLU~? ULMNm 3 1myr_c00 MYROSINASE user 3 3 RMSD = 1.45 A TRANSFORM -0.7656 -0.4804 -0.4278 -0.2738 -0.3585 0.8925 0.5822 -0.8004 -0.1429 46.850 172.387 25.544 187 GLN D 400 GLN.? 328 ASN D 398 ASN~? 409 GLU D 394 GLU~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 RMSD = 1.45 A TRANSFORM 0.1394 -0.5547 -0.8203 0.9620 -0.1207 0.2450 0.2349 0.8233 -0.5168 1.291 40.197 1.324 179 ASP A 430 ASP.? 214 ASP C 357 ASP.? 289 ASP C 426 ASP.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 23 3 RMSD = 1.45 A TRANSFORM 0.4837 -0.0546 -0.8736 0.8433 -0.2380 0.4818 0.2342 0.9697 0.0690 31.853 26.110 -18.207 I 303 TYR B 437 TYR^? I 306 VAL B 419 VAL^? I 308 VAL B 404 VAL^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 45 3 RMSD = 1.45 A TRANSFORM 0.0319 0.1419 0.9894 0.4988 0.8556 -0.1388 0.8662 -0.4979 0.0435 58.033 11.461 -11.012 I 303 TYR D 437 TYR^? I 306 VAL D 419 VAL^? I 308 VAL D 404 VAL^? ULMNm 3 3hde_o02 LYSOZYME user 4 3 RMSD = 1.45 A TRANSFORM 0.4228 0.3263 -0.8455 0.5967 0.6019 0.5307 -0.6820 0.7289 -0.0598 -21.579 -24.111 12.690 C 35 GLU D 330 GLU~? C 44 ASP D 315 ASP.? C 50 THR D 318 THR.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 13 3 RMSD = 1.45 A TRANSFORM 0.0625 0.8334 0.5492 0.5412 -0.4906 0.6829 -0.8386 -0.2545 0.4816 21.466 67.947 66.522 A 228 ASP C 426 ASP.? A 260 ASP A 350 ASP.? A 329 ASP A 430 ASP.? ULMNm 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 13 3 RMSD = 1.46 A TRANSFORM 0.6444 -0.5215 0.5592 -0.7362 -0.6208 0.2695 -0.2066 0.5854 0.7840 18.660 77.865 86.811 D 57 GLU D 363 GLU~? D 226 THR D 420 THR^? D 229 LYS D 403 LYS^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.46 A TRANSFORM 0.4466 -0.5593 -0.6984 0.4725 -0.5154 0.7149 0.7598 0.6493 -0.0341 47.271 37.268 -23.195 199 ASP A 426 ASP.? 218 GLU C 342 GLU^? 329 ASP C 430 ASP.? ULMNm 3 2dbt_c01 CHITINASE C user 4 3 RMSD = 1.46 A TRANSFORM -0.1929 0.6253 -0.7562 -0.2776 0.7044 0.6533 -0.9411 -0.3359 -0.0377 48.006 44.659 18.532 B 147 GLU A 446 GLU~? B 156 GLU A 450 GLU~? B 194 ASN B 405 ASN^? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.46 A TRANSFORM 0.9850 0.1652 -0.0489 -0.0477 -0.0114 -0.9988 0.1656 -0.9862 0.0034 -37.660 63.518 -0.283 A 81 ASP A 357 ASP.? A 99 GLY B 323 GLY.? A 125 ASN A 333 ASN~? ULMNm 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 13 3 RMSD = 1.46 A TRANSFORM 0.4804 -0.7727 -0.4148 0.7471 0.6083 -0.2680 -0.4594 0.1812 -0.8695 -5.469 65.353 45.983 B 57 GLU D 363 GLU~? B 226 THR D 420 THR^? B 229 LYS D 403 LYS^? ULMNm 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 13 3 RMSD = 1.46 A TRANSFORM 0.6899 0.6764 0.2578 0.6823 -0.7266 0.0804 -0.2417 -0.1204 0.9628 -1.546 85.327 93.206 A 57 GLU D 363 GLU~? A 226 THR D 420 THR^? A 229 LYS D 403 LYS^? ULMNm 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 13 3 RMSD = 1.46 A TRANSFORM 0.5539 0.4174 -0.7204 -0.6689 0.7382 -0.0867 -0.4957 -0.5299 -0.6881 -20.538 57.431 60.547 C 57 GLU D 363 GLU~? C 226 THR D 420 THR^? C 229 LYS D 403 LYS^? ULMNm 3 3hde_o00 LYSOZYME user 1 3 RMSD = 1.46 A TRANSFORM -0.4216 -0.2856 0.8606 0.7158 -0.6875 0.1225 -0.5567 -0.6676 -0.4943 4.569 -22.651 22.359 A 35 GLU A 330 GLU~? A 44 ASP A 315 ASP.? A 50 THR A 318 THR.? ULMNm 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 3 3 RMSD = 1.47 A TRANSFORM -0.6361 0.6588 0.4017 -0.3969 0.1671 -0.9025 0.6618 0.7335 -0.1552 56.290 -9.683 -29.667 A 21 GLN C 331 GLN~? A 41 TYR C 326 TYR^? A 43 ASN D 347 ASN^? ULMNm 3 2dbt_c00 CHITINASE C user 4 3 RMSD = 1.47 A TRANSFORM -0.1914 -0.6266 0.7554 -0.0675 0.7762 0.6268 0.9792 -0.0690 0.1908 70.605 -2.547 9.937 A 147 GLU A 446 GLU~? A 156 GLU A 450 GLU~? A 194 ASN B 405 ASN^? ULMNm 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 10 3 RMSD = 1.47 A TRANSFORM 0.3827 0.7976 -0.4662 -0.8409 0.0917 -0.5333 0.3826 -0.5962 -0.7058 -18.649 48.222 38.069 D 57 GLU C 363 GLU~? D 226 THR C 420 THR^? D 229 LYS C 403 LYS^? ULMNm 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 10 3 RMSD = 1.48 A TRANSFORM 0.9867 -0.1606 0.0265 0.1614 0.9864 -0.0317 0.0211 -0.0356 -0.9991 -7.130 78.534 25.607 A 57 GLU C 363 GLU~? A 226 THR C 420 THR^? A 229 LYS C 403 LYS^? ULMNm 3 2dbt_c02 CHITINASE C user 4 3 RMSD = 1.48 A TRANSFORM 0.5601 0.5750 -0.5964 0.3016 -0.8121 -0.4996 0.7716 -0.0999 0.6283 44.435 47.141 8.204 C 147 GLU A 446 GLU~? C 156 GLU A 450 GLU~? C 194 ASN B 405 ASN^? ULMNm 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 10 3 RMSD = 1.48 A TRANSFORM 0.4565 -0.0290 0.8892 -0.1460 -0.9884 0.0428 -0.8776 0.1494 0.4555 36.012 64.849 97.887 C 57 GLU C 363 GLU~? C 226 THR C 420 THR^? C 229 LYS C 403 LYS^? ULMNm 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 10 3 RMSD = 1.48 A TRANSFORM -0.1642 0.9073 0.3872 0.8431 -0.0747 0.5326 -0.5121 -0.4139 0.7526 18.931 94.854 102.384 B 57 GLU C 363 GLU~? B 226 THR C 420 THR^? B 229 LYS C 403 LYS^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 16 3 RMSD = 1.48 A TRANSFORM -0.7469 0.1172 0.6545 -0.2117 0.8912 -0.4012 0.6303 0.4383 0.6408 32.963 14.934 -43.437 A 465 GLY C 429 GLY.? A 501 ASP A 387 ASP~? B 367 TYR B 354 TYR^? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 7 3 RMSD = 1.48 A TRANSFORM -0.2533 0.7442 -0.6180 -0.9025 0.0482 0.4279 -0.3482 -0.6662 -0.6595 22.557 108.999 37.495 A 459 ASN B 324 ASN.? A 460 GLY B 323 GLY.? A 461 ASN A 356 ASN.? ULMNm 3 2dbt_c02 CHITINASE C user 3 3 RMSD = 1.49 A TRANSFORM 0.7758 -0.5836 0.2397 -0.6230 -0.6486 0.4373 0.0997 0.4886 0.8668 33.024 39.392 -6.389 C 147 GLU A 342 GLU^? C 156 GLU A 436 GLU^? C 194 ASN B 324 ASN.? ULMNm 3 1akd_c01 CYTOCHROME P450CAM user 1 3 RMSD = 1.49 A TRANSFORM -0.2305 -0.3930 0.8902 -0.9544 -0.0869 -0.2855 -0.1896 0.9154 0.3551 9.295 51.736 7.343 252 THR A 369 THR~? 350 PHE A 352 PHE^? 357 CYH A 380 CYH~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 19 3 RMSD = 1.49 A TRANSFORM -0.2749 -0.6010 0.7505 0.6979 -0.6617 -0.2742 -0.6613 -0.4483 -0.6013 46.801 45.325 -21.128 D 465 GLY C 429 GLY.? D 501 ASP A 387 ASP~? E 367 TYR B 354 TYR^? ULMNm 3 1akd_c01 CYTOCHROME P450CAM user 2 3 RMSD = 1.49 A TRANSFORM -0.1566 0.2845 -0.9458 -0.7337 -0.6745 -0.0814 0.6611 -0.6812 -0.3144 -22.051 57.891 6.104 252 THR C 369 THR~? 350 PHE C 352 PHE^? 357 CYH C 380 CYH~? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 1.49 A TRANSFORM -0.1909 -0.4900 -0.8506 -0.7384 -0.4992 0.4533 0.6467 -0.7146 0.2665 -3.101 126.040 94.345 B 137 ARG C 316 ARG.? B 141 THR C 318 THR.? B 235 ASP C 357 ASP.? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 4 3 RMSD = 1.50 A TRANSFORM 0.6404 0.6496 0.4096 -0.3696 -0.2068 0.9059 -0.6732 0.7316 -0.1076 -46.553 55.756 -21.751 A 81 ASP B 357 ASP.? A 99 GLY A 323 GLY.? A 125 ASN B 333 ASN~? ULMNm 3 2dbt_c01 CHITINASE C user 5 3 RMSD = 1.50 A TRANSFORM 0.1667 -0.7176 0.6762 0.8628 -0.2258 -0.4523 -0.4772 -0.6589 -0.5815 55.676 79.133 32.726 B 147 GLU A 450 GLU~? B 156 GLU A 446 GLU~? B 194 ASN B 405 ASN^? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 3 3 RMSD = 1.50 A TRANSFORM -0.3248 0.2260 -0.9184 -0.4927 0.7884 0.3683 -0.8073 -0.5721 0.1447 22.742 62.124 127.356 A 270 ASN A 405 ASN^? A 384 ASN A 376 ASN~? A 385 GLU A 378 GLU~?