*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1exp_c00 BETA-1,4-D-GLYCANASE CEX-CD user 1 4 RMSD = 1.37 A TRANSFORM -0.1149 0.4594 -0.8807 0.9892 0.1344 -0.0590 0.0913 -0.8780 -0.4699 18.645 35.801 51.178 127 GLU B 64 GLU~? 205 HIS B 10 HIS.? 233 GLU B 66 GLU~? 235 ASP A 19 ASP~? ULMNm 4 1xyz_c01 1,4-BETA-D-XYLAN-XYLANOHYDROLASE user 1 4 RMSD = 1.39 A TRANSFORM 0.6824 0.5583 0.4718 0.6639 -0.2034 -0.7196 -0.3058 0.8043 -0.5095 -22.627 13.892 64.729 B 645 GLU B 64 GLU~? B 723 HIS B 10 HIS.? B 754 GLU B 66 GLU~? B 756 ASP A 19 ASP~? ULMNm 4 1xyz_c00 1,4-BETA-D-XYLAN-XYLANOHYDROLASE user 1 4 RMSD = 1.39 A TRANSFORM -0.6740 -0.5578 -0.4843 -0.2895 0.8026 -0.5216 0.6796 -0.2113 -0.7025 46.344 9.157 17.403 A 645 GLU B 64 GLU~? A 723 HIS B 10 HIS.? A 754 GLU B 66 GLU~? A 756 ASP A 19 ASP~? ULMNm 4 1ro7_c02 ALPHA-2,3/8-SIALYLTRANSFERASE user 2 4 RMSD = 1.41 A TRANSFORM 0.0473 -0.2511 0.9668 0.9897 0.1428 -0.0113 -0.1352 0.9574 0.2552 -16.975 -26.920 -34.599 C 129 ARG B 89 ARG~? C 156 TYR B 78 TYR~? C 162 TYR B 13 TYR.? C 188 HIS B 86 HIS~? ULMNm 4 1ro7_c00 ALPHA-2,3/8-SIALYLTRANSFERASE user 1 4 RMSD = 1.50 A TRANSFORM 0.4214 0.4033 0.8123 -0.2741 -0.7971 0.5380 0.8645 -0.4494 -0.2253 4.312 21.580 10.284 A 129 ARG A 89 ARG~? A 156 TYR A 78 TYR~? A 162 TYR A 13 TYR.? A 188 HIS A 86 HIS~? ULMNm 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 RMSD = 0.71 A TRANSFORM 0.5271 0.8318 0.1742 -0.8418 0.5391 -0.0267 -0.1161 -0.1325 0.9844 39.369 69.609 -21.005 A 325 ARG B 70 ARG~? A 342 ASP A 50 ASP~? A 531 ARG A 70 ARG~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 4 3 RMSD = 0.73 A TRANSFORM 0.0316 0.1739 -0.9842 -0.6290 -0.7619 -0.1548 -0.7768 0.6239 0.0853 0.355 100.762 102.524 A 270 ASN B 111 ASN~? A 384 ASN B 56 ASN~? A 385 GLU B 52 GLU~? ULMNm 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 RMSD = 0.73 A TRANSFORM 0.2590 -0.9395 0.2244 -0.6221 -0.3399 -0.7053 0.7389 0.0431 -0.6725 96.409 93.909 -36.125 A 325 ARG A 70 ARG~? A 342 ASP B 50 ASP~? A 531 ARG B 70 ARG~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 0.89 A TRANSFORM -0.4097 0.4530 0.7918 -0.6292 0.4881 -0.6048 -0.6604 -0.7460 0.0851 40.581 2.256 84.724 A 198 GLY B 9 GLY.? A 228 SER A 16 SER~? A 549 ASP A 50 ASP~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 0.93 A TRANSFORM -0.8144 0.5779 0.0532 -0.2048 -0.2004 -0.9581 -0.5430 -0.7911 0.2815 136.545 88.361 152.693 B1198 GLY B 9 GLY.? B1228 SER A 16 SER~? B1549 ASP A 50 ASP~? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 RMSD = 0.97 A TRANSFORM -0.6075 -0.1850 -0.7725 -0.7644 -0.1280 0.6319 -0.2157 0.9744 -0.0637 29.171 61.166 73.861 C 14 ASP A 19 ASP~? C 16 HIS B 10 HIS.? C 67 GLY A 22 GLY~? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 RMSD = 0.97 A TRANSFORM -0.6401 0.0219 -0.7680 0.7633 0.1327 -0.6323 0.0881 -0.9909 -0.1016 26.733 -30.024 95.383 A 14 ASP A 19 ASP~? A 16 HIS B 10 HIS.? A 67 GLY A 22 GLY~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 RMSD = 0.97 A TRANSFORM -0.8069 -0.1959 0.5572 -0.3529 0.9164 -0.1889 -0.4736 -0.3491 -0.8086 20.052 44.922 131.165 A 270 ASN A 111 ASN~? A 384 ASN A 56 ASN~? A 385 GLU A 52 GLU~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 RMSD = 1.04 A TRANSFORM -0.3161 -0.9378 -0.1437 0.6181 -0.0887 -0.7811 0.7198 -0.3357 0.6076 71.885 80.375 31.159 229 ASP A 50 ASP~? 264 GLU A 33 GLU~? 328 ASP A 19 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 RMSD = 1.07 A TRANSFORM -0.0860 0.9946 -0.0589 -0.2984 0.0307 0.9540 0.9506 0.0996 0.2941 10.383 88.100 15.428 229 ASP B 50 ASP~? 264 GLU B 33 GLU~? 328 ASP B 19 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.09 A TRANSFORM -0.6455 -0.6335 0.4266 -0.1766 -0.4197 -0.8903 0.7431 -0.6500 0.1590 -0.932 48.487 36.557 D 603 HIS B 10 HIS.? D 646 ASP A 19 ASP~? D 739 GLY A 27 GLY.? ULMNm 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 RMSD = 1.09 A TRANSFORM -0.4356 -0.8582 -0.2715 0.3490 -0.4390 0.8280 -0.8298 0.2659 0.4907 101.142 40.440 -0.050 B 325 ARG B 70 ARG~? B 342 ASP A 50 ASP~? B 531 ARG A 70 ARG~? ULMNm 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 RMSD = 1.10 A TRANSFORM -0.2782 0.9562 -0.0909 0.9492 0.2592 -0.1782 -0.1469 -0.1358 -0.9798 44.057 12.291 4.404 B 325 ARG A 70 ARG~? B 342 ASP B 50 ASP~? B 531 ARG B 70 ARG~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 3 3 RMSD = 1.12 A TRANSFORM 0.5262 -0.8482 -0.0609 -0.8247 -0.4915 -0.2799 0.2075 0.1975 -0.9581 11.065 32.477 -12.267 14 ASP B 19 ASP~? 16 HIS A 10 HIS.? 67 GLY B 9 GLY.? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 3 3 RMSD = 1.12 A TRANSFORM -0.3450 0.8752 0.3392 -0.8137 -0.0988 -0.5728 -0.4678 -0.4736 0.7462 -14.961 94.757 154.728 B 109 ASP B 19 ASP~? B 182 GLU A 67 GLU~? B 286 ASN B 15 ASN~? ULMNm 3 2hos_d00 TRANSCRIPTION/DNA user 2 3 RMSD = 1.13 A TRANSFORM 0.3420 -0.2860 -0.8951 -0.4407 0.7925 -0.4216 0.8299 0.5387 0.1450 23.413 -1.234 -2.456 A 5 ARG B 48 ARG~? A 50 LYS B 36 LYS~? A 51 ASN B 42 ASN~? ULMNm 3 2dbt_c00 CHITINASE C user 6 3 RMSD = 1.14 A TRANSFORM -0.0017 0.2990 0.9542 -0.3264 0.9018 -0.2832 -0.9452 -0.3119 0.0960 54.907 10.309 37.131 A 147 GLU A 53 GLU~? A 156 GLU B 67 GLU~? A 194 ASN A 15 ASN~? ULMNm 3 1cns_c01 CHITINASE user 2 3 RMSD = 1.17 A TRANSFORM -0.0358 -0.9764 0.2130 -0.9292 0.1110 0.3526 -0.3679 -0.1853 -0.9112 56.708 4.823 60.632 B 67 GLU B 45 GLU~? B 89 GLU B 53 GLU~? B 120 SER B 16 SER~? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.18 A TRANSFORM -0.0511 -0.8297 -0.5559 -0.9011 0.2783 -0.3326 0.4307 0.4839 -0.7618 32.756 84.359 115.178 B 109 ASP A 19 ASP~? B 182 GLU B 67 GLU~? B 286 ASN A 15 ASN~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 RMSD = 1.23 A TRANSFORM -0.4145 -0.1268 0.9012 -0.8682 0.3519 -0.3498 -0.2728 -0.9274 -0.2560 15.505 76.117 72.644 179 ASP B 50 ASP~? 227 GLU B 67 GLU~? 289 ASP B 19 ASP~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 RMSD = 1.26 A TRANSFORM 0.5318 0.1169 -0.8388 -0.8236 -0.1592 -0.5443 -0.1972 0.9803 0.0116 -3.179 90.903 14.148 179 ASP A 50 ASP~? 227 GLU A 67 GLU~? 289 ASP A 19 ASP~? ULMNm 3 1cns_c01 CHITINASE user 1 3 RMSD = 1.28 A TRANSFORM 0.3838 0.9119 -0.1456 -0.2089 -0.0678 -0.9756 -0.8995 0.4048 0.1644 -5.229 0.373 50.641 B 67 GLU A 45 GLU~? B 89 GLU A 53 GLU~? B 120 SER A 16 SER~? ULMNm 3 2c3x_p00 ALPHA-AMYLASE G-6 user 1 3 RMSD = 1.32 A TRANSFORM -0.8147 0.2441 0.5259 -0.1899 0.7446 -0.6399 -0.5479 -0.6212 -0.5603 12.740 26.095 111.117 A 26 HIS A 10 HIS.? A 76 ASN B 15 ASN~? A 81 ASP B 50 ASP~? ULMNm 3 1oyg_c00 LEVANSUCRASE user 1 3 RMSD = 1.33 A TRANSFORM 0.1804 -0.6915 0.6995 -0.6373 0.4595 0.6186 -0.7492 -0.5574 -0.3578 44.458 33.529 23.426 A 86 ASP A 39 ASP~? A 247 ASP A 35 ASP~? A 342 GLU A 102 GLU.? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 RMSD = 1.33 A TRANSFORM 0.9383 0.0558 0.3414 0.2984 0.3684 -0.8805 -0.1749 0.9280 0.3290 23.511 78.102 25.260 229 ASP A 50 ASP~? 264 GLU B 64 GLU~? 328 ASP A 19 ASP~? ULMNm 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 RMSD = 1.34 A TRANSFORM -0.2475 -0.9008 -0.3569 0.3076 -0.4224 0.8526 -0.9188 0.1012 0.3816 88.458 76.856 66.270 B 232 HIS A 10 HIS.? B 262 GLU A 66 GLU~? B 358 GLU A 64 GLU~? ULMNm 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 3 3 RMSD = 1.36 A TRANSFORM -0.2883 0.9358 -0.2027 -0.2245 -0.2719 -0.9358 -0.9308 -0.2243 0.2884 33.922 91.331 77.356 B 232 HIS B 10 HIS.? B 262 GLU A 23 GLU~? B 358 GLU A 28 GLU.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.37 A TRANSFORM -0.7093 -0.0771 0.7007 0.1297 0.9627 0.2373 -0.6929 0.2592 -0.6729 71.361 -4.231 24.060 199 ASP B 50 ASP~? 218 GLU A 45 GLU~? 329 ASP B 19 ASP~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.37 A TRANSFORM 0.7729 0.4781 0.4172 -0.5124 0.8581 -0.0341 -0.3743 -0.1874 0.9082 -16.807 4.594 44.370 B 16 TYR A 13 TYR.? B 40 ASP A 19 ASP~? B 103 LEU B 74 LEU~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 RMSD = 1.38 A TRANSFORM 0.7114 -0.6277 0.3159 -0.4708 -0.7595 -0.4489 0.5218 0.1706 -0.8359 17.016 52.806 23.422 B 16 TYR B 13 TYR.? B 40 ASP B 19 ASP~? B 103 LEU A 74 LEU~? ULMNm 3 1i29_c03 CSDB user 2 3 RMSD = 1.38 A TRANSFORM -0.5406 -0.2890 -0.7901 0.2176 -0.9552 0.2006 -0.8127 -0.0635 0.5793 44.239 57.880 28.310 A 128 VAL B 68 VAL~? A 200 ASP A 19 ASP~? A 226 LYS A 29 LYS.? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 RMSD = 1.40 A TRANSFORM -0.1072 -0.0825 0.9908 0.9493 0.2876 0.1266 -0.2954 0.9542 0.0475 -9.522 -10.598 -29.587 A 14 GLU A 67 GLU~? A 61 GLU B 23 GLU~? A 162 HIS A 10 HIS.? ULMNm 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 RMSD = 1.41 A TRANSFORM 0.6154 0.7705 0.1661 -0.2679 0.4027 -0.8752 -0.7413 0.4942 0.4542 -20.617 60.892 41.902 A 232 HIS A 10 HIS.? A 262 GLU A 66 GLU~? A 358 GLU A 64 GLU~? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.41 A TRANSFORM -0.9614 -0.2035 -0.1854 -0.1817 -0.0373 0.9827 -0.2069 0.9784 -0.0011 48.708 36.858 92.736 A 109 ASP A 50 ASP~? A 182 GLU A 53 GLU~? A 286 ASN A 15 ASN~? ULMNm 3 1a41_c01 TOPOISOMERASE I user 1 3 RMSD = 1.42 A TRANSFORM -0.3883 0.8928 0.2282 -0.6230 -0.0719 -0.7789 -0.6790 -0.4446 0.5842 -22.729 65.954 37.135 223 ARG A 26 ARG~? 265 HIS B 10 HIS.? 274 TYR B 78 TYR~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 RMSD = 1.42 A TRANSFORM 0.5864 -0.6691 0.4565 0.4906 0.7419 0.4571 -0.6445 -0.0441 0.7633 18.322 -16.398 23.570 A 16 TYR B 13 TYR.? A 40 ASP B 19 ASP~? A 103 LEU A 74 LEU~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.42 A TRANSFORM 0.8156 0.5281 0.2364 0.5335 -0.8445 0.0462 0.2240 0.0884 -0.9706 -20.157 30.866 9.692 A 16 TYR A 13 TYR.? A 40 ASP A 19 ASP~? A 103 LEU B 74 LEU~? ULMNm 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 3 3 RMSD = 1.43 A TRANSFORM 0.6555 -0.7534 0.0511 0.2653 0.2931 0.9185 -0.7070 -0.5886 0.3920 24.112 45.069 74.330 A 232 HIS B 10 HIS.? A 262 GLU A 23 GLU~? A 358 GLU A 28 GLU.? ULMNm 3 1b02_c02 THYMIDYLATE SYNTHASE user 1 3 RMSD = 1.44 A TRANSFORM 0.7075 0.3625 0.6066 -0.3591 -0.5548 0.7505 0.6086 -0.7488 -0.2624 -32.639 56.945 19.502 A 71 GLU A 121 GLU~? A 161 CYH A 51 CYH~? A 192 ASN A 71 ASN~? ULMNm 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 7 3 RMSD = 1.45 A TRANSFORM -0.9323 0.3278 -0.1530 -0.3131 -0.9430 -0.1127 -0.1812 -0.0571 0.9818 12.816 62.035 27.577 A 167 LYS B 91 LYS~? A 169 LYS B 100 LYS.? A 327 GLU B 88 GLU~? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 1 3 RMSD = 1.45 A TRANSFORM -0.0602 -0.6172 0.7845 -0.9900 0.1371 0.0319 -0.1273 -0.7748 -0.6193 35.639 104.232 54.511 313 ASP A 118 ASP~? 315 GLU A 121 GLU~? 390 TYR A 73 TYR~? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 4 3 RMSD = 1.45 A TRANSFORM -0.6148 0.4067 -0.6758 0.7338 -0.0190 -0.6791 -0.2890 -0.9134 -0.2868 25.783 25.013 150.666 A 109 ASP B 50 ASP~? A 182 GLU B 53 GLU~? A 286 ASN B 15 ASN~? ULMNm 3 2dbt_c00 CHITINASE C user 7 3 RMSD = 1.46 A TRANSFORM -0.1640 0.0210 0.9862 -0.8876 -0.4393 -0.1383 0.4303 -0.8981 0.0907 58.696 57.080 30.122 A 147 GLU A 66 GLU~? A 156 GLU B 23 GLU~? A 194 ASN A 71 ASN~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 7 3 RMSD = 1.46 A TRANSFORM -0.9884 0.1390 -0.0615 -0.1370 -0.9899 -0.0359 -0.0659 -0.0270 0.9975 31.135 52.372 37.216 B 16 TYR B 13 TYR.? B 40 ASP B 50 ASP~? B 103 LEU B 75 LEU~? ULMNm 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 RMSD = 1.48 A TRANSFORM 0.9226 0.2538 0.2906 -0.1456 0.9265 -0.3470 -0.3573 0.2778 0.8917 -16.796 -0.075 55.635 111 GLN B 69 GLN~? 294 GLU B 64 GLU~? 304 ARG A 26 ARG~? ULMNm 3 1mas_c01 INOSINE-URIDINE NUCLEOSIDE N-RIBOHYDuser 2 3 RMSD = 1.48 A TRANSFORM -0.6565 0.7541 -0.0178 -0.7356 -0.6349 0.2363 0.1669 0.1682 0.9715 -20.149 17.913 33.403 B 10 ASP A 50 ASP~? B 168 ASN A 15 ASN~? B 241 HIS B 10 HIS.? ULMNm 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 RMSD = 1.48 A TRANSFORM -0.1784 -0.1754 -0.9682 -0.1462 0.9778 -0.1501 0.9730 0.1148 -0.2001 44.614 15.410 19.185 A 18 HIS A 10 HIS.? A 91 ARG A 70 ARG~? A 129 SER B 16 SER~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 2 3 RMSD = 1.49 A TRANSFORM 0.6593 0.1403 0.7386 -0.7515 0.1532 0.6417 -0.0232 -0.9782 0.2065 -29.576 5.032 12.898 14 ASP A 19 ASP~? 16 HIS B 10 HIS.? 67 GLY A 61 GLY.? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 RMSD = 1.49 A TRANSFORM 0.5082 0.2299 0.8300 0.6354 0.5505 -0.5416 -0.5814 0.8026 0.1337 30.342 -8.948 -10.976 A 261 GLY A 9 GLY.? B 17 GLN A 69 GLN~? B 140 GLU A 66 GLU~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 6 3 RMSD = 1.49 A TRANSFORM -0.9608 0.1181 -0.2509 0.1124 0.9930 0.0368 0.2535 0.0071 -0.9673 29.424 -15.622 7.299 A 16 TYR B 13 TYR.? A 40 ASP B 50 ASP~? A 103 LEU B 75 LEU~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.50 A TRANSFORM -0.6737 -0.2320 0.7016 -0.5679 -0.4449 -0.6925 0.4728 -0.8650 0.1680 -10.179 44.043 -8.507 B 114 HIS A 10 HIS.? B 197 ASP B 50 ASP~? B 223 ALA B 63 ALA.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.50 A TRANSFORM 0.6806 0.2195 -0.6990 0.4871 0.5771 0.6555 0.5473 -0.7866 0.2859 -83.462 -48.770 -15.446 A 114 HIS A 10 HIS.? A 197 ASP B 50 ASP~? A 223 ALA B 63 ALA.?