*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 1 3 RMSD = 0.78 A TRANSFORM -0.5185 0.8127 -0.2658 -0.7579 -0.2928 0.5830 -0.3960 -0.5037 -0.7678 21.785 80.572 43.201 A 459 ASN A 2 ASN^? A 460 GLY A 3 GLY^? A 461 ASN A 4 ASN^? ULMNm 3 1ez2_c01 PHOSPHOTRIESTERASE user 2 3 RMSD = 0.97 A TRANSFORM -0.7438 0.1265 0.6563 0.4243 -0.6694 0.6099 -0.5164 -0.7321 -0.4443 38.794 -38.953 23.536 B 233 ASP A 94 ASP^? B 254 HIS A 73 HIS^? B 301 ASP A 67 ASP^? ULMNm 3 1ez2_c00 PHOSPHOTRIESTERASE user 2 3 RMSD = 0.98 A TRANSFORM -0.7714 0.0676 0.6328 -0.4294 0.6786 -0.5960 0.4697 0.7314 0.4944 38.884 3.763 11.456 A 233 ASP A 94 ASP^? A 254 HIS A 73 HIS^? A 301 ASP A 67 ASP^? ULMNm 3 1ez2_c01 PHOSPHOTRIESTERASE user 1 3 RMSD = 1.00 A TRANSFORM 0.6762 -0.5744 -0.4613 -0.6618 -0.7488 -0.0377 0.3237 -0.3308 0.8865 64.929 -18.826 -14.191 B 233 ASP A 67 ASP^? B 254 HIS A 73 HIS^? B 301 ASP A 94 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.02 A TRANSFORM 0.5267 0.8290 0.1882 -0.8188 0.5542 -0.1495 0.2283 0.0754 -0.9707 7.976 -84.352 -93.297 A 420 ALA A 119 ALA~? B 182 GLY A 85 GLY^? B 183 GLY A 114 GLY^? ULMNm 3 1ez2_c00 PHOSPHOTRIESTERASE user 1 3 RMSD = 1.03 A TRANSFORM 0.6819 -0.6064 -0.4090 0.6798 0.7318 0.0484 -0.2700 0.3110 -0.9112 62.890 -16.075 50.560 A 233 ASP A 67 ASP^? A 254 HIS A 73 HIS^? A 301 ASP A 94 ASP^? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 2 3 RMSD = 1.04 A TRANSFORM 0.8774 -0.0484 0.4773 0.4038 -0.4628 -0.7892 -0.2591 -0.8851 0.3865 -3.724 126.913 3.991 A 459 ASN A 4 ASN^? A 460 GLY A 3 GLY^? A 461 ASN A 2 ASN^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.04 A TRANSFORM -0.5692 0.7757 0.2726 0.6024 0.1677 0.7804 -0.5596 -0.6084 0.5627 16.629 -117.773 -129.777 A 183 GLY A 85 GLY^? B 419 GLY A 115 GLY~? B 420 ALA A 118 ALA~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.05 A TRANSFORM 0.4109 0.2471 0.8776 0.6167 -0.7842 -0.0679 -0.6714 -0.5691 0.4746 -24.128 -67.594 -124.269 A 183 GLY A 85 GLY^? B 419 GLY A 114 GLY^? B 420 ALA A 118 ALA~? ULMNm 3 3hde_o01 LYSOZYME user 4 3 RMSD = 1.07 A TRANSFORM -0.5637 -0.4005 -0.7224 0.6978 -0.6989 -0.1571 0.4419 0.5926 -0.6734 22.636 -9.152 -21.102 B 35 GLU A 90 GLU^? B 44 ASP A 67 ASP^? B 50 THR A 66 THR^? ULMNm 3 3hde_o00 LYSOZYME user 1 3 RMSD = 1.08 A TRANSFORM 0.0444 -0.8681 0.4944 -0.9967 -0.0050 0.0807 0.0676 0.4964 0.8655 -3.620 -11.568 -52.640 A 35 GLU A 90 GLU^? A 44 ASP A 67 ASP^? A 50 THR A 66 THR^? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 4 3 RMSD = 1.08 A TRANSFORM 0.2947 0.3202 0.9004 -0.8506 -0.3415 0.3998 -0.4355 0.8837 -0.1717 -30.727 33.999 8.001 B 66 HIS A 160 HIS.? B 110 GLY A 126 GLY~? B 140 TYR A 109 TYR^? ULMNm 3 3hde_o02 LYSOZYME user 4 3 RMSD = 1.12 A TRANSFORM -0.0499 0.8163 -0.5754 -0.0200 -0.5768 -0.8166 0.9986 0.0292 -0.0451 26.555 29.595 -12.064 C 35 GLU A 90 GLU^? C 44 ASP A 67 ASP^? C 50 THR A 66 THR^? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 4 3 RMSD = 1.13 A TRANSFORM 0.2263 0.8925 -0.3902 0.8767 -0.0120 0.4809 -0.4245 0.4510 0.7851 -5.533 -16.588 -9.893 C 66 HIS A 160 HIS.? C 110 GLY A 126 GLY~? C 140 TYR A 109 TYR^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.14 A TRANSFORM -0.1984 0.9747 -0.1032 -0.8534 -0.2236 -0.4708 0.4820 0.0054 -0.8762 35.177 -57.425 -101.983 A 420 ALA A 119 ALA~? B 182 GLY A 85 GLY^? B 183 GLY A 115 GLY~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 RMSD = 1.18 A TRANSFORM 0.1439 0.7572 -0.6371 -0.9375 0.3104 0.1572 -0.3168 -0.5747 -0.7545 48.637 82.773 67.915 229 ASP A 67 ASP^? 264 GLU A 14 GLU~? 328 ASP A 94 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.18 A TRANSFORM -0.8188 -0.3628 -0.4450 0.2551 -0.9242 0.2841 0.5143 -0.1191 -0.8493 82.950 -108.750 -101.711 A 420 ALA A 119 ALA~? B 182 GLY A 114 GLY^? B 183 GLY A 115 GLY~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.26 A TRANSFORM 0.8780 -0.4601 -0.1322 -0.2452 -0.1949 -0.9497 -0.4112 -0.8662 0.2839 58.193 60.236 21.441 199 ASP A 94 ASP^? 242 GLU A 101 GLU.? 329 ASP A 67 ASP^? ULMNm 3 1b6g_c00 HALOALKANE DEHALOGENASE user 2 3 RMSD = 1.32 A TRANSFORM 0.8905 -0.0815 0.4477 0.1023 -0.9228 -0.3714 -0.4434 -0.3765 0.8134 18.669 49.556 14.844 124 ASP A 94 ASP^? 260 ASP A 67 ASP^? 289 HIS A 73 HIS^? ULMNm 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 RMSD = 1.33 A TRANSFORM 0.3740 -0.7615 0.5294 -0.8314 -0.0223 0.5552 0.4110 0.6478 0.6414 23.312 144.938 -35.675 A 85 GLU A 41 GLU.? A 87 ASP A 42 ASP.? A 89 GLU A 64 GLU^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.35 A TRANSFORM 0.9023 0.2800 0.3277 -0.2603 0.9600 -0.1037 0.3436 -0.0083 -0.9391 1.005 -103.498 -95.204 A 420 ALA A 119 ALA~? B 182 GLY A 115 GLY~? B 183 GLY A 114 GLY^? ULMNm 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.36 A TRANSFORM 0.1760 -0.9597 -0.2191 -0.3651 0.1431 -0.9199 -0.9142 -0.2419 0.3252 46.427 33.330 -1.460 A 169 TYR A 72 TYR.? A 172 HIS A 73 HIS^? A 267 ASP A 67 ASP^? ULMNm 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.37 A TRANSFORM -0.3289 0.9436 0.0369 -0.8980 -0.3004 -0.3214 0.2922 0.1388 -0.9462 28.509 12.216 46.697 B 169 TYR A 72 TYR.? B 172 HIS A 73 HIS^? B 267 ASP A 67 ASP^? ULMNm 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 RMSD = 1.37 A TRANSFORM -0.0856 -0.6765 0.7314 -0.9591 0.2547 0.1233 0.2698 0.6910 0.6707 23.498 188.632 -22.400 B 85 GLU A 41 GLU.? B 87 ASP A 42 ASP.? B 89 GLU A 64 GLU^? ULMNm 3 1iph_c03 CATALASE HPII user 1 3 RMSD = 1.37 A TRANSFORM 0.6383 -0.7331 0.2349 -0.7428 -0.5064 0.4378 0.2021 0.4539 0.8678 18.753 -14.500 -59.223 D 128 HIS A 157 HIS^? D 167 SER A 6 SER^? D 201 ASN A 4 ASN^? ULMNm 3 1iph_c02 CATALASE HPII user 1 3 RMSD = 1.37 A TRANSFORM -0.6383 0.7331 -0.2349 0.7428 0.5064 -0.4378 0.2021 0.4539 0.8678 -18.753 14.500 -59.223 C 128 HIS A 157 HIS^? C 167 SER A 6 SER^? C 201 ASN A 4 ASN^? ULMNm 3 1iph_c01 CATALASE HPII user 1 3 RMSD = 1.37 A TRANSFORM -0.6383 0.7331 -0.2349 -0.7428 -0.5064 0.4378 -0.2021 -0.4539 -0.8678 -18.753 -14.500 59.223 B 128 HIS A 157 HIS^? B 167 SER A 6 SER^? B 201 ASN A 4 ASN^? ULMNm 3 1iph_c00 CATALASE HPII user 1 3 RMSD = 1.37 A TRANSFORM 0.6383 -0.7331 0.2349 0.7428 0.5064 -0.4378 -0.2021 -0.4539 -0.8678 18.753 14.500 59.223 A 128 HIS A 157 HIS^? A 167 SER A 6 SER^? A 201 ASN A 4 ASN^? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 RMSD = 1.40 A TRANSFORM -0.4426 0.0136 -0.8966 0.0878 -0.9944 -0.0584 0.8924 0.1045 -0.4389 3.152 78.374 26.542 A 104 ILE A 68 ILE^? A 106 HIS A 73 HIS^? A 142 ASP A 67 ASP^? ULMNm 3 1b6g_c00 HALOALKANE DEHALOGENASE user 1 3 RMSD = 1.44 A TRANSFORM -0.8828 0.1151 -0.4554 -0.4547 -0.4528 0.7669 0.1180 -0.8841 -0.4521 44.097 21.768 45.824 124 ASP A 67 ASP^? 260 ASP A 94 ASP^? 289 HIS A 73 HIS^? ULMNm 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.44 A TRANSFORM -0.3127 -0.5321 0.7869 0.7420 -0.6540 -0.1474 -0.5930 -0.5378 -0.5993 10.037 28.272 34.671 A 169 TYR A 109 TYR^? A 172 HIS A 158 HIS^? A 174 TYR A 107 TYR^? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.44 A TRANSFORM 0.9003 0.4330 0.0445 -0.3814 0.7356 0.5598 -0.2097 0.5209 -0.8274 -2.696 -0.124 61.425 A 316 ALA A 61 ALA^? A 317 GLY A 80 GLY^? A 318 ASP A 60 ASP^? ULMNm 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 1 3 RMSD = 1.45 A TRANSFORM 0.3968 0.3188 -0.8608 -0.0811 -0.9219 -0.3788 0.9143 -0.2201 0.3400 66.528 29.710 15.914 B 169 TYR A 109 TYR^? B 172 HIS A 158 HIS^? B 174 TYR A 107 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.46 A TRANSFORM -0.4057 0.9140 0.0103 0.6603 0.3008 -0.6882 0.6320 0.2724 0.7255 -15.504 16.569 -39.721 141 ASP A 135 ASP~? 166 GLY A 80 GLY^? 169 GLU A 112 GLU^? ULMNm 3 2ayh_c00 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROuser 1 3 RMSD = 1.47 A TRANSFORM 0.0244 0.5498 0.8349 -0.0057 -0.8351 0.5501 -0.9997 0.0182 0.0172 -5.474 21.600 27.303 105 GLU A 41 GLU.? 107 ASP A 42 ASP.? 109 GLU A 64 GLU^? ULMNm 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 2 3 RMSD = 1.48 A TRANSFORM 0.2781 0.5590 0.7812 0.0792 0.7971 -0.5986 0.9573 -0.2283 -0.1774 8.434 33.834 -10.167 B 267 ASP A 94 ASP^? B 268 HIS A 73 HIS^? B 334 TYR A 72 TYR.?