*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 0.87 A TRANSFORM -0.1095 -0.9650 -0.2382 -0.6287 0.2529 -0.7354 0.7699 0.0693 -0.6344 59.402 29.356 12.035 C 603 HIS A 83 HIS^? C 646 ASP A 28 ASP~? C 739 GLY A 67 GLY~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 0.88 A TRANSFORM -0.9437 0.3242 -0.0657 -0.2445 -0.8175 -0.5215 -0.2227 -0.4761 0.8507 49.801 122.947 14.871 A 757 ASP A 28 ASP~? A 759 HIS A 35 HIS^? A 810 SER A 25 SER~? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 0.89 A TRANSFORM -0.7459 -0.3768 0.5493 0.6569 -0.2796 0.7002 -0.1103 0.8831 0.4561 -34.676 -33.655 -61.656 B 603 HIS A 83 HIS^? B 646 ASP A 28 ASP~? B 739 GLY A 67 GLY~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 0.91 A TRANSFORM 0.6340 0.5169 -0.5752 0.3364 0.4853 0.8070 0.6963 -0.7052 0.1338 -14.751 -1.294 5.460 B 757 ASP A 28 ASP~? B 759 HIS A 35 HIS^? B 810 SER A 25 SER~? ULMNm 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 RMSD = 0.96 A TRANSFORM -0.4449 -0.5964 -0.6681 -0.4552 0.7930 -0.4048 0.7713 0.1241 -0.6243 79.840 13.892 38.121 B 325 ASP A 98 ASP^? B 354 GLU A 96 GLU^? B 421 ASP A 14 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 0.97 A TRANSFORM -0.7804 -0.3484 0.5192 0.6114 -0.2516 0.7503 -0.1308 0.9029 0.4094 -6.039 -35.842 -21.661 A 603 HIS A 83 HIS^? A 646 ASP A 28 ASP~? A 739 GLY A 67 GLY~? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.00 A TRANSFORM -0.1526 -0.9523 -0.2643 -0.6448 0.2986 -0.7036 0.7490 0.0631 -0.6596 7.058 26.617 52.202 D 603 HIS A 83 HIS^? D 646 ASP A 28 ASP~? D 739 GLY A 67 GLY~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.05 A TRANSFORM 0.1474 -0.2446 0.9583 -0.0172 0.9682 0.2498 -0.9889 -0.0533 0.1385 -5.208 -131.548 -97.848 A 183 GLY A 77 GLY~? B 419 GLY A 78 GLY~? B 420 ALA A 74 ALA^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.07 A TRANSFORM 0.4816 -0.1390 0.8653 -0.8756 -0.0341 0.4819 -0.0375 -0.9897 -0.1382 -44.043 11.080 51.656 141 ASP A 31 ASP~? 166 GLY A 67 GLY~? 169 GLU A 64 GLU~? ULMNm 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 RMSD = 1.08 A TRANSFORM 0.4953 0.5658 0.6592 0.0008 -0.7591 0.6510 0.8687 -0.3219 -0.3765 -23.511 53.276 51.131 A 325 ASP A 98 ASP^? A 354 GLU A 96 GLU^? A 421 ASP A 14 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.11 A TRANSFORM -0.4379 -0.4136 0.7982 -0.7129 -0.3812 -0.5886 0.5477 -0.8268 -0.1279 47.853 -30.915 -118.467 A 420 ALA A 47 ALA~? B 182 GLY A 52 GLY.? B 183 GLY A 105 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.11 A TRANSFORM 0.3169 0.1309 -0.9394 -0.9149 0.3032 -0.2664 0.2500 0.9439 0.2159 54.087 -58.481 -183.392 A 420 ALA A 54 ALA.? B 182 GLY A 105 GLY.? B 183 GLY A 52 GLY.? ULMNm 3 1euu_c00 SIALIDASE user 1 3 RMSD = 1.19 A TRANSFORM 0.3186 -0.9408 -0.1153 -0.2617 0.0297 -0.9647 0.9111 0.3375 -0.2367 43.960 37.008 -3.971 92 ASP A 31 ASP~? 260 GLU A 73 GLU^? 370 TYR A 85 TYR.? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.22 A TRANSFORM -0.7357 -0.6582 0.1598 -0.5933 0.7400 0.3168 -0.3268 0.1382 -0.9349 112.058 61.152 67.682 D 98 SER A 37 SER^? D 123 HIS A 35 HIS^? D 172 ASP A 28 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM -0.5171 -0.4296 -0.7403 -0.4389 -0.6094 0.6603 -0.7348 0.6663 0.1266 46.046 14.585 19.021 A 603 HIS A 83 HIS^? A 646 ASP A 28 ASP~? A 739 GLY A 39 GLY~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.24 A TRANSFORM 0.8906 0.2731 -0.3637 -0.0080 -0.7902 -0.6128 -0.4548 0.5487 -0.7015 -5.207 101.891 55.361 G 98 SER A 37 SER^? G 123 HIS A 35 HIS^? G 172 ASP A 28 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.24 A TRANSFORM 0.0279 0.9690 0.2454 0.7348 0.1466 -0.6622 -0.6777 0.1989 -0.7080 -11.225 11.526 53.210 A 229 ALA A 46 ALA~? A 257 ALA A 47 ALA~? A 328 ASP A 102 ASP.? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.25 A TRANSFORM -0.1041 -0.9524 -0.2864 -0.9722 0.0367 0.2311 -0.2096 0.3025 -0.9298 93.973 110.222 55.302 E 98 SER A 37 SER^? E 123 HIS A 35 HIS^? E 172 ASP A 28 ASP~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.26 A TRANSFORM -0.3247 -0.2419 -0.9144 0.8541 -0.4902 -0.1736 -0.4062 -0.8374 0.3658 50.901 5.368 17.154 F 51 ALA A 97 ALA^? F 148 HIS A 112 HIS~? F 163 ASP A 100 ASP.? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM -0.8004 0.3223 0.5055 0.3213 0.9425 -0.0923 -0.5061 0.0886 -0.8579 159.261 -17.116 129.117 N 98 SER A 37 SER^? N 123 HIS A 35 HIS^? N 172 ASP A 28 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM -0.8450 0.1441 0.5151 0.1632 0.9866 -0.0081 -0.5093 0.0772 -0.8571 81.536 15.699 79.303 C 98 SER A 37 SER^? C 123 HIS A 35 HIS^? C 172 ASP A 28 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM 0.6448 -0.5410 -0.5399 -0.7133 -0.6798 -0.1707 -0.2747 0.4952 -0.8242 41.675 129.770 49.604 F 98 SER A 37 SER^? F 123 HIS A 35 HIS^? F 172 ASP A 28 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM -0.2481 -0.9363 -0.2484 -0.9469 0.1803 0.2663 -0.2046 0.3012 -0.9313 188.458 75.639 105.168 I 98 SER A 37 SER^? I 123 HIS A 35 HIS^? I 172 ASP A 28 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM -0.8290 -0.5099 0.2299 -0.4463 0.8507 0.2776 -0.3371 0.1276 -0.9328 196.866 22.288 118.722 H 98 SER A 37 SER^? H 123 HIS A 35 HIS^? H 172 ASP A 28 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.28 A TRANSFORM 0.8781 0.1176 -0.4637 -0.1667 -0.8333 -0.5270 -0.4484 0.5401 -0.7122 89.522 83.195 105.507 K 98 SER A 37 SER^? K 123 HIS A 35 HIS^? K 172 ASP A 28 ASP~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.28 A TRANSFORM 0.5112 -0.6726 -0.5351 -0.8189 -0.5701 -0.0657 -0.2609 0.4717 -0.8423 140.677 101.999 100.393 J 98 SER A 37 SER^? J 123 HIS A 35 HIS^? J 172 ASP A 28 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.28 A TRANSFORM 0.4395 0.8926 0.1008 0.6720 -0.2522 -0.6963 -0.5961 0.3737 -0.7107 -11.991 45.689 71.612 A 98 SER A 37 SER^? A 123 HIS A 35 HIS^? A 172 ASP A 28 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.28 A TRANSFORM 0.4395 0.8926 0.1008 0.6720 -0.2522 -0.6963 -0.5961 0.3737 -0.7107 -11.991 45.689 71.612 A 98 SER A 37 SER^? A 123 HIS A 35 HIS^? A 172 ASP A 28 ASP~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.28 A TRANSFORM -0.3059 0.8170 0.4888 0.7096 0.5380 -0.4550 -0.6347 0.2077 -0.7443 26.703 9.440 79.470 B 98 SER A 37 SER^? B 123 HIS A 35 HIS^? B 172 ASP A 28 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.29 A TRANSFORM -0.1775 0.9004 0.3972 0.7501 0.3851 -0.5376 -0.6371 0.2025 -0.7437 104.552 -12.986 130.186 M 98 SER A 37 SER^? M 123 HIS A 35 HIS^? M 172 ASP A 28 ASP~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.29 A TRANSFORM 0.5785 0.8155 -0.0171 0.5605 -0.4127 -0.7180 -0.5926 0.4058 -0.6958 72.327 30.753 119.599 L 98 SER A 37 SER^? L 123 HIS A 35 HIS^? L 172 ASP A 28 ASP~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.30 A TRANSFORM -0.7946 0.5953 0.1195 -0.3530 -0.2927 -0.8887 -0.4941 -0.7483 0.4427 -27.793 67.253 83.624 B 51 ALA A 97 ALA^? B 148 HIS A 112 HIS~? B 163 ASP A 100 ASP.? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.30 A TRANSFORM 0.7762 -0.6198 -0.1157 -0.3294 -0.2421 -0.9126 0.5377 0.7465 -0.3921 -3.224 64.834 -10.529 A 51 ALA A 97 ALA^? A 148 HIS A 112 HIS~? A 163 ASP A 100 ASP.? ULMNm 3 1sll_c00 SIALIDASE L user 1 3 RMSD = 1.31 A TRANSFORM 0.4285 -0.3143 -0.8471 -0.5456 0.6573 -0.5199 0.7202 0.6850 0.1102 47.536 18.533 -19.553 318 ASP A 31 ASP~? 595 GLU A 73 GLU^? 713 TYR A 85 TYR.? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.35 A TRANSFORM 0.7771 -0.5525 0.3015 -0.1372 0.3188 0.9379 -0.6143 -0.7701 0.1719 -24.895 -51.173 97.682 D 51 ALA A 97 ALA^? D 148 HIS A 112 HIS~? D 163 ASP A 100 ASP.? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM -0.1499 0.2458 0.9577 0.7660 -0.5836 0.2696 0.6252 0.7740 -0.1008 -63.636 -7.085 -92.116 H 51 ALA A 97 ALA^? H 148 HIS A 112 HIS~? H 163 ASP A 100 ASP.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.38 A TRANSFORM 0.1143 -0.9125 -0.3929 -0.8444 0.1192 -0.5223 0.5234 0.3914 -0.7568 100.882 54.982 23.614 A 67 ASP A 31 ASP~? A 68 ALA A 30 ALA~? A 72 LEU A 29 LEU~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 3 3 RMSD = 1.38 A TRANSFORM -0.8226 0.3487 -0.4491 0.3113 0.9372 0.1575 0.4758 -0.0103 -0.8795 71.599 -35.050 44.441 A 316 ALA A 103 ALA.? A 317 GLY A 105 GLY.? A 318 ASP A 102 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.42 A TRANSFORM 0.1098 -0.2115 -0.9712 0.5671 0.8158 -0.1135 0.8163 -0.5383 0.2095 82.298 -19.809 26.028 A 316 ALA A 30 ALA~? A 317 GLY A 32 GLY~? A 318 ASP A 28 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.42 A TRANSFORM -0.8828 -0.4158 0.2185 -0.2901 0.1169 -0.9498 0.3694 -0.9019 -0.2238 32.084 47.945 40.976 141 ASP A 69 ASP.? 166 GLY A 39 GLY~? 169 GLU A 44 GLU~? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.44 A TRANSFORM -0.7700 0.5432 -0.3347 -0.1579 0.3461 0.9248 0.6182 0.7650 -0.1808 -6.710 -50.850 -20.781 C 51 ALA A 97 ALA^? C 148 HIS A 112 HIS~? C 163 ASP A 100 ASP.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.45 A TRANSFORM -0.4489 -0.7746 0.4455 0.5517 -0.6325 -0.5436 0.7029 0.0018 0.7113 77.862 48.984 -48.960 A 229 ALA A 47 ALA~? A 257 ALA A 46 ALA~? A 328 ASP A 102 ASP.? ULMNm 3 3nwu_o01 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.46 A TRANSFORM -0.0188 0.1453 -0.9892 -0.8899 -0.4535 -0.0497 -0.4558 0.8793 0.1378 -21.030 114.934 -47.324 B 220 HIS A 35 HIS^? B 250 ASP A 28 ASP~? B 328 SER A 37 SER^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.46 A TRANSFORM -0.8279 -0.1411 0.5429 -0.5082 -0.2212 -0.8324 0.2375 -0.9650 0.1114 38.685 85.507 106.338 A 241 ASP A 111 ASP~? A 265 GLU A 44 GLU~? A 369 ASP A 100 ASP.? ULMNm 3 3nwu_o02 SERINE PROTEASE HTRA1 user 1 3 RMSD = 1.47 A TRANSFORM 0.3362 -0.9163 -0.2175 -0.1151 0.1893 -0.9752 0.9348 0.3528 -0.0418 -12.843 76.925 -83.566 C 220 HIS A 35 HIS^? C 250 ASP A 28 ASP~? C 328 SER A 37 SER^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 RMSD = 1.48 A TRANSFORM 0.2930 0.5959 -0.7477 0.9532 -0.1213 0.2769 0.0743 -0.7939 -0.6035 16.534 55.639 54.649 193 ASP A 100 ASP.? 231 ASP A 28 ASP~? 294 ASP A 102 ASP.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.48 A TRANSFORM -0.5010 -0.2364 0.8325 0.3838 -0.9229 -0.0312 0.7757 0.3039 0.5531 51.003 47.490 -39.888 199 ASP A 98 ASP^? 218 GLU A 68 GLU.? 329 ASP A 14 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.49 A TRANSFORM 0.0939 0.9901 0.1046 0.1026 -0.1141 0.9882 0.9903 -0.0821 -0.1123 10.077 -23.066 -13.964 A 67 ASP A 98 ASP^? A 68 ALA A 97 ALA^? A 72 LEU A 58 LEU^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.49 A TRANSFORM 0.3726 -0.9022 -0.2172 -0.4027 -0.3680 0.8381 -0.8361 -0.2249 -0.5004 72.872 -67.106 -66.110 A 183 GLY A 77 GLY~? B 419 GLY A 78 GLY~? B 420 ALA A 79 ALA.?