*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 1 3 RMSD = 0.62 A TRANSFORM 0.9414 -0.0644 -0.3311 0.3050 -0.2564 0.9172 0.1439 0.9644 0.2217 -3.957 36.474 13.056 A 107 ASP A 55 ASP^? A 246 ASP A 72 ASP^? A 275 HIS A 70 HIS^? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 RMSD = 0.88 A TRANSFORM -0.8369 0.5473 0.0032 0.5422 0.8283 0.1413 -0.0747 -0.1200 0.9900 41.692 11.276 117.049 A 270 ASN A 26 ASN.? A 384 ASN A 95 ASN~? A 385 GLU A 98 GLU~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 4 3 RMSD = 0.98 A TRANSFORM -0.5221 -0.8476 0.0944 0.8068 -0.4549 0.3771 0.2767 -0.2731 -0.9213 69.214 -29.598 63.426 A 198 GLY A 189 GLY.? A 228 SER A 185 SER.? A 549 ASP A 153 ASP~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 4 3 RMSD = 1.01 A TRANSFORM -0.0353 -0.9906 -0.1319 -0.4143 0.1346 -0.9001 -0.9095 -0.0228 0.4152 24.067 15.591 20.114 14 ASP A 72 ASP^? 16 HIS A 73 HIS^? 67 GLY A 41 GLY~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.02 A TRANSFORM 0.0835 0.5514 -0.8301 -0.9955 0.0840 -0.0444 -0.0452 -0.8300 -0.5559 19.534 63.623 50.006 A 316 ALA A 37 ALA.? A 317 GLY A 36 GLY.? A 318 ASP A 88 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.06 A TRANSFORM 0.8750 -0.4541 -0.1680 0.4795 0.7647 0.4304 0.0670 0.4571 -0.8869 10.038 47.191 31.251 A 228 ASP A 153 ASP~? A 261 ASP A 82 ASP^? A 329 ASP A 117 ASP^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.07 A TRANSFORM -0.8365 -0.0839 0.5414 0.5385 -0.3081 0.7843 -0.1011 -0.9476 -0.3029 98.571 -57.694 -18.795 B 37 ASP A 173 ASP~? B 56 ILE A 130 ILE~? B 82 TYR A 134 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.08 A TRANSFORM -0.8331 -0.0816 0.5471 0.5398 -0.3360 0.7718 -0.1209 -0.9383 -0.3240 95.432 -41.090 10.150 A 37 ASP A 173 ASP~? A 56 ILE A 130 ILE~? A 82 TYR A 134 TYR~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 4 3 RMSD = 1.10 A TRANSFORM 0.3052 -0.9211 0.2417 0.9495 0.3136 -0.0038 0.0723 -0.2307 -0.9703 128.446 42.345 140.593 B1198 GLY A 189 GLY.? B1228 SER A 185 SER.? B1549 ASP A 153 ASP~? ULMNm 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 RMSD = 1.11 A TRANSFORM -0.5784 -0.7520 0.3162 0.8057 -0.4660 0.3655 0.1275 -0.4662 -0.8755 89.437 1.748 10.825 A 49 GLU A 98 GLU~? A 60 ASP A 88 ASP.? A 175 TYR A 59 TYR.? ULMNm 3 1grc_c02 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.17 A TRANSFORM 0.1507 -0.3389 0.9287 -0.7270 0.5986 0.3365 0.6699 0.7258 0.1562 54.201 64.760 -24.814 A 106 ASN A 53 ASN.? A 108 HIS A 70 HIS^? A 144 ASP A 55 ASP^? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.24 A TRANSFORM 0.8166 0.4908 0.3038 -0.5658 0.7848 0.2530 0.1143 0.3785 -0.9185 -95.292 -1.467 -16.633 B 603 HIS A 70 HIS^? B 646 ASP A 72 ASP^? B 739 GLY A 110 GLY^? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.24 A TRANSFORM 0.1299 -0.1812 0.9748 0.5344 -0.8154 -0.2228 -0.8352 -0.5499 0.0091 -1.318 -2.817 56.810 C 603 HIS A 70 HIS^? C 646 ASP A 72 ASP^? C 739 GLY A 110 GLY^? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.26 A TRANSFORM 0.8469 0.4546 0.2759 -0.5162 0.8274 0.2211 0.1278 0.3297 -0.9354 -67.550 -4.482 22.717 A 603 HIS A 70 HIS^? A 646 ASP A 72 ASP^? A 739 GLY A 110 GLY^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.27 A TRANSFORM 0.2598 0.1488 0.9541 0.0473 0.9849 -0.1665 0.9645 -0.0884 -0.2488 132.301 8.432 -43.038 A 316 ALA A 37 ALA.? A 317 GLY A 36 GLY.? A 318 ASP A 88 ASP.? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.28 A TRANSFORM 0.1707 -0.2142 0.9618 0.5521 -0.7877 -0.2734 -0.8161 -0.5776 0.0162 -55.879 -3.826 95.120 D 603 HIS A 70 HIS^? D 646 ASP A 72 ASP^? D 739 GLY A 110 GLY^? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.29 A TRANSFORM -0.0654 -0.6388 -0.7666 -0.2230 -0.7394 0.6352 0.9726 -0.2125 0.0940 -5.713 60.284 43.287 B 34 SER A 43 SER~? B 37 ASN A 47 ASN~? B 45 THR A 31 THR^? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 1 3 RMSD = 1.30 A TRANSFORM 0.7774 0.3054 -0.5499 -0.2662 -0.6324 -0.7275 0.5699 -0.7119 0.4104 -27.335 31.478 5.462 A 101 VAL A 49 VAL~? A 102 PHE A 45 PHE~? A 169 CYH A 200 CYH~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.30 A TRANSFORM 0.2867 0.9579 0.0146 -0.8629 0.2648 -0.4303 0.4161 -0.1108 -0.9026 10.062 105.352 6.494 B 194 SER A 35 SER^? B 292 ASP A 153 ASP~? B 322 HIS A 107 HIS~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 RMSD = 1.32 A TRANSFORM -0.0926 -0.9461 -0.3103 -0.4719 -0.2327 0.8504 0.8768 -0.2252 0.4249 0.313 56.432 46.180 B 34 SER A 44 SER~? B 37 ASN A 47 ASN~? B 45 THR A 31 THR^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.33 A TRANSFORM 0.6248 -0.6088 -0.4888 0.4778 0.7933 -0.3774 -0.6175 -0.0022 -0.7865 -4.494 -48.502 -22.853 B 250 ALA A 37 ALA.? B 251 GLY A 36 GLY.? B 252 ASP A 88 ASP.? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 3 3 RMSD = 1.33 A TRANSFORM -0.8587 -0.4873 -0.1584 0.1246 0.1013 -0.9870 -0.4970 0.8673 0.0263 64.568 60.787 99.874 A 270 ASN A 53 ASN.? A 384 ASN A 205 ASN~? A 385 GLU A 201 GLU~? ULMNm 3 1qrz_c21 PLASMINOGEN user 2 3 RMSD = 1.34 A TRANSFORM -0.1644 -0.4549 -0.8752 -0.9545 0.2972 0.0248 -0.2488 -0.8395 0.4831 -15.916 30.576 19.880 B 603 HIS A 73 HIS^? B 646 ASP A 72 ASP^? B 739 GLY A 110 GLY^? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.35 A TRANSFORM 0.1546 0.6626 -0.7329 0.9689 -0.2466 -0.0186 0.1931 0.7072 0.6801 -10.052 -38.861 -28.569 C 603 HIS A 73 HIS^? C 646 ASP A 72 ASP^? C 739 GLY A 110 GLY^? ULMNm 3 1qrz_c13 PLASMINOGEN user 1 3 RMSD = 1.36 A TRANSFORM 0.0653 -0.8464 0.5285 0.7558 0.3878 0.5276 0.6515 -0.3650 -0.6651 -27.517 -37.957 -13.718 B 603 HIS A 70 HIS^? B 646 ASP A 72 ASP^? B 741 SER A 50 SER~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.37 A TRANSFORM -0.0979 -0.8596 0.5014 -0.6951 0.4197 0.5838 0.7123 0.2914 0.6386 37.574 8.942 -35.585 A 250 ALA A 37 ALA.? A 251 GLY A 36 GLY.? A 252 ASP A 88 ASP.? ULMNm 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 1 3 RMSD = 1.38 A TRANSFORM -0.7172 0.5410 -0.4394 -0.6039 -0.7971 0.0043 0.3479 -0.2685 -0.8983 47.892 43.698 18.458 232 HIS A 73 HIS^? 254 LYS A 196 LYS~? 333 ARG A 51 ARG.? ULMNm 3 1qrz_c14 PLASMINOGEN user 1 3 RMSD = 1.39 A TRANSFORM -0.5657 0.0863 0.8201 -0.7809 -0.3755 -0.4991 -0.2649 0.9228 -0.2799 15.848 32.105 -8.442 C 603 HIS A 70 HIS^? C 646 ASP A 72 ASP^? C 741 SER A 50 SER~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.39 A TRANSFORM 0.1890 0.9818 0.0179 -0.9747 0.1854 0.1250 -0.1194 0.0411 -0.9920 108.437 103.061 133.198 B1198 GLY A 41 GLY~? B1228 SER A 43 SER~? B1549 ASP A 82 ASP^? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.41 A TRANSFORM 0.2145 0.2779 -0.9364 0.9344 0.2208 0.2796 -0.2844 0.9349 0.2123 23.823 -11.433 39.702 A 194 SER A 35 SER^? A 292 ASP A 153 ASP~? A 322 HIS A 107 HIS~? ULMNm 3 2phk_c03 MC-PEPTIDE user 2 3 RMSD = 1.43 A TRANSFORM -0.8923 0.4098 -0.1891 -0.3040 -0.8553 -0.4195 0.3336 0.3169 -0.8878 72.957 35.721 36.554 A 149 ASP A 117 ASP^? A 151 LYS A 151 LYS~? A 154 ASN A 150 ASN^? ULMNm 3 1amo_c01 NADPH-CYTOCHROME P450 REDUCTASE user 1 3 RMSD = 1.43 A TRANSFORM 0.9277 0.2910 0.2339 -0.2586 0.0489 0.9648 -0.2693 0.9555 -0.1206 15.997 26.435 31.166 B 457 SER A 119 SER.? B 630 CYH A 122 CYH.? B 675 ASP A 117 ASP^? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 5 3 RMSD = 1.43 A TRANSFORM -0.5002 -0.8577 0.1192 0.6511 -0.4632 -0.6013 -0.5709 0.2231 -0.7901 69.008 -13.626 82.265 A 198 GLY A 191 GLY~? A 228 SER A 185 SER.? A 549 ASP A 153 ASP~? ULMNm 3 1amo_c00 NADPH-CYTOCHROME P450 REDUCTASE user 1 3 RMSD = 1.44 A TRANSFORM -0.9433 -0.2232 -0.2458 0.2823 -0.1490 -0.9477 -0.1749 0.9633 -0.2036 35.943 -1.279 29.019 A 457 SER A 119 SER.? A 630 CYH A 122 CYH.? A 675 ASP A 117 ASP^? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 8 3 RMSD = 1.45 A TRANSFORM -0.7170 -0.5742 0.3953 -0.6969 0.5767 -0.4263 -0.0168 0.5811 0.8137 3.832 61.011 56.388 B 34 SER A 185 SER.? B 37 ASN A 150 ASN^? B 45 THR A 198 THR~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.45 A TRANSFORM 0.8487 0.5039 -0.1607 -0.4492 0.8471 0.2838 -0.2791 0.1687 -0.9453 9.705 -5.067 65.424 A 198 GLY A 41 GLY~? A 228 SER A 43 SER~? A 549 ASP A 82 ASP^? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 RMSD = 1.46 A TRANSFORM 0.3966 0.9071 0.1408 -0.8811 0.3331 0.3358 -0.2577 0.2572 -0.9314 26.026 108.057 57.088 229 ASP A 117 ASP^? 264 GLU A 193 GLU~? 328 ASP A 153 ASP~? ULMNm 3 1qrz_c12 PLASMINOGEN user 1 3 RMSD = 1.46 A TRANSFORM 0.0423 -0.8659 0.4984 0.7876 0.3358 0.5166 0.6147 -0.3707 -0.6962 1.589 -37.501 26.194 A 603 HIS A 70 HIS^? A 646 ASP A 72 ASP^? A 741 SER A 50 SER~? ULMNm 3 2odj_o00 PORIN D user 3 3 RMSD = 1.48 A TRANSFORM 0.0134 0.8331 0.5529 0.2200 -0.5419 0.8112 -0.9754 -0.1108 0.1906 -8.162 18.410 80.883 A 156 HIS A 107 HIS~? A 208 ASP A 206 ASP~? A 296 SER A 43 SER~? ULMNm 3 1ga8_c00 GALACTOSYL TRANSFERASE LGTC user 1 3 RMSD = 1.49 A TRANSFORM -0.1776 0.7659 -0.6179 0.7306 0.5233 0.4386 -0.6593 0.3736 0.6525 43.758 4.674 98.028 A 130 ASP A 173 ASP~? A 153 ASN A 174 ASN~? A 189 GLN A 170 GLN~? ULMNm 3 1qrz_c15 PLASMINOGEN user 1 3 RMSD = 1.49 A TRANSFORM -0.6201 0.0566 0.7825 -0.7378 -0.3813 -0.5570 -0.2669 0.9227 -0.2782 -35.231 31.313 29.825 D 603 HIS A 70 HIS^? D 646 ASP A 72 ASP^? D 741 SER A 50 SER~?