*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 RMSD = 0.80 A TRANSFORM -0.2809 -0.5054 -0.8159 0.9131 0.1210 -0.3893 -0.2955 0.8544 -0.4275 36.976 34.381 89.810 A 270 ASN A 111 ASN^? A 384 ASN A 44 ASN^? A 385 GLU A 61 GLU^? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 0.84 A TRANSFORM 0.2201 -0.1775 -0.9592 -0.9562 0.1554 -0.2482 -0.1931 -0.9718 0.1355 -9.882 85.374 151.667 A 1 ALA A 119 ALA~? A 74 ASN A 116 ASN~? A 75 GLY A 115 GLY.? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 0.86 A TRANSFORM 0.7387 -0.1799 0.6496 0.6315 -0.1521 -0.7603 -0.2356 -0.9719 -0.0013 2.824 -4.350 65.915 C 1 ALA A 119 ALA~? C 74 ASN A 116 ASN~? C 75 GLY A 115 GLY.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 0.90 A TRANSFORM -0.5281 -0.4503 -0.7200 -0.3275 -0.6743 0.6619 0.7835 -0.5854 -0.2086 60.507 44.097 17.022 B 1 ALA A 119 ALA~? B 74 ASN A 116 ASN~? B 75 GLY A 115 GLY.? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 0.92 A TRANSFORM 0.0157 -0.4499 0.8930 0.6834 0.6567 0.3188 0.7299 -0.6053 -0.3178 2.084 8.861 107.336 D 1 ALA A 119 ALA~? D 74 ASN A 116 ASN~? D 75 GLY A 115 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.95 A TRANSFORM -0.7048 -0.7077 -0.0494 -0.1532 0.0838 0.9846 0.6927 -0.7015 0.1675 87.241 -116.567 -131.932 A 420 ALA A 52 ALA.? B 182 GLY A 56 GLY.? B 183 GLY A 55 GLY.? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 RMSD = 1.00 A TRANSFORM -0.8619 -0.2992 0.4095 -0.2000 0.9425 0.2678 0.4660 -0.1489 0.8721 156.907 47.261 99.146 B1198 GLY A 56 GLY.? B1228 SER A 49 SER.? B1549 ASP A 140 ASP.? ULMNm 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 1 3 RMSD = 1.01 A TRANSFORM 0.9144 0.3213 0.2464 0.1348 -0.8153 0.5631 -0.3818 0.4816 0.7888 -9.497 17.685 19.056 A 267 GLU A 61 GLU^? A 369 ARG A 92 ARG^? A 372 TYR A 76 TYR^? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.01 A TRANSFORM 0.9590 -0.0681 -0.2751 0.2814 0.3430 0.8962 -0.0333 0.9369 -0.3481 13.172 92.695 -16.698 B 106 ASN A 111 ASN^? B 108 HIS A 108 HIS.? B 144 ASP A 95 ASP^? ULMNm 3 1cde_c04 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 RMSD = 1.02 A TRANSFORM -0.0885 0.3946 0.9146 -0.9144 0.3319 -0.2317 0.3950 0.8568 -0.3314 -1.878 5.494 -37.534 106 ASN A 111 ASN^? 108 HIS A 108 HIS.? 144 ASP A 118 ASP~? ULMNm 3 1cde_c07 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 RMSD = 1.02 A TRANSFORM -0.0885 0.3946 0.9146 -0.9144 0.3319 -0.2317 0.3950 0.8568 -0.3314 -1.878 5.494 -37.534 106 ASN A 111 ASN^? 108 HIS A 108 HIS.? 144 ASP A 118 ASP~? ULMNm 3 1cde_c05 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 RMSD = 1.02 A TRANSFORM -0.0885 0.3946 0.9146 -0.9144 0.3319 -0.2317 0.3950 0.8568 -0.3314 -1.878 5.494 -37.534 106 ASN A 111 ASN^? 108 HIS A 108 HIS.? 144 ASP A 118 ASP~? ULMNm 3 1cde_c06 PHOSPHORIBOSYLGLYCINAMIDE FORMYLTRANuser 1 3 RMSD = 1.02 A TRANSFORM -0.0885 0.3946 0.9146 -0.9144 0.3319 -0.2317 0.3950 0.8568 -0.3314 -1.878 5.494 -37.534 106 ASN A 111 ASN^? 108 HIS A 108 HIS.? 144 ASP A 118 ASP~? ULMNm 3 1c2t_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.08 A TRANSFORM 0.2985 0.9193 -0.2566 -0.7323 0.0481 -0.6793 0.6121 -0.3907 -0.6875 -0.354 32.922 -11.270 B 106 ASN A 111 ASN^? B 108 HIS A 108 HIS.? B 144 ASP A 118 ASP~? ULMNm 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 RMSD = 1.14 A TRANSFORM -0.0594 -0.8606 0.5058 -0.3360 -0.4599 -0.8219 -0.9400 0.2188 0.2619 32.834 31.616 55.440 111 GLN A 99 GLN.? 294 GLU A 40 GLU.? 304 ARG A 100 ARG.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.20 A TRANSFORM -0.3880 -0.9114 0.1369 0.7910 -0.4055 -0.4581 -0.4730 0.0695 -0.8783 52.799 22.444 39.985 A 57 HIS A 58 HIS.? A 102 ASP A 79 ASP^? A 193 GLY A 56 GLY.? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.21 A TRANSFORM -0.3675 -0.8556 -0.3645 -0.8652 0.1708 0.4714 0.3411 -0.4886 0.8031 91.146 6.390 44.545 A 198 GLY A 55 GLY.? A 228 SER A 49 SER.? A 549 ASP A 47 ASP.? ULMNm 3 1a0j_c13 TRYPSIN user 1 3 RMSD = 1.21 A TRANSFORM 0.8155 -0.3286 0.4763 -0.4266 0.2149 0.8786 0.3911 0.9197 -0.0351 25.029 43.913 13.391 B 57 HIS A 58 HIS.? B 102 ASP A 79 ASP^? B 193 GLY A 55 GLY.? ULMNm 3 1c2t_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.21 A TRANSFORM 0.4304 -0.7285 -0.5329 0.7512 -0.0382 0.6589 0.5004 0.6839 -0.5309 22.009 -8.813 -18.286 A 106 ASN A 111 ASN^? A 108 HIS A 108 HIS.? A 144 ASP A 118 ASP~? ULMNm 3 1a0j_c12 TRYPSIN user 1 3 RMSD = 1.22 A TRANSFORM -0.0254 0.7819 -0.6228 -0.1778 -0.6166 -0.7669 0.9837 -0.0912 -0.1547 8.295 72.336 36.142 A 57 HIS A 58 HIS.? A 102 ASP A 79 ASP^? A 193 GLY A 55 GLY.? ULMNm 3 1a0j_c15 TRYPSIN user 1 3 RMSD = 1.23 A TRANSFORM -0.1404 -0.9227 -0.3591 -0.1590 -0.3370 0.9280 0.9772 -0.1874 0.0994 43.726 21.609 70.991 D 57 HIS A 58 HIS.? D 102 ASP A 79 ASP^? D 193 GLY A 55 GLY.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.23 A TRANSFORM -0.5458 -0.7127 0.4406 0.7424 -0.6551 -0.1401 -0.3885 -0.2506 -0.8867 49.236 27.921 47.000 A 57 HIS A 58 HIS.? A 102 ASP A 79 ASP^? A 193 GLY A 55 GLY.? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.24 A TRANSFORM -0.1697 0.8240 -0.5405 0.7847 -0.2188 -0.5799 0.5961 0.5226 0.6095 -2.046 -4.169 -33.570 A 105 ALA A 81 ALA^? A 244 ASP A 79 ASP^? A 271 HIS A 58 HIS.? ULMNm 3 1a0j_c14 TRYPSIN user 1 3 RMSD = 1.24 A TRANSFORM -0.8522 0.2377 0.4660 0.5084 0.1665 0.8449 -0.1232 -0.9570 0.2627 48.570 13.122 103.621 C 57 HIS A 58 HIS.? C 102 ASP A 79 ASP^? C 193 GLY A 55 GLY.? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 RMSD = 1.25 A TRANSFORM -0.8397 -0.4597 0.2889 0.3180 -0.8477 -0.4246 -0.4401 0.2647 -0.8580 32.222 47.533 55.975 B 57 HIS A 58 HIS.? B 102 ASP A 79 ASP^? B 193 GLY A 55 GLY.? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.26 A TRANSFORM -0.5818 -0.6755 0.4529 0.7139 -0.6910 -0.1136 -0.3897 -0.2572 -0.8843 49.061 29.562 47.177 A 57 HIS A 58 HIS.? A 102 ASP A 79 ASP^? A 193 GLY A 55 GLY.? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.31 A TRANSFORM 0.6662 0.5175 0.5369 0.2363 0.5364 -0.8102 0.7073 -0.6667 -0.2351 -67.469 -34.901 26.833 C 51 ALA A 81 ALA^? C 148 HIS A 58 HIS.? C 163 ASP A 79 ASP^? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.31 A TRANSFORM 0.3831 -0.0273 -0.9233 -0.5076 -0.8413 -0.1857 0.7717 -0.5399 0.3362 8.748 69.535 15.834 E 57 HIS A 58 HIS.? E 102 ASP A 79 ASP^? E 193 GLY A 55 GLY.? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.32 A TRANSFORM -0.8583 -0.4706 0.2048 -0.1838 0.6545 0.7334 0.4791 -0.5918 0.6482 167.796 44.304 117.488 B1198 GLY A 55 GLY.? B1228 SER A 49 SER.? B1549 ASP A 47 ASP.? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.32 A TRANSFORM 0.6621 0.7365 0.1388 -0.1295 -0.0700 0.9891 -0.7381 0.6729 -0.0491 -77.882 15.193 52.105 B 51 ALA A 81 ALA^? B 148 HIS A 58 HIS.? B 163 ASP A 79 ASP^? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.34 A TRANSFORM 0.0832 0.5632 -0.8221 0.7664 0.4912 0.4140 -0.6370 0.6645 0.3907 -45.606 -53.392 -23.742 G 51 ALA A 81 ALA^? G 148 HIS A 58 HIS.? G 163 ASP A 79 ASP^? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.34 A TRANSFORM -0.6881 -0.5482 -0.4754 0.1632 0.5214 -0.8375 -0.7071 0.6539 0.2693 35.859 -32.173 49.842 D 51 ALA A 81 ALA^? D 148 HIS A 58 HIS.? D 163 ASP A 79 ASP^? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.35 A TRANSFORM -0.6822 -0.7216 -0.1180 -0.0647 -0.1011 0.9928 0.7283 -0.6849 -0.0223 45.330 13.821 25.372 A 51 ALA A 81 ALA^? A 148 HIS A 58 HIS.? A 163 ASP A 79 ASP^? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM -0.0428 -0.1018 0.9939 -0.5536 -0.8257 -0.1084 -0.8317 0.5549 0.0210 -0.588 59.189 -10.523 F 51 ALA A 81 ALA^? F 148 HIS A 58 HIS.? F 163 ASP A 79 ASP^? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 1.38 A TRANSFORM 0.5426 0.0004 0.8400 -0.0281 0.9994 0.0177 0.8395 0.0332 -0.5424 -13.041 6.694 20.858 A 156 HIS A 28 HIS~? A 208 ASP A 141 ASP^? A 296 SER A 14 SER~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.38 A TRANSFORM 0.0799 0.5382 -0.8390 -0.7124 -0.5579 -0.4258 0.6972 -0.6317 -0.3388 -45.196 51.796 -41.477 H 51 ALA A 81 ALA^? H 148 HIS A 58 HIS.? H 163 ASP A 79 ASP^? ULMNm 3 1am5_c04 PEPSIN user 1 3 RMSD = 1.39 A TRANSFORM 0.1878 -0.7049 -0.6840 0.6584 -0.4264 0.6202 0.7288 0.5669 -0.3840 18.415 -12.721 114.377 32 ASP A 47 ASP.? 35 SER A 49 SER.? 215 ASP A 140 ASP.? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.39 A TRANSFORM -0.0664 -0.1171 0.9909 0.5637 0.8150 0.1341 0.8233 -0.5675 -0.0119 0.776 -59.828 -51.122 E 51 ALA A 81 ALA^? E 148 HIS A 58 HIS.? E 163 ASP A 79 ASP^? ULMNm 3 2odj_o01 PORIN D user 1 3 RMSD = 1.40 A TRANSFORM -0.8153 -0.0750 0.5741 -0.0168 -0.9881 -0.1530 -0.5787 0.1344 -0.8044 0.977 6.396 100.252 B 156 HIS A 28 HIS~? B 208 ASP A 141 ASP^? B 296 SER A 14 SER~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.40 A TRANSFORM 0.4420 -0.8958 0.0467 -0.8947 -0.4365 0.0947 0.0645 0.0836 0.9944 -16.503 74.308 43.796 D 603 HIS A 108 HIS.? D 646 ASP A 118 ASP~? D 739 GLY A 101 GLY.? ULMNm 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 RMSD = 1.42 A TRANSFORM 0.5197 0.8295 -0.2044 0.6921 -0.2685 0.6700 -0.5009 0.4897 0.7137 -7.863 -14.878 6.156 E 33 ASP A 47 ASP.? E 36 SER A 49 SER.? E 213 ASP A 140 ASP.? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.42 A TRANSFORM 0.0982 -0.8934 0.4385 0.2249 0.4491 0.8647 0.9694 -0.0137 -0.2450 8.275 20.217 16.664 B 1 SER A 26 SER~? B 69 ALA A 22 ALA~? B 241 ASN A 23 ASN~? ULMNm 3 1sme_c05 PLASMEPSIN II user 1 3 RMSD = 1.42 A TRANSFORM -0.0374 0.9977 -0.0562 0.7356 0.0656 0.6743 -0.6764 0.0161 0.7364 -6.477 59.307 59.672 B 34 ASP A 47 ASP.? B 37 SER A 49 SER.? B 214 ASP A 140 ASP.? ULMNm 3 1sme_c04 PLASMEPSIN II user 1 3 RMSD = 1.44 A TRANSFORM -0.6892 0.4766 -0.5458 0.1495 0.8305 0.5365 -0.7090 -0.2881 0.6436 71.785 23.414 36.730 A 34 ASP A 47 ASP.? A 37 SER A 49 SER.? A 214 ASP A 140 ASP.? ULMNm 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 RMSD = 1.46 A TRANSFORM 0.0255 0.7910 -0.6113 0.3967 -0.5694 -0.7201 0.9176 0.2241 0.3283 2.370 33.490 31.660 32 ASP A 47 ASP.? 35 SER A 49 SER.? 215 ASP A 140 ASP.? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.47 A TRANSFORM 0.5151 0.0463 -0.8559 0.3801 -0.9073 0.1797 0.7682 0.4179 0.4849 10.991 46.689 35.472 A 241 ASP A 47 ASP.? A 265 GLU A 91 GLU^? A 369 ASP A 54 ASP.? ULMNm 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 RMSD = 1.47 A TRANSFORM 0.6883 -0.4156 -0.5946 -0.3641 0.5110 -0.7787 -0.6274 -0.7525 -0.2004 47.725 35.753 52.048 A 32 ASP A 47 ASP.? A 35 SER A 49 SER.? A 218 ASP A 140 ASP.? ULMNm 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 RMSD = 1.47 A TRANSFORM -0.1769 0.7761 0.6053 -0.9725 -0.0433 -0.2287 0.1513 0.6291 -0.7624 14.774 95.191 98.540 35 ASP A 47 ASP.? 38 SER A 49 SER.? 218 ASP A 140 ASP.? ULMNm 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 RMSD = 1.47 A TRANSFORM 0.7025 0.0718 -0.7081 0.1633 0.9521 0.2586 -0.6927 0.2973 -0.6571 -0.435 -1.708 38.881 P 32 ASP A 47 ASP.? P 35 SER A 49 SER.? P 215 ASP A 140 ASP.? ULMNm 3 3hde_o02 LYSOZYME user 3 3 RMSD = 1.49 A TRANSFORM 0.4209 -0.9064 0.0359 -0.8577 -0.4105 -0.3096 -0.2954 -0.0996 0.9502 38.980 37.038 3.201 C 35 GLU A 91 GLU^? C 44 ASP A 95 ASP^? C 50 THR A 78 THR^?