*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ukf_o00 AVIRULENCE PROTEIN AVRPPH3 user 1 3 RMSD = 0.76 A TRANSFORM -0.9478 0.2308 0.2201 -0.2235 -0.9730 0.0580 -0.2275 -0.0058 -0.9738 66.423 95.776 54.390 A 98 CYH A 72 CYH~? A 212 HIS A 200 HIS^? A 227 ASP A 216 ASP.? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.85 A TRANSFORM -0.6388 -0.7637 0.0927 -0.4492 0.4681 0.7610 0.6246 -0.4445 0.6421 72.110 -18.112 -47.126 E 51 ALA A 173 ALA.? E 148 HIS A 200 HIS^? E 163 ASP A 216 ASP.? ULMNm 3 1euu_c00 SIALIDASE user 2 3 RMSD = 0.88 A TRANSFORM 0.0675 0.3736 -0.9251 -0.5304 0.7988 0.2839 -0.8451 -0.4715 -0.2521 -5.676 -18.055 94.052 92 ASP A 89 ASP~? 260 GLU A 96 GLU~? 370 TYR A 141 TYR~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.90 A TRANSFORM -0.6434 -0.7549 0.1269 0.4393 -0.4999 -0.7464 -0.6269 0.4245 -0.6533 71.824 19.797 -13.990 F 51 ALA A 173 ALA.? F 148 HIS A 200 HIS^? F 163 ASP A 216 ASP.? ULMNm 3 1e2t_c04 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM 0.2430 -0.6392 0.7297 0.6188 -0.4772 -0.6241 -0.7470 -0.6032 -0.2795 44.213 97.921 78.385 E 69 CYH A 72 CYH~? E 107 HIS A 200 HIS^? E 122 ASP A 216 ASP.? ULMNm 3 1e2t_c05 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM 0.3469 0.2173 -0.9124 0.8226 -0.5377 0.1847 0.4505 0.8146 0.3653 36.216 76.190 -43.353 F 69 CYH A 72 CYH~? F 107 HIS A 200 HIS^? F 122 ASP A 216 ASP.? ULMNm 3 1e2t_c03 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM -0.2608 -0.5929 -0.7619 -0.8526 0.5116 -0.1063 -0.4528 -0.6219 0.6389 143.750 98.921 99.662 D 69 CYH A 72 CYH~? D 107 HIS A 200 HIS^? D 122 ASP A 216 ASP.? ULMNm 3 1e2t_c01 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM -0.2715 -0.2564 0.9277 0.8563 -0.5043 0.1112 -0.4393 -0.8246 -0.3564 95.132 72.714 128.303 B 69 CYH A 72 CYH~? B 107 HIS A 200 HIS^? B 122 ASP A 216 ASP.? ULMNm 3 1e2t_c00 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM -0.2065 0.5963 -0.7758 0.6518 -0.5075 -0.5636 0.7297 0.6220 0.2839 90.055 94.665 7.096 A 69 CYH A 72 CYH~? A 107 HIS A 200 HIS^? A 122 ASP A 216 ASP.? ULMNm 3 1e2t_c06 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.94 A TRANSFORM 0.2111 0.6556 0.7250 -0.8653 0.4704 -0.1734 0.4547 0.5907 -0.6666 -11.067 104.607 -12.533 G 69 CYH A 72 CYH~? G 107 HIS A 200 HIS^? G 122 ASP A 216 ASP.? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 RMSD = 0.95 A TRANSFORM -0.4126 -0.1891 0.8911 -0.1433 -0.9526 -0.2685 -0.8996 0.2385 -0.3659 35.393 69.342 58.663 A 16 TYR A 141 TYR~? A 40 ASP A 89 ASP~? A 103 LEU A 93 LEU~? ULMNm 3 1e2t_c07 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.96 A TRANSFORM -0.7890 -0.2468 -0.5626 -0.5910 0.5549 0.5855 -0.1678 -0.7945 0.5837 92.987 74.866 46.371 H 69 CYH A 72 CYH~? H 107 HIS A 200 HIS^? H 122 ASP A 216 ASP.? ULMNm 3 1e2t_c02 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 RMSD = 0.96 A TRANSFORM 0.7525 0.2669 0.6021 -0.6362 0.5313 0.5595 0.1706 0.8040 -0.5696 39.076 76.285 38.028 C 69 CYH A 72 CYH~? C 107 HIS A 200 HIS^? C 122 ASP A 216 ASP.? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.96 A TRANSFORM -0.3556 0.4284 0.8307 -0.6888 -0.7209 0.0769 -0.6318 0.5448 -0.5515 -37.495 86.103 48.805 B 51 ALA A 173 ALA.? B 148 HIS A 200 HIS^? B 163 ASP A 216 ASP.? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.96 A TRANSFORM -0.4989 -0.0024 0.8666 0.2897 0.9420 0.1694 0.8168 -0.3355 0.4693 -1.493 -79.330 7.589 C 51 ALA A 173 ALA.? C 148 HIS A 200 HIS^? C 163 ASP A 216 ASP.? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 0.96 A TRANSFORM 0.2441 0.9675 0.0665 0.4537 -0.0534 -0.8895 0.8571 -0.2473 0.4520 -94.053 -10.920 -67.268 H 51 ALA A 173 ALA.? H 148 HIS A 200 HIS^? H 163 ASP A 216 ASP.? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 RMSD = 0.98 A TRANSFORM -0.2419 -0.2554 0.9361 0.1420 0.9450 0.2945 0.9599 -0.2042 0.1923 29.627 -32.891 -13.932 B 16 TYR A 141 TYR~? B 40 ASP A 89 ASP~? B 103 LEU A 93 LEU~? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.00 A TRANSFORM 0.4759 -0.0406 -0.8785 0.2921 0.9495 0.1143 -0.8296 0.3110 -0.4638 -27.931 -80.146 70.866 D 51 ALA A 173 ALA.? D 148 HIS A 200 HIS^? D 163 ASP A 216 ASP.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.00 A TRANSFORM -0.8602 -0.4935 -0.1288 -0.3936 0.4819 0.7828 0.3243 -0.7241 0.6087 149.996 102.344 167.732 B 141 GLY A 128 GLY.? B 144 GLU A 73 GLU~? B 164 GLU A 199 GLU^? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.01 A TRANSFORM 0.3274 -0.4319 -0.8404 -0.6497 -0.7487 0.1316 0.6860 -0.5029 0.5258 6.399 85.603 22.714 A 51 ALA A 173 ALA.? A 148 HIS A 200 HIS^? A 163 ASP A 216 ASP.? ULMNm 3 1din_c00 DIENELACTONE HYDROLASE user 1 3 RMSD = 1.02 A TRANSFORM 0.6149 0.5437 0.5712 0.6687 0.0245 -0.7431 0.4180 -0.8389 0.3485 -40.772 19.522 24.985 123 CYH A 72 CYH~? 171 ASP A 216 ASP.? 202 HIS A 200 HIS^? ULMNm 3 1sll_c00 SIALIDASE L user 1 3 RMSD = 1.05 A TRANSFORM -0.7451 0.5329 -0.4010 -0.2666 0.3131 0.9115 -0.6113 -0.7861 0.0913 30.141 3.581 101.348 318 ASP A 89 ASP~? 595 GLU A 96 GLU~? 713 TYR A 141 TYR~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.07 A TRANSFORM -0.3501 -0.5401 0.7654 0.0164 -0.8205 -0.5714 -0.9366 0.1875 -0.2961 124.473 123.578 204.183 E 141 GLY A 128 GLY.? E 144 GLU A 73 GLU~? E 164 GLU A 199 GLU^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.09 A TRANSFORM 0.8949 0.3817 0.2312 0.4062 -0.4822 -0.7762 0.1848 -0.7885 0.5866 -1.060 82.179 179.650 F 141 GLY A 128 GLY.? F 144 GLU A 73 GLU~? F 164 GLU A 199 GLU^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.10 A TRANSFORM 0.7739 -0.6054 0.1859 0.1087 0.4162 0.9027 0.6239 0.6784 -0.3880 50.121 73.081 80.237 C 141 GLY A 128 GLY.? C 144 GLU A 73 GLU~? C 164 GLU A 199 GLU^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.11 A TRANSFORM 0.4100 -0.6731 -0.6155 0.5262 -0.3767 0.7624 0.7450 0.6365 -0.1998 19.111 -1.476 -52.496 141 ASP A 69 ASP.? 166 GLY A 109 GLY.? 169 GLU A 187 GLU^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.12 A TRANSFORM -0.6429 0.7166 -0.2705 -0.1197 -0.4427 -0.8886 0.7566 0.5389 -0.3704 82.166 113.735 77.966 D 141 GLY A 128 GLY.? D 144 GLU A 73 GLU~? D 164 GLU A 199 GLU^? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.14 A TRANSFORM 0.1795 0.9809 0.0753 0.5006 -0.1569 0.8513 -0.8469 0.1151 0.5192 -44.895 -7.446 11.658 B 60 HIS A 131 HIS~? B 84 ASP A 148 ASP^? B 140 GLY A 114 GLY.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.15 A TRANSFORM -0.4707 -0.2523 0.8455 -0.0689 -0.9448 -0.3203 -0.8796 0.2090 -0.4273 12.948 59.645 30.908 141 ASP A 105 ASP.? 166 GLY A 126 GLY.? 169 GLU A 199 GLU^? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 3 3 RMSD = 1.16 A TRANSFORM 0.2720 0.6691 -0.6917 0.9315 -0.0027 0.3637 -0.2415 0.7432 0.6240 -26.621 -21.909 -42.743 B 60 HIS A 200 HIS^? B 84 ASP A 216 ASP.? B 140 GLY A 128 GLY.? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 3 3 RMSD = 1.16 A TRANSFORM 0.1631 -0.4795 -0.8622 0.7729 0.6053 -0.1904 -0.6132 0.6353 -0.4693 9.088 -37.663 37.678 B 57 HIS A 200 HIS^? B 102 ASP A 216 ASP.? B 193 GLY A 71 GLY~? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 3 3 RMSD = 1.17 A TRANSFORM 0.5275 -0.5046 -0.6835 0.8385 0.4384 0.3235 -0.1364 0.7437 -0.6544 14.099 -29.139 -13.023 A 57 HIS A 200 HIS^? A 102 ASP A 216 ASP.? A 193 GLY A 71 GLY~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.17 A TRANSFORM 0.0103 0.9605 0.2783 0.9705 0.0574 -0.2342 0.2409 -0.2725 0.9315 -53.411 -25.914 -5.685 141 ASP A 192 ASP^? 166 GLY A 117 GLY.? 169 GLU A 124 GLU.? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 RMSD = 1.18 A TRANSFORM 0.4021 0.4494 0.7977 0.5699 -0.8048 0.1661 -0.7166 -0.3878 0.5797 37.077 97.679 136.482 A 451 GLU A 73 GLU~? A 504 TYR A 127 TYR.? A 540 GLU A 199 GLU^? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 3 3 RMSD = 1.18 A TRANSFORM 0.5275 -0.5103 -0.6792 0.8372 0.4483 0.3133 -0.1446 0.7339 -0.6637 14.339 -29.556 -12.228 A 57 HIS A 200 HIS^? A 102 ASP A 216 ASP.? A 193 GLY A 71 GLY~? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.18 A TRANSFORM 0.7719 0.5878 -0.2420 0.2311 -0.6141 -0.7546 0.5922 -0.5266 0.6099 -54.408 61.781 12.360 A 57 HIS A 131 HIS~? A 102 ASP A 148 ASP^? A 193 GLY A 239 GLY.? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 RMSD = 1.19 A TRANSFORM 0.1093 -0.8525 0.5111 0.3434 0.5149 0.7855 0.9328 -0.0897 -0.3490 19.831 9.000 -14.475 A 104 ILE A 243 ILE^? A 106 HIS A 131 HIS~? A 142 ASP A 148 ASP^? ULMNm 3 1a0j_c14 TRYPSIN user 3 3 RMSD = 1.19 A TRANSFORM -0.4532 -0.7228 -0.5217 0.2487 -0.6645 0.7047 0.8561 -0.1896 -0.4809 88.711 65.026 42.545 C 57 HIS A 200 HIS^? C 102 ASP A 216 ASP.? C 193 GLY A 71 GLY~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 RMSD = 1.19 A TRANSFORM 0.2536 0.0917 0.9630 0.7107 -0.6930 -0.1212 -0.6562 -0.7151 0.2409 25.925 59.332 137.448 A 50 GLN A 237 GLN~? A 91 LEU A 178 LEU.? A 133 GLU A 180 GLU~? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 RMSD = 1.20 A TRANSFORM 0.7346 0.6594 0.1597 0.6561 -0.6306 -0.4146 0.1726 -0.4094 0.8959 -81.106 35.516 46.658 B 57 HIS A 131 HIS~? B 102 ASP A 148 ASP^? B 193 GLY A 239 GLY.? ULMNm 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 RMSD = 1.20 A TRANSFORM 0.6688 -0.7277 -0.1522 0.7420 0.6408 0.1970 0.0458 0.2447 -0.9685 27.572 79.586 1.937 A 461 GLU A 73 GLU~? A 503 TYR A 127 TYR.? A 537 GLU A 199 GLU^? ULMNm 3 1a0j_c12 TRYPSIN user 3 3 RMSD = 1.21 A TRANSFORM -0.8542 0.4884 0.1784 0.2970 0.7398 -0.6037 0.4269 0.4627 0.7770 40.505 -10.486 22.121 A 57 HIS A 200 HIS^? A 102 ASP A 216 ASP.? A 193 GLY A 71 GLY~? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.22 A TRANSFORM 0.7635 0.6030 -0.2312 0.2510 -0.6069 -0.7541 0.5951 -0.5177 0.6147 -55.025 60.358 11.620 A 57 HIS A 131 HIS~? A 102 ASP A 148 ASP^? A 193 GLY A 239 GLY.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 8 3 RMSD = 1.23 A TRANSFORM -0.2703 -0.5605 0.7828 0.8132 -0.5682 -0.1260 -0.5154 -0.6025 -0.6093 68.786 13.828 74.535 I 303 TYR A 245 TYR^? I 306 VAL A 167 VAL^? I 308 VAL A 161 VAL~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.24 A TRANSFORM 0.8182 0.2084 -0.5358 -0.3221 0.9382 -0.1269 -0.4762 -0.2764 -0.8347 -13.077 -1.876 58.389 A 229 ALA A 138 ALA~? A 257 ALA A 146 ALA^? A 328 ASP A 148 ASP^? ULMNm 3 8pch_c01 CATHEPSIN H user 1 3 RMSD = 1.24 A TRANSFORM -0.0200 -0.9912 0.1311 -0.1244 0.1326 0.9833 0.9920 -0.0033 0.1260 62.242 10.479 -23.934 A 19 GLN A 64 GLN.? A 25 CYH A 72 CYH~? A 159 HIS A 200 HIS^? ULMNm 3 1a0j_c12 TRYPSIN user 2 3 RMSD = 1.24 A TRANSFORM -0.5173 -0.3855 0.7641 0.7718 -0.5959 0.2218 -0.3698 -0.7045 -0.6058 64.372 33.680 127.947 A 57 HIS A 131 HIS~? A 102 ASP A 148 ASP^? A 193 GLY A 239 GLY.? ULMNm 3 1bwd_c03 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 RMSD = 1.24 A TRANSFORM 0.5993 0.2544 -0.7590 -0.1247 -0.9069 -0.4024 0.7908 -0.3358 0.5118 47.733 124.821 5.875 B 179 ASP A 216 ASP.? B 227 HIS A 200 HIS^? B 332 CYH A 72 CYH~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.24 A TRANSFORM 0.3247 0.0618 0.9438 -0.1740 -0.9769 0.1239 -0.9297 0.2044 0.3065 64.488 168.043 179.054 B 141 GLY A 128 GLY.? B 144 GLU A 199 GLU^? B 164 GLU A 73 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.24 A TRANSFORM 0.0020 0.9738 0.2275 0.3837 0.2093 -0.8994 0.9235 -0.0891 0.3732 -53.163 -4.028 -30.514 141 ASP A 192 ASP^? 166 GLY A 126 GLY.? 169 GLU A 124 GLU.? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 RMSD = 1.25 A TRANSFORM -0.7784 0.5570 0.2896 -0.2914 0.0881 -0.9525 0.5561 0.8258 -0.0937 83.380 52.150 -16.864 B 550 GLN A 237 GLN~? B 591 LEU A 178 LEU.? B 633 GLU A 180 GLU~? ULMNm 3 1bwd_c02 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 RMSD = 1.25 A TRANSFORM 0.2322 -0.1180 -0.9655 0.9657 0.1466 0.2143 -0.1163 0.9821 -0.1480 112.359 -21.939 -42.013 A 179 ASP A 216 ASP.? A 227 HIS A 200 HIS^? A 332 CYH A 72 CYH~? ULMNm 3 1a0j_c15 TRYPSIN user 2 3 RMSD = 1.25 A TRANSFORM 0.9240 -0.3338 -0.1863 0.1672 0.7911 -0.5884 -0.3438 -0.5126 -0.7868 -17.032 -31.415 151.952 D 57 HIS A 131 HIS~? D 102 ASP A 148 ASP^? D 193 GLY A 239 GLY.? ULMNm 3 1a0j_c14 TRYPSIN user 2 3 RMSD = 1.25 A TRANSFORM 0.1109 0.8960 0.4300 -0.5672 0.4123 -0.7129 0.8161 0.1648 -0.5539 -27.708 54.963 29.440 C 57 HIS A 131 HIS~? C 102 ASP A 148 ASP^? C 193 GLY A 239 GLY.? ULMNm 3 1a0j_c13 TRYPSIN user 2 3 RMSD = 1.27 A TRANSFORM -0.2268 -0.1376 -0.9642 -0.1562 0.9823 -0.1035 -0.9613 -0.1271 0.2442 75.097 -1.435 105.553 B 57 HIS A 131 HIS~? B 102 ASP A 148 ASP^? B 193 GLY A 239 GLY.? ULMNm 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 RMSD = 1.29 A TRANSFORM 0.5147 0.2707 0.8135 -0.4796 0.8774 0.0115 0.7106 0.3961 -0.5815 45.398 15.799 63.562 B 451 GLU A 73 GLU~? B 504 TYR A 127 TYR.? B 540 GLU A 199 GLU^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.29 A TRANSFORM -0.6207 -0.2743 0.7345 0.0660 0.9152 0.3976 0.7812 -0.2953 0.5500 123.515 30.681 147.467 E 141 GLY A 128 GLY.? E 144 GLU A 199 GLU^? E 164 GLU A 73 GLU~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.29 A TRANSFORM -0.4685 -0.0506 -0.8820 0.1649 0.9758 -0.1435 -0.8680 0.2127 0.4488 86.494 17.626 177.615 F 141 GLY A 128 GLY.? F 144 GLU A 199 GLU^? F 164 GLU A 73 GLU~? ULMNm 3 1jdw_c01 L-ARGININE-GLYCINE AMIDINOTRANSFERASuser 1 3 RMSD = 1.30 A TRANSFORM -0.0428 -0.9125 -0.4069 -0.9700 0.1355 -0.2017 -0.2391 -0.3861 0.8909 93.829 105.275 45.632 254 ASP A 216 ASP.? 303 HIS A 200 HIS^? 407 CYH A 72 CYH~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 RMSD = 1.30 A TRANSFORM 0.5714 0.0780 -0.8169 -0.3187 -0.8962 -0.3085 0.7562 -0.4367 0.4873 25.621 51.692 -34.223 A 37 ASP A 89 ASP~? A 56 ILE A 86 ILE.? A 82 TYR A 141 TYR~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.31 A TRANSFORM 0.8353 -0.5498 -0.0022 0.5373 0.8155 0.2151 0.1165 0.1808 -0.9766 77.758 16.778 127.163 D 141 GLY A 128 GLY.? D 144 GLU A 199 GLU^? D 164 GLU A 73 GLU~? ULMNm 3 1bwl_c01 NADPH DEHYDROGENASE 1 user 1 3 RMSD = 1.31 A TRANSFORM 0.1978 -0.9521 0.2332 -0.9007 -0.2704 -0.3400 -0.3868 0.1428 0.9110 80.939 130.592 20.297 191 ASN A 112 ASN.? 194 HIS A 131 HIS~? 196 TYR A 130 TYR~? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.32 A TRANSFORM -0.7934 0.5798 -0.1854 -0.5518 -0.8136 -0.1830 0.2569 0.0429 -0.9655 63.026 168.701 130.868 C 141 GLY A 128 GLY.? C 144 GLU A 199 GLU^? C 164 GLU A 73 GLU~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.32 A TRANSFORM 0.5709 0.0854 -0.8166 -0.3376 -0.8822 -0.3283 0.7484 -0.4631 0.4748 28.243 35.959 -60.317 B 37 ASP A 89 ASP~? B 56 ILE A 86 ILE.? B 82 TYR A 141 TYR~? ULMNm 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 RMSD = 1.32 A TRANSFORM -0.2353 0.3510 -0.9063 0.3176 -0.8535 -0.4131 0.9185 0.3851 -0.0894 66.389 57.152 -12.184 B 36 GLU A 96 GLU~? B 47 ASP A 89 ASP~? B 161 TYR A 141 TYR~? ULMNm 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 RMSD = 1.32 A TRANSFORM -0.2925 0.8964 0.3330 0.1684 -0.2945 0.9407 -0.9413 -0.3312 0.0649 13.511 6.857 138.682 A 36 GLU A 96 GLU~? A 47 ASP A 89 ASP~? A 161 TYR A 141 TYR~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 RMSD = 1.34 A TRANSFORM -0.2642 0.9569 -0.1207 0.7600 0.2836 0.5847 -0.5938 -0.0627 0.8022 -24.351 -39.163 38.201 A 105 ALA A 173 ALA.? A 244 ASP A 216 ASP.? A 271 HIS A 200 HIS^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.35 A TRANSFORM -0.6111 -0.1152 0.7831 -0.4599 -0.7536 -0.4697 -0.6443 0.6472 -0.4075 12.903 67.211 3.018 141 ASP A 105 ASP.? 166 GLY A 126 GLY.? 169 GLU A 73 GLU~? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.35 A TRANSFORM -0.2742 0.9607 0.0433 0.9605 0.2713 0.0620 -0.0478 -0.0586 0.9971 -30.387 -37.014 20.576 E 57 HIS A 131 HIS~? E 102 ASP A 148 ASP^? E 193 GLY A 114 GLY.? ULMNm 3 2pth_c00 PEPTIDYL-TRNA HYDROLASE user 1 3 RMSD = 1.35 A TRANSFORM -0.1284 -0.1068 -0.9860 -0.9776 -0.1534 0.1439 0.1666 -0.9824 0.0847 71.913 95.248 93.034 10 ASN A 112 ASN.? 20 HIS A 131 HIS~? 93 ASP A 148 ASP^? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 RMSD = 1.37 A TRANSFORM -0.4949 0.8347 -0.2417 0.8341 0.3782 -0.4016 0.2438 0.4004 0.8833 -1.617 -44.945 -19.537 30 GLY A 114 GLY.? 48 HIS A 131 HIS~? 99 ASP A 148 ASP^? ULMNm 3 1a0j_c14 TRYPSIN user 1 3 RMSD = 1.37 A TRANSFORM 0.2837 -0.6074 -0.7420 -0.3794 -0.7817 0.4949 0.8806 -0.1411 0.4523 63.151 99.146 32.370 C 57 HIS A 131 HIS~? C 102 ASP A 148 ASP^? C 193 GLY A 114 GLY.? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.38 A TRANSFORM 0.5631 -0.0764 -0.8228 -0.1940 -0.9801 -0.0417 0.8033 -0.1832 0.5667 44.666 86.027 14.913 C1050 GLN A 64 GLN.? C1091 LEU A 68 LEU.? C1133 GLU A 73 GLU~? ULMNm 3 1a0j_c15 TRYPSIN user 1 3 RMSD = 1.38 A TRANSFORM 0.8250 0.4730 0.3093 0.4106 -0.8777 0.2472 -0.3884 0.0770 0.9183 -63.299 41.859 100.403 D 57 HIS A 131 HIS~? D 102 ASP A 148 ASP^? D 193 GLY A 114 GLY.? ULMNm 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.39 A TRANSFORM -0.7598 -0.1498 0.6327 0.6499 -0.1467 0.7457 0.0189 -0.9778 -0.2088 67.846 20.254 138.758 C 151 SER A 211 SER^? C 164 TYR A 213 TYR^? C 168 LYS A 225 LYS^? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.40 A TRANSFORM -0.3066 0.8410 0.4457 0.9513 0.2866 0.1135 0.0323 -0.4588 0.8879 16.257 -2.601 87.096 A 50 GLN A 64 GLN.? A 91 LEU A 68 LEU.? A 133 GLU A 73 GLU~? ULMNm 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.40 A TRANSFORM -0.7454 -0.3070 0.5917 -0.6512 0.1455 -0.7448 -0.1426 0.9405 0.3084 78.077 65.203 10.215 B 151 SER A 211 SER^? B 164 TYR A 213 TYR^? B 168 LYS A 225 LYS^? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.40 A TRANSFORM 0.4976 0.7004 -0.5117 0.3932 -0.7080 -0.5867 0.7732 -0.0907 0.6277 -10.435 55.717 35.992 A 50 GLN A 64 GLN.? A 91 LEU A 68 LEU.? A 133 GLU A 73 GLU~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.40 A TRANSFORM 0.3350 0.0941 -0.9375 -0.3390 0.9404 -0.0267 -0.8791 -0.3267 -0.3470 5.775 22.525 63.350 A 603 HIS A 131 HIS~? A 646 ASP A 148 ASP^? A 739 GLY A 114 GLY.? ULMNm 3 2p3i_p00 VP4 user 1 3 RMSD = 1.40 A TRANSFORM -0.1619 -0.8542 -0.4942 0.9598 -0.2527 0.1224 0.2294 0.4545 -0.8607 98.700 -25.581 -35.101 A 101 ARG A 228 ARG~? A 188 TYR A 213 TYR^? A 190 SER A 211 SER^? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.41 A TRANSFORM -0.1757 0.7669 0.6173 -0.6275 -0.5704 0.5300 -0.7585 0.2942 -0.5814 63.537 98.680 78.385 B 550 GLN A 64 GLN.? B 591 LEU A 68 LEU.? B 633 GLU A 73 GLU~? ULMNm 3 1wbf_p00 PROTEIN (AGGLUTININ) user 1 3 RMSD = 1.41 A TRANSFORM 0.0254 0.9439 0.3294 -0.0937 0.3303 -0.9392 0.9953 0.0070 -0.0968 -64.456 -3.893 -5.572 A 44 ASN A 110 ASN.? A 213 PRO A 111 PRO.? A 219 ASN A 104 ASN^? ULMNm 3 1a0j_c13 TRYPSIN user 1 3 RMSD = 1.41 A TRANSFORM -0.1665 -0.2904 0.9423 0.1038 -0.9555 -0.2761 -0.9806 -0.0519 -0.1892 58.337 97.943 106.700 B 57 HIS A 131 HIS~? B 102 ASP A 148 ASP^? B 193 GLY A 114 GLY.? ULMNm 3 9pap_c01 PAPAIN user 1 3 RMSD = 1.42 A TRANSFORM -0.6374 -0.5468 -0.5429 0.2577 -0.8153 0.5186 0.7262 -0.1906 -0.6605 83.817 96.902 -2.870 19 GLN A 64 GLN.? 25 CYH A 72 CYH~? 159 HIS A 200 HIS^? ULMNm 3 1a0j_c12 TRYPSIN user 1 3 RMSD = 1.43 A TRANSFORM -0.6607 0.4820 -0.5754 0.5734 0.8188 0.0275 -0.4844 0.3118 0.8174 37.442 -34.277 58.879 A 57 HIS A 131 HIS~? A 102 ASP A 148 ASP^? A 193 GLY A 114 GLY.? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 RMSD = 1.43 A TRANSFORM -0.4143 0.8948 0.1668 0.0388 0.2004 -0.9789 0.9093 0.3991 0.1178 -6.360 -1.051 -35.069 30 GLY A 71 GLY~? 48 HIS A 200 HIS^? 99 ASP A 216 ASP.? ULMNm 3 1euu_c00 SIALIDASE user 3 3 RMSD = 1.43 A TRANSFORM 0.8768 0.1873 -0.4430 -0.0070 0.9260 0.3776 -0.4809 0.3279 -0.8132 -58.637 -70.461 22.634 92 ASP A 208 ASP.? 260 GLU A 232 GLU~? 370 TYR A 158 TYR~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.43 A TRANSFORM -0.5426 -0.1175 0.8317 0.7370 0.4085 0.5385 0.4031 -0.9051 0.1350 9.459 -48.981 26.427 141 ASP A 105 ASP.? 166 GLY A 114 GLY.? 169 GLU A 73 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 RMSD = 1.44 A TRANSFORM -0.0144 -0.9639 -0.2659 0.9826 -0.0629 0.1745 0.1849 0.2588 -0.9481 45.518 -37.824 -29.335 141 ASP A 220 ASP.? 166 GLY A 206 GLY^? 169 GLU A 232 GLU~? ULMNm 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 6 3 RMSD = 1.44 A TRANSFORM 0.0824 0.8272 0.5558 -0.7121 -0.3413 0.6136 -0.6973 0.4464 -0.5609 -17.888 79.068 76.326 A 36 GLU A 232 GLU~? A 47 ASP A 208 ASP.? A 161 TYR A 158 TYR~? ULMNm 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 6 3 RMSD = 1.45 A TRANSFORM 0.6835 0.4279 -0.5914 0.0073 -0.8142 -0.5806 0.7299 -0.3925 0.5596 -10.963 85.069 45.525 B 36 GLU A 232 GLU~? B 47 ASP A 208 ASP.? B 161 TYR A 158 TYR~? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.45 A TRANSFORM 0.9123 -0.4073 0.0426 0.1191 0.3634 0.9240 0.3918 0.8379 -0.3800 -7.622 -7.750 -43.478 A 57 HIS A 131 HIS~? A 102 ASP A 148 ASP^? A 193 GLY A 114 GLY.? ULMNm 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.46 A TRANSFORM 0.2851 0.9125 -0.2933 -0.4710 -0.1332 -0.8720 0.8348 -0.3868 -0.3918 -45.538 53.431 68.534 D 151 SER A 211 SER^? D 164 TYR A 213 TYR^? D 168 LYS A 225 LYS^? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 RMSD = 1.47 A TRANSFORM -0.1432 0.8538 -0.5005 0.7814 -0.2129 -0.5867 0.6074 0.4751 0.6366 -26.449 1.385 -22.557 E 57 HIS A 200 HIS^? E 102 ASP A 216 ASP.? E 193 GLY A 128 GLY.? ULMNm 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 RMSD = 1.47 A TRANSFORM 0.4110 0.8429 -0.3473 0.4698 0.1306 0.8730 -0.7813 0.5220 0.3424 -45.182 32.096 61.648 A 151 SER A 211 SER^? A 164 TYR A 213 TYR^? A 168 LYS A 225 LYS^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 2 3 RMSD = 1.47 A TRANSFORM 0.6890 0.5140 -0.5110 -0.6861 0.6897 -0.2315 -0.2334 -0.5101 -0.8278 -28.515 28.992 53.727 I 303 TYR A 130 TYR~? I 306 VAL A 129 VAL.? I 308 VAL A 116 VAL^?