*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 3ay3_o00 NAD-DEPENDENT EPIMERASE/DEHYDRATASE user 2 4 RMSD = 1.43 A TRANSFORM -0.9253 -0.3682 0.0905 -0.3776 0.9163 -0.1337 -0.0337 -0.1579 -0.9869 76.256 76.127 71.543 A 33 ASP A 288 ASP^? A 50 ASP A 278 ASP.? A 135 TYR A 203 TYR~? A 139 LYS A 206 LYS.? ULMNm 4 3ay3_o03 NAD-DEPENDENT EPIMERASE/DEHYDRATASE user 2 4 RMSD = 1.46 A TRANSFORM -0.3475 0.9274 -0.1383 0.9370 0.3375 -0.0905 -0.0373 -0.1610 -0.9862 92.143 57.512 98.035 D 33 ASP A 288 ASP^? D 50 ASP A 278 ASP.? D 135 TYR A 203 TYR~? D 139 LYS A 206 LYS.? ULMNm 4 3ay3_o01 NAD-DEPENDENT EPIMERASE/DEHYDRATASE user 2 4 RMSD = 1.48 A TRANSFORM 0.9823 -0.1857 -0.0262 0.1774 0.9652 -0.1920 0.0610 0.1839 0.9810 66.469 74.267 -19.686 B 33 ASP A 288 ASP^? B 50 ASP A 278 ASP.? B 135 TYR A 203 TYR~? B 139 LYS A 206 LYS.? ULMNm 4 3ay3_o02 NAD-DEPENDENT EPIMERASE/DEHYDRATASE user 3 4 RMSD = 1.50 A TRANSFORM 0.1436 0.9737 -0.1767 -0.9889 0.1480 0.0121 0.0380 0.1730 0.9842 89.689 68.199 7.071 C 33 ASP A 288 ASP^? C 50 ASP A 278 ASP.? C 135 TYR A 203 TYR~? C 139 LYS A 206 LYS.? ULMNm 3 3gqj_o00 CELL INHIBITING FACTOR (CIF) user 1 3 RMSD = 0.53 A TRANSFORM -0.9849 0.0266 -0.1713 0.1612 -0.2230 -0.9614 -0.0638 -0.9744 0.2154 21.407 30.202 16.907 A 123 CYH A 118 CYH~? A 181 HIS A 291 HIS^? A 200 GLN A 306 GLN^? ULMNm 3 3eir_o00 CHBP, A CIF HOMOLOGUE FROM BURKHOLDEuser 1 3 RMSD = 0.60 A TRANSFORM 0.1360 -0.9728 -0.1874 -0.9907 -0.1343 -0.0215 -0.0043 0.1885 -0.9821 56.473 48.691 67.358 A 156 CYH A 118 CYH~? A 211 HIS A 291 HIS^? A 231 GLN A 306 GLN^? ULMNm 3 3gqm_o00 CELL INHIBITING FACTOR (CIFBP) user 1 3 RMSD = 0.61 A TRANSFORM -0.1130 0.9683 0.2229 0.9929 0.1186 -0.0117 -0.0378 0.2200 -0.9748 -2.238 -7.750 8.384 A 90 CYH A 118 CYH~? A 145 HIS A 291 HIS^? A 165 GLN A 306 GLN^? ULMNm 3 3efy_o00 CIF (CELL CYCLE INHIBITING FACTOR) user 1 3 RMSD = 0.62 A TRANSFORM -0.0346 -0.9990 0.0299 -0.3295 -0.0168 -0.9440 0.9435 -0.0425 -0.3285 66.818 36.208 12.527 A 109 CYH A 118 CYH~? A 165 HIS A 291 HIS^? A 185 GLN A 306 GLN^? ULMNm 3 3eit_o00 CHBP, A CIF HOMOLOGUE FROM BURKHOLDEuser 1 3 RMSD = 0.65 A TRANSFORM 0.1274 -0.9626 -0.2390 -0.9918 -0.1237 -0.0303 -0.0004 0.2409 -0.9705 56.820 47.284 65.085 A 156 CYH A 118 CYH~? A 211 HIS A 291 HIS^? A 231 GLN A 306 GLN^? ULMNm 3 1qrz_c21 PLASMINOGEN user 2 3 RMSD = 0.75 A TRANSFORM -0.3751 0.3428 -0.8613 0.2105 -0.8734 -0.4393 -0.9028 -0.3460 0.2555 -29.297 24.815 -3.541 B 603 HIS A 158 HIS.? B 646 ASP A 119 ASP~? B 739 GLY A 100 GLY.? ULMNm 3 1qrz_c23 PLASMINOGEN user 2 3 RMSD = 0.75 A TRANSFORM 0.7268 0.4565 -0.5132 -0.2166 0.8613 0.4595 0.6518 -0.2228 0.7249 -47.254 -31.144 28.824 D 603 HIS A 158 HIS.? D 646 ASP A 119 ASP~? D 739 GLY A 100 GLY.? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 0.76 A TRANSFORM -0.3985 0.3830 -0.8333 0.1440 -0.8712 -0.4693 -0.9058 -0.3070 0.2921 -2.832 25.810 33.283 A 603 HIS A 158 HIS.? A 646 ASP A 119 ASP~? A 739 GLY A 100 GLY.? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 0.81 A TRANSFORM 0.7457 0.4089 -0.5260 -0.1600 0.8763 0.4545 0.6468 -0.2548 0.7189 7.749 -31.693 -8.783 C 603 HIS A 158 HIS.? C 646 ASP A 119 ASP~? C 739 GLY A 100 GLY.? ULMNm 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 1 3 RMSD = 0.91 A TRANSFORM -0.4591 -0.7343 -0.5000 0.3181 -0.6614 0.6792 -0.8295 0.1527 0.5372 53.166 -12.139 7.389 B 46 HIS A 291 HIS^? B 163 ALA A 307 ALA^? B 182 SER A 308 SER^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 RMSD = 0.92 A TRANSFORM -0.0969 0.9066 -0.4107 0.1196 0.4203 0.8995 0.9881 0.0381 -0.1492 -1.273 -12.853 -35.454 A 49 ASP A 117 ASP~? A 147 THR A 120 THR~? A 294 ASP A 114 ASP.? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 RMSD = 0.96 A TRANSFORM -0.2651 -0.6737 0.6898 -0.9640 0.2020 -0.1731 -0.0227 -0.7109 -0.7030 3.790 39.422 17.912 A 10 ASP A 176 ASP^? A 186 ASN A 336 ASN^? A 260 ALA A 193 ALA^? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 11 3 RMSD = 0.96 A TRANSFORM -0.7944 -0.5817 0.1745 -0.1755 -0.0553 -0.9829 0.5815 -0.8115 -0.0582 -9.990 69.749 34.728 D 130 SER A 318 SER^? D 166 PHE A 261 PHE~? D 182 PHE A 251 PHE~? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 6 3 RMSD = 0.97 A TRANSFORM 0.2327 0.9681 -0.0924 0.1687 0.0533 0.9842 0.9578 -0.2446 -0.1510 -29.706 31.980 74.496 B 130 SER A 318 SER^? B 166 PHE A 261 PHE~? B 182 PHE A 251 PHE~? ULMNm 3 1qrz_c21 PLASMINOGEN user 3 3 RMSD = 1.00 A TRANSFORM -0.3897 -0.6578 -0.6445 0.7730 -0.6141 0.1593 -0.5006 -0.4361 0.7478 -22.484 3.874 -16.803 B 603 HIS A 158 HIS.? B 646 ASP A 119 ASP~? B 739 GLY A 149 GLY~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 RMSD = 1.00 A TRANSFORM 0.2358 -0.9529 0.1905 -0.1350 0.1620 0.9775 -0.9624 -0.2563 -0.0905 57.778 -28.727 77.313 A 198 GLY A 115 GLY.? A 228 SER A 96 SER.? A 549 ASP A 117 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.01 A TRANSFORM -0.4364 -0.6307 -0.6416 0.7251 -0.6688 0.1642 -0.5327 -0.3936 0.7492 4.883 4.590 21.002 A 603 HIS A 158 HIS.? A 646 ASP A 119 ASP~? A 739 GLY A 149 GLY~? ULMNm 3 1qrz_c23 PLASMINOGEN user 3 3 RMSD = 1.02 A TRANSFORM 0.3305 0.2109 -0.9199 -0.7729 0.6199 -0.1356 0.5416 0.7558 0.3679 -32.083 -10.537 26.421 D 603 HIS A 158 HIS.? D 646 ASP A 119 ASP~? D 739 GLY A 149 GLY~? ULMNm 3 1qrz_c22 PLASMINOGEN user 3 3 RMSD = 1.03 A TRANSFORM 0.3765 0.1874 -0.9072 -0.7386 0.6519 -0.1718 0.5593 0.7347 0.3839 21.854 -10.404 -11.989 C 603 HIS A 158 HIS.? C 646 ASP A 119 ASP~? C 739 GLY A 149 GLY~? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 RMSD = 1.06 A TRANSFORM -0.1579 -0.9838 -0.0846 0.6918 -0.0491 -0.7204 0.7046 -0.1723 0.6884 -0.381 54.524 36.685 D 130 SER A 60 SER~? D 166 PHE A 87 PHE~? D 182 PHE A 116 PHE.? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.07 A TRANSFORM -0.4617 -0.5413 0.7027 0.7058 0.2556 0.6606 -0.5372 0.8011 0.2640 3.654 38.314 44.473 C 603 HIS A 158 HIS.? C 646 ASP A 163 ASP~? C 739 GLY A 149 GLY~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.10 A TRANSFORM -0.0536 0.9941 -0.0941 -0.2413 0.0785 0.9673 0.9690 0.0746 0.2357 -8.904 -21.431 -11.434 141 ASP A 106 ASP.? 166 GLY A 284 GLY~? 169 GLU A 286 GLU.? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.12 A TRANSFORM -0.4080 -0.5436 0.7335 0.7053 0.3225 0.6314 -0.5798 0.7749 0.2518 5.444 39.176 -18.108 A 603 HIS A 158 HIS.? A 646 ASP A 163 ASP~? A 739 GLY A 149 GLY~? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.12 A TRANSFORM -0.6763 -0.7328 0.0756 0.3837 -0.2627 0.8853 -0.6289 0.6277 0.4588 -20.485 16.157 -38.407 B 603 HIS A 158 HIS.? B 646 ASP A 163 ASP~? B 739 GLY A 284 GLY~? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 RMSD = 1.16 A TRANSFORM 0.8307 0.1807 0.5266 0.4963 0.1882 -0.8475 -0.2522 0.9654 0.0667 -21.957 25.716 36.515 54 ASP A 288 ASP^? 158 THR A 160 THR.? 317 ASP A 176 ASP^? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 6 3 RMSD = 1.17 A TRANSFORM -0.2304 -0.9186 -0.3212 -0.2600 -0.2600 0.9299 -0.9377 0.2977 -0.1789 -33.153 36.784 108.045 A 130 SER A 318 SER^? A 166 PHE A 261 PHE~? A 182 PHE A 251 PHE~? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.18 A TRANSFORM -0.9344 -0.0262 -0.3551 -0.1968 0.8692 0.4537 0.2968 0.4938 -0.8174 51.225 5.504 29.235 B 46 ASP A 217 ASP~? B 100 ARG A 224 ARG~? B 116 GLN A 107 GLN.? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 4 3 RMSD = 1.18 A TRANSFORM 0.7850 0.5049 0.3589 0.2627 0.2534 -0.9310 -0.5611 0.8251 0.0663 -29.010 64.666 62.446 C 130 SER A 318 SER^? C 166 PHE A 261 PHE~? C 182 PHE A 251 PHE~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.19 A TRANSFORM 0.5686 -0.0094 -0.8225 -0.2406 0.9543 -0.1773 0.7866 0.2987 0.5404 35.308 53.830 40.150 C 603 HIS A 158 HIS.? C 646 ASP A 163 ASP~? C 739 GLY A 284 GLY~? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 RMSD = 1.19 A TRANSFORM -0.2637 0.8548 -0.4470 0.3694 0.5176 0.7718 0.8911 0.0384 -0.4522 125.983 60.791 115.849 B1198 GLY A 267 GLY.? B1228 SER A 81 SER~? B1549 ASP A 78 ASP~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.20 A TRANSFORM 0.2397 -0.3092 0.9203 0.6770 0.7326 0.0698 -0.6958 0.6063 0.3850 9.850 -88.309 -149.674 A 183 GLY A 98 GLY.? B 419 GLY A 100 GLY.? B 420 ALA A 103 ALA.? ULMNm 3 12as_c00 ASPARAGINE SYNTHETASE user 3 3 RMSD = 1.21 A TRANSFORM 0.9057 -0.0621 0.4193 -0.0634 -0.9979 -0.0109 0.4191 -0.0167 -0.9078 13.550 50.018 40.205 A 46 ASP A 217 ASP~? A 100 ARG A 224 ARG~? A 116 GLN A 107 GLN.? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 8 3 RMSD = 1.23 A TRANSFORM 0.4424 -0.0875 0.8926 0.8141 0.4567 -0.3587 -0.3762 0.8853 0.2732 25.233 52.157 66.683 A 50 GLN A 338 GLN^? A 91 LEU A 174 LEU^? A 133 GLU A 271 GLU^? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 7 3 RMSD = 1.23 A TRANSFORM 0.4633 0.1497 0.8735 -0.8558 0.3315 0.3971 -0.2301 -0.9315 0.2817 75.098 45.289 55.468 B 550 GLN A 338 GLN^? B 591 LEU A 174 LEU^? B 633 GLU A 271 GLU^? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 RMSD = 1.24 A TRANSFORM -0.3987 0.1773 -0.8998 -0.1187 0.9629 0.2424 0.9094 0.2034 -0.3629 51.832 -15.459 42.533 A 198 GLY A 267 GLY.? A 228 SER A 81 SER~? A 549 ASP A 78 ASP~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 RMSD = 1.25 A TRANSFORM 0.2693 0.1956 -0.9430 0.1743 -0.9729 -0.1520 -0.9471 -0.1235 -0.2961 43.505 82.415 114.357 A 270 ASN A 155 ASN.? A 384 ASN A 219 ASN~? A 385 GLU A 220 GLU~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 8 3 RMSD = 1.25 A TRANSFORM 0.8725 -0.4262 -0.2389 -0.2827 -0.0415 -0.9583 0.3985 0.9037 -0.1567 40.735 56.461 65.881 A 50 GLN A 338 GLN^? A 91 LEU A 174 LEU^? A 133 GLU A 271 GLU^? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 8 3 RMSD = 1.25 A TRANSFORM 0.3217 -0.3758 -0.8691 -0.8806 0.2184 -0.4204 0.3478 0.9006 -0.2607 76.151 44.933 43.754 C1050 GLN A 338 GLN^? C1091 LEU A 174 LEU^? C1133 GLU A 271 GLU^? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 RMSD = 1.25 A TRANSFORM 0.0519 -0.9674 -0.2478 -0.9971 -0.0638 0.0403 -0.0548 0.2450 -0.9680 13.461 35.962 23.227 A 10 ASP A 176 ASP^? A 186 ASN A 336 ASN^? A 260 ALA A 190 ALA.? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 4 3 RMSD = 1.26 A TRANSFORM 0.6726 0.4768 -0.5660 0.7399 -0.4196 0.5258 0.0132 -0.7724 -0.6350 -1.853 32.829 43.519 B 1 SER A 81 SER~? B 69 ALA A 77 ALA~? B 241 ASN A 266 ASN.? ULMNm 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 1 3 RMSD = 1.28 A TRANSFORM 0.4765 -0.1951 0.8573 -0.1535 0.9416 0.2997 -0.8657 -0.2744 0.4187 28.319 2.242 98.020 B 237 HIS A 291 HIS^? B 238 GLY A 293 GLY^? B 287 CYH A 118 CYH~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 5 3 RMSD = 1.30 A TRANSFORM -0.8877 0.4604 -0.0108 0.2382 0.4389 -0.8664 -0.3941 -0.7716 -0.4992 2.787 32.509 55.201 B 1 SER A 133 SER~? B 69 ALA A 131 ALA~? B 241 ASN A 132 ASN.? ULMNm 3 2dbt_c00 CHITINASE C user 3 3 RMSD = 1.32 A TRANSFORM 0.9389 -0.0642 0.3382 0.2816 -0.4219 -0.8618 0.1980 0.9044 -0.3780 61.835 61.496 -2.220 A 147 GLU A 220 GLU~? A 156 GLU A 227 GLU~? A 194 ASN A 102 ASN.? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.32 A TRANSFORM -0.8362 -0.5393 0.0993 0.3619 -0.4068 0.8388 -0.4119 0.7374 0.5354 -24.441 15.987 21.686 D 603 HIS A 158 HIS.? D 646 ASP A 163 ASP~? D 739 GLY A 284 GLY~? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.32 A TRANSFORM -0.1500 0.9282 0.3404 -0.5358 0.2130 -0.8170 -0.8309 -0.3050 0.4654 -5.024 45.041 3.407 B 66 HIS A 143 HIS~? B 110 GLY A 149 GLY~? B 140 TYR A 167 TYR~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 7 3 RMSD = 1.33 A TRANSFORM -0.1164 0.5436 0.8312 -0.8646 -0.4673 0.1845 0.4887 -0.6972 0.5244 -3.846 38.094 16.785 B 1 SER A 240 SER.? B 69 ALA A 193 ALA^? B 241 ASN A 194 ASN.? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 2 3 RMSD = 1.34 A TRANSFORM 0.2822 -0.9272 0.2461 0.4836 -0.0841 -0.8712 0.8285 0.3649 0.4247 24.178 41.284 -35.311 B 60 HIS A 158 HIS.? B 84 ASP A 163 ASP~? B 140 GLY A 98 GLY.? ULMNm 3 1emh_d00 HYDROLASE/DNA user 2 3 RMSD = 1.34 A TRANSFORM -0.9908 -0.0854 0.1048 -0.1340 0.7211 -0.6797 -0.0175 -0.6876 -0.7259 28.606 17.163 21.741 A 271 PRO A 246 PRO^? A 272 LEU A 250 LEU~? A 276 ARG A 327 ARG~? ULMNm 3 2odj_o00 PORIN D user 11 3 RMSD = 1.35 A TRANSFORM -0.5573 0.4116 -0.7211 0.8118 0.4527 -0.3689 0.1746 -0.7910 -0.5864 33.327 7.800 38.749 A 156 HIS A 291 HIS^? A 208 ASP A 316 ASP^? A 296 SER A 252 SER~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 8 3 RMSD = 1.36 A TRANSFORM 0.8174 -0.2927 0.4962 -0.1148 -0.9268 -0.3576 0.5646 0.2353 -0.7912 -3.088 58.781 106.604 A 270 ASN A 257 ASN~? A 384 ASN A 165 ASN~? A 385 GLU A 271 GLU^? ULMNm 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 7 3 RMSD = 1.36 A TRANSFORM -0.9419 -0.3347 -0.0290 -0.3029 0.8088 0.5040 -0.1452 0.4835 -0.8632 36.557 25.290 49.108 146 TYR A 203 TYR~? 150 LYS A 206 LYS.? 186 ASN A 155 ASN.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.37 A TRANSFORM -0.7005 0.5117 -0.4974 0.7134 0.5212 -0.4685 0.0195 -0.6830 -0.7301 64.757 0.047 29.713 A 37 ASP A 106 ASP.? A 56 ILE A 154 ILE.? A 82 TYR A 203 TYR~? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.37 A TRANSFORM -0.2743 -0.3641 0.8900 0.5976 0.6606 0.4544 -0.7534 0.6565 0.0364 -16.298 -2.553 12.291 C 66 HIS A 143 HIS~? C 110 GLY A 149 GLY~? C 140 TYR A 167 TYR~? ULMNm 3 2odj_o01 PORIN D user 10 3 RMSD = 1.38 A TRANSFORM -0.2320 0.7868 0.5719 -0.7206 -0.5339 0.4422 0.6533 -0.3095 0.6909 -15.048 -0.428 53.715 B 156 HIS A 291 HIS^? B 208 ASP A 316 ASP^? B 296 SER A 252 SER~? ULMNm 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 RMSD = 1.38 A TRANSFORM 0.6161 0.6192 0.4869 0.7824 -0.4094 -0.4693 -0.0913 0.6700 -0.7367 -17.247 22.007 79.507 32 ASP A 117 ASP~? 35 SER A 96 SER.? 215 ASP A 119 ASP~? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 RMSD = 1.38 A TRANSFORM 0.4410 -0.6748 0.5917 -0.2627 -0.7275 -0.6339 0.8582 0.1241 -0.4981 2.161 52.700 36.130 E 57 HIS A 158 HIS.? E 102 ASP A 163 ASP~? E 193 GLY A 98 GLY.? ULMNm 3 1b01_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.38 A TRANSFORM -0.5268 -0.8346 0.1610 0.5822 -0.2163 0.7838 -0.6193 0.5067 0.5998 50.860 -2.691 81.162 B 4 ARG A 156 ARG.? B 6 THR A 120 THR~? B 8 THR A 124 THR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 RMSD = 1.40 A TRANSFORM -0.6793 0.7314 -0.0597 -0.7316 -0.6686 0.1335 0.0577 0.1343 0.9893 57.345 12.259 -27.685 A 37 ASP A 119 ASP~? A 56 ILE A 93 ILE.? A 82 TYR A 92 TYR.? ULMNm 3 1a0j_c13 TRYPSIN user 2 3 RMSD = 1.40 A TRANSFORM 0.8051 0.3792 -0.4560 -0.5596 0.7403 -0.3725 0.1964 0.5551 0.8083 50.291 48.206 24.503 B 57 HIS A 158 HIS.? B 102 ASP A 163 ASP~? B 193 GLY A 98 GLY.? ULMNm 3 1iph_c00 CATALASE HPII user 1 3 RMSD = 1.41 A TRANSFORM 0.5013 -0.5880 0.6348 0.8048 0.5863 -0.0924 -0.3178 0.5572 0.7672 -2.662 -4.474 29.718 A 128 HIS A 259 HIS~? A 167 SER A 262 SER~? A 201 ASN A 257 ASN~? ULMNm 3 1iph_c03 CATALASE HPII user 1 3 RMSD = 1.41 A TRANSFORM 0.5013 -0.5880 0.6348 -0.8048 -0.5863 0.0924 0.3178 -0.5572 -0.7672 -2.662 4.474 -29.718 D 128 HIS A 259 HIS~? D 167 SER A 262 SER~? D 201 ASN A 257 ASN~? ULMNm 3 1iph_c02 CATALASE HPII user 1 3 RMSD = 1.41 A TRANSFORM -0.5013 0.5880 -0.6348 0.8048 0.5863 -0.0924 0.3178 -0.5572 -0.7672 2.662 -4.474 -29.718 C 128 HIS A 259 HIS~? C 167 SER A 262 SER~? C 201 ASN A 257 ASN~? ULMNm 3 1iph_c01 CATALASE HPII user 1 3 RMSD = 1.41 A TRANSFORM -0.5013 0.5880 -0.6348 -0.8048 -0.5863 0.0924 -0.3178 0.5572 0.7672 2.662 4.474 29.718 B 128 HIS A 259 HIS~? B 167 SER A 262 SER~? B 201 ASN A 257 ASN~? ULMNm 3 1myr_c00 MYROSINASE user 1 3 RMSD = 1.41 A TRANSFORM -0.4344 0.8449 -0.3123 -0.1923 0.2518 0.9485 0.8800 0.4720 0.0531 50.410 104.256 45.143 187 GLN A 338 GLN^? 328 ASN A 336 ASN^? 409 GLU A 271 GLU^? ULMNm 3 1qrz_c21 PLASMINOGEN user 4 3 RMSD = 1.41 A TRANSFORM 0.7975 -0.5910 -0.1210 -0.0789 0.0966 -0.9922 0.5981 0.8009 0.0304 -40.379 28.973 -16.570 B 603 HIS A 158 HIS.? B 646 ASP A 163 ASP~? B 739 GLY A 284 GLY~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.41 A TRANSFORM 0.2253 0.3712 0.9008 -0.0557 -0.9182 0.3922 0.9727 -0.1385 -0.1862 -4.072 27.422 34.091 A 156 HIS A 143 HIS~? A 208 ASP A 163 ASP~? A 296 SER A 81 SER~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 5 3 RMSD = 1.42 A TRANSFORM -0.5239 -0.4029 0.7504 0.7083 -0.6955 0.1210 0.4732 0.5949 0.6498 -31.848 36.493 54.149 B 34 SER A 161 SER.? B 37 ASN A 165 ASN~? B 45 THR A 120 THR~? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 RMSD = 1.42 A TRANSFORM -0.8848 0.3803 0.2693 -0.0225 -0.6121 0.7905 0.4654 0.6934 0.5501 2.467 7.384 -54.047 A 49 ASP A 117 ASP~? A 147 THR A 120 THR~? A 294 ASP A 106 ASP.? ULMNm 3 1a0j_c15 TRYPSIN user 2 3 RMSD = 1.43 A TRANSFORM 0.0915 -0.8240 -0.5591 -0.1952 0.5357 -0.8215 0.9765 0.1844 -0.1118 32.332 31.278 94.663 D 57 HIS A 158 HIS.? D 102 ASP A 163 ASP~? D 193 GLY A 98 GLY.? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 RMSD = 1.43 A TRANSFORM -0.6756 0.7349 -0.0594 -0.7364 -0.6686 0.1039 0.0367 0.1139 0.9928 60.122 -3.458 -54.858 B 37 ASP A 119 ASP~? B 56 ILE A 93 ILE.? B 82 TYR A 92 TYR.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 1 3 RMSD = 1.43 A TRANSFORM 0.2465 0.9553 -0.1631 -0.7706 0.0911 -0.6308 -0.5878 0.2812 0.7586 17.104 9.181 -14.386 B 56 GLU A 99 GLU.? B 67 ARG A 145 ARG~? B 86 HIS A 158 HIS.? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 RMSD = 1.44 A TRANSFORM 0.1357 0.5040 -0.8530 -0.4829 -0.7181 -0.5011 -0.8651 0.4800 0.1459 23.390 38.253 14.942 A 10 ASP A 176 ASP^? A 186 ASN A 336 ASN^? A 260 ALA A 268 ALA.? ULMNm 3 3hde_o00 LYSOZYME user 1 3 RMSD = 1.44 A TRANSFORM 0.1385 0.6371 0.7583 0.1334 0.7467 -0.6517 -0.9813 0.1914 0.0185 -44.494 -9.622 -23.150 A 35 GLU A 222 GLU~? A 44 ASP A 209 ASP~? A 50 THR A 207 THR~? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 RMSD = 1.45 A TRANSFORM -0.3119 0.6759 -0.6678 0.6775 0.6510 0.3424 0.6661 -0.3456 -0.6610 -6.920 61.655 113.203 D 137 ARG A 112 ARG.? D 141 THR A 90 THR.? D 235 ASP A 106 ASP.? ULMNm 3 1a0j_c14 TRYPSIN user 2 3 RMSD = 1.45 A TRANSFORM -0.9344 0.3276 -0.1399 0.3553 0.8853 -0.3000 0.0256 -0.3300 -0.9436 36.214 38.460 102.152 C 57 HIS A 158 HIS.? C 102 ASP A 163 ASP~? C 193 GLY A 98 GLY.? ULMNm 3 1a0j_c12 TRYPSIN user 2 3 RMSD = 1.46 A TRANSFORM -0.1038 -0.0869 0.9908 0.0412 -0.9957 -0.0830 0.9937 0.0322 0.1070 0.316 54.715 56.451 A 57 HIS A 158 HIS.? A 102 ASP A 163 ASP~? A 193 GLY A 98 GLY.? ULMNm 3 1mjo_d00 TRANSCRIPTION/DNA user 2 3 RMSD = 1.46 A TRANSFORM 0.1652 0.9384 0.3034 0.3688 -0.3441 0.8635 0.9147 -0.0308 -0.4030 83.809 6.030 35.717 D 23 LYS A 333 LYS.? D 25 THR A 248 THR~? D 27 SER A 252 SER~? ULMNm 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 RMSD = 1.46 A TRANSFORM 0.7748 -0.1492 -0.6143 0.6322 0.1769 0.7544 -0.0039 -0.9729 0.2314 51.153 -5.921 18.902 A 32 ASP A 117 ASP~? A 35 SER A 96 SER.? A 218 ASP A 119 ASP~? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 RMSD = 1.47 A TRANSFORM -0.4565 -0.1294 -0.8803 0.8585 -0.3240 -0.3975 -0.2338 -0.9372 0.2590 40.983 41.765 23.751 A 57 HIS A 158 HIS.? A 102 ASP A 163 ASP~? A 193 GLY A 98 GLY.? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 9 3 RMSD = 1.47 A TRANSFORM 0.2645 -0.8635 0.4295 0.7476 0.4649 0.4743 -0.6092 0.1956 0.7685 -41.415 24.528 79.087 B 34 SER A 252 SER~? B 37 ASN A 257 ASN~? B 45 THR A 178 THR~? ULMNm 3 2dbt_c02 CHITINASE C user 3 3 RMSD = 1.47 A TRANSFORM -0.7728 0.4051 -0.4886 -0.1491 0.6324 0.7602 0.6169 0.6603 -0.4283 49.774 -18.358 10.978 C 147 GLU A 220 GLU~? C 156 GLU A 227 GLU~? C 194 ASN A 102 ASN.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.47 A TRANSFORM 0.3003 0.1575 0.9407 -0.9527 0.0016 0.3039 0.0464 -0.9875 0.1506 -15.470 9.342 8.926 141 ASP A 119 ASP~? 166 GLY A 172 GLY.? 169 GLU A 343 GLU.? ULMNm 3 1sme_c04 PLASMEPSIN II user 1 3 RMSD = 1.48 A TRANSFORM 0.3173 0.0475 0.9471 -0.4710 0.8747 0.1140 -0.8231 -0.4823 0.2999 26.014 51.123 32.572 A 34 ASP A 117 ASP~? A 37 SER A 96 SER.? A 214 ASP A 119 ASP~? ULMNm 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 RMSD = 1.48 A TRANSFORM 0.3513 0.9362 0.0044 -0.4550 0.1749 -0.8731 -0.8182 0.3047 0.4875 6.350 35.755 13.888 E 33 ASP A 117 ASP~? E 36 SER A 96 SER.? E 213 ASP A 119 ASP~? ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.48 A TRANSFORM -0.9311 0.0836 -0.3552 -0.1975 -0.9339 0.2979 -0.3068 0.3475 0.8861 22.371 10.550 -16.397 A 66 HIS A 143 HIS~? A 110 GLY A 149 GLY~? A 140 TYR A 167 TYR~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 3 3 RMSD = 1.49 A TRANSFORM -0.3856 -0.8997 0.2047 0.1434 0.1608 0.9765 -0.9114 0.4059 0.0670 22.995 -7.119 13.743 A 271 PRO A 342 PRO.? A 272 LEU A 130 LEU~? A 276 ARG A 79 ARG~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 7 3 RMSD = 1.49 A TRANSFORM -0.5349 0.6251 -0.5684 -0.6344 0.1472 0.7589 0.5580 0.7666 0.3178 -1.574 25.765 64.640 B 34 SER A 240 SER.? B 37 ASN A 194 ASN.? B 45 THR A 331 THR.?