*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1sme_c00 PLASMEPSIN II user 1 4 RMSD = 1.11 A TRANSFORM -0.8925 -0.2093 -0.3996 -0.0933 0.9523 -0.2905 0.4413 -0.2219 -0.8695 105.420 27.677 84.002 A 34 ASP A 327 ASP~? A 37 SER A 324 SER~? A 214 ASP A 7 ASP.? A 217 THR A 238 THR.? ULMNm 4 1apt_c02 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 4 RMSD = 1.12 A TRANSFORM -0.5372 0.7681 0.3484 0.8434 0.4825 0.2366 0.0137 0.4209 -0.9070 -32.289 -44.278 54.856 E 33 ASP A 327 ASP~? E 36 SER A 324 SER~? E 213 ASP A 7 ASP.? E 216 THR A 238 THR.? ULMNm 4 1eag_c02 PEPTIDE INHIBITOR user 1 4 RMSD = 1.16 A TRANSFORM 0.0552 -0.2491 0.9669 -0.9861 -0.1654 0.0136 0.1566 -0.9542 -0.2548 -5.716 46.931 77.605 A 32 ASP A 327 ASP~? A 35 SER A 324 SER~? A 218 ASP A 7 ASP.? A 221 THR A 238 THR.? ULMNm 4 2jxr_c02 LIGAND CP-081282 user 1 4 RMSD = 1.19 A TRANSFORM 0.9002 0.2873 0.3273 0.1049 0.5864 -0.8032 -0.4227 0.7573 0.4978 -67.547 81.698 -26.055 A 32 ASP A 327 ASP~? A 35 SER A 324 SER~? A 215 ASP A 7 ASP.? A 218 THR A 238 THR.? ULMNm 4 1rne_c02 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 RMSD = 1.43 A TRANSFORM -0.9066 0.3734 0.1964 0.1475 -0.1557 0.9767 0.3953 0.9145 0.0861 -8.006 -43.745 7.719 32 ASP A 327 ASP~? 35 SER A 324 SER~? 215 ASP A 7 ASP.? 218 ALA A 237 ALA^? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 0.65 A TRANSFORM -0.2627 0.3641 -0.8935 -0.9493 -0.2631 0.1719 -0.1725 0.8934 0.4148 32.210 90.847 -29.075 C 137 ARG A 240 ARG.? C 141 THR A 243 THR~? C 235 ASP A 327 ASP~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 RMSD = 0.70 A TRANSFORM 0.2630 -0.3785 0.8875 0.9479 0.2726 -0.1646 -0.1796 0.8846 0.4304 -31.080 69.429 -29.524 A 137 ARG A 240 ARG.? A 141 THR A 243 THR~? A 235 ASP A 327 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 0.84 A TRANSFORM -0.2749 0.9584 -0.0770 -0.5874 -0.1040 0.8026 0.7612 0.2658 0.5915 2.854 18.537 -45.962 199 ASP A 20 ASP~? 242 GLU A 192 GLU~? 329 ASP A 63 ASP~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 18 3 RMSD = 0.86 A TRANSFORM -0.9778 -0.0787 0.1941 0.1696 -0.8415 0.5129 0.1229 0.5344 0.8362 32.133 28.674 -102.661 A 465 GLY A 253 GLY.? A 501 ASP A 20 ASP~? B 367 TYR A 295 TYR~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 19 3 RMSD = 0.88 A TRANSFORM -0.7388 0.6295 -0.2408 0.6515 0.5755 -0.4944 -0.1727 -0.5221 -0.8352 32.963 38.876 37.726 D 465 GLY A 253 GLY.? D 501 ASP A 20 ASP~? E 367 TYR A 295 TYR~? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 0.91 A TRANSFORM -0.4438 0.1733 -0.8792 0.8848 -0.0709 -0.4606 -0.1421 -0.9823 -0.1219 41.558 103.258 160.926 D 137 ARG A 240 ARG.? D 141 THR A 243 THR~? D 235 ASP A 323 ASP.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 0.92 A TRANSFORM 0.5771 0.1024 -0.8102 -0.2327 -0.9303 -0.2834 -0.7828 0.3521 -0.5131 42.917 52.411 171.580 C 70 ALA A 266 ALA~? C 126 LEU A 270 LEU~? C 158 GLU A 273 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 21 3 RMSD = 0.92 A TRANSFORM 0.3447 -0.6467 0.6804 0.8967 0.0126 -0.4424 0.2775 0.7626 0.5843 -23.720 22.903 -92.388 141 ASP A 317 ASP.? 166 GLY A 340 GLY^? 169 GLU A 353 GLU~? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.94 A TRANSFORM -0.6256 -0.7389 -0.2502 0.7420 -0.4646 -0.4833 0.2408 -0.4880 0.8389 82.064 32.086 -1.091 B 99 ARG A 17 ARG~? B 101 ASP A 20 ASP~? B 132 ASP A 49 ASP~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 0.94 A TRANSFORM -0.5060 -0.8498 0.1477 -0.4368 0.4001 0.8057 -0.7438 0.3432 -0.5736 -1.429 -55.846 176.236 B 70 ALA A 266 ALA~? B 126 LEU A 270 LEU~? B 158 GLU A 273 GLU~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.94 A TRANSFORM -0.6107 -0.7559 -0.2357 0.7513 -0.4593 -0.4739 0.2500 -0.4665 0.8485 82.007 31.316 -3.033 B 99 ARG A 17 ARG~? B 101 ASP A 20 ASP~? B 132 ASP A 49 ASP~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.94 A TRANSFORM 0.6190 0.7402 0.2626 -0.7228 0.4062 0.5590 0.3071 -0.5359 0.7865 -59.531 -7.096 1.283 A 99 ARG A 17 ARG~? A 101 ASP A 20 ASP~? A 132 ASP A 49 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.94 A TRANSFORM 0.6093 0.7491 0.2602 -0.7219 0.3881 0.5729 0.3282 -0.5369 0.7772 -59.532 -6.656 1.038 A 99 ARG A 17 ARG~? A 101 ASP A 20 ASP~? A 132 ASP A 49 ASP~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 0.95 A TRANSFORM -0.1565 0.7826 0.6025 0.5923 0.5625 -0.5768 -0.7903 0.2666 -0.5516 -72.611 37.109 176.594 A 70 ALA A 266 ALA~? A 126 LEU A 270 LEU~? A 158 GLU A 273 GLU~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.04 A TRANSFORM -0.3585 -0.7212 0.5928 0.8802 -0.4726 -0.0427 0.3110 0.5065 0.8042 -2.639 71.248 41.289 A 1 ALA A 264 ALA^? A 74 ASN A 297 ASN.? A 75 GLY A 296 GLY~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 13 3 RMSD = 1.04 A TRANSFORM 0.6383 0.6524 -0.4086 0.7697 -0.5492 0.3255 -0.0120 -0.5222 -0.8527 -35.477 4.496 64.545 141 ASP A 51 ASP~? 166 GLY A 187 GLY~? 169 GLU A 195 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 16 3 RMSD = 1.05 A TRANSFORM 0.6979 -0.7154 -0.0326 -0.7079 -0.6823 -0.1822 0.1081 0.1503 -0.9827 22.785 84.581 61.349 141 ASP A 226 ASP~? 166 GLY A 340 GLY^? 169 GLU A 355 GLU~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.05 A TRANSFORM -0.1709 -0.9078 0.3829 -0.9762 0.1034 -0.1906 0.1334 -0.4064 -0.9039 81.088 -75.614 -47.971 A 420 ALA A 351 ALA~? B 182 GLY A 344 GLY.? B 183 GLY A 347 GLY~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 21 3 RMSD = 1.06 A TRANSFORM 0.9582 0.0943 -0.2701 -0.1058 -0.7604 -0.6408 -0.2658 0.6426 -0.7186 8.859 106.332 -7.441 A 465 GLY A 283 GLY.? A 501 ASP A 360 ASP.? B 367 TYR A 207 TYR.? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 6 3 RMSD = 1.06 A TRANSFORM 0.0299 0.8629 0.5044 -0.4476 -0.4397 0.7787 0.8937 -0.2491 0.3732 -83.571 -5.654 -25.468 A 16 TYR A 361 TYR^? A 40 ASP A 316 ASP.? A 103 LEU A 376 LEU.? ULMNm 3 1sme_c04 PLASMEPSIN II user 4 3 RMSD = 1.08 A TRANSFORM -0.8897 -0.3624 -0.2778 -0.1985 0.8547 -0.4796 0.4112 -0.3716 -0.8324 106.222 47.708 90.854 A 34 ASP A 327 ASP~? A 37 SER A 324 SER~? A 214 ASP A 7 ASP.? ULMNm 3 2odj_o01 PORIN D user 2 3 RMSD = 1.08 A TRANSFORM 0.9590 0.2597 -0.1131 0.2424 -0.9590 -0.1468 -0.1466 0.1134 -0.9827 -25.936 56.080 104.606 B 156 HIS A 88 HIS~? B 208 ASP A 138 ASP~? B 296 SER A 162 SER.? ULMNm 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 5 3 RMSD = 1.09 A TRANSFORM -0.5788 0.7785 0.2426 0.8132 0.5730 0.1018 -0.0598 0.2562 -0.9648 -25.281 -40.129 69.611 E 33 ASP A 327 ASP~? E 36 SER A 324 SER~? E 213 ASP A 7 ASP.? ULMNm 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 4 3 RMSD = 1.09 A TRANSFORM -0.9458 0.2608 0.1937 0.0872 -0.3704 0.9248 0.3129 0.8915 0.3276 -0.605 -26.653 -5.692 32 ASP A 327 ASP~? 35 SER A 324 SER~? 215 ASP A 7 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 22 3 RMSD = 1.09 A TRANSFORM 0.1316 -0.9033 0.4083 -0.0248 -0.4147 -0.9096 0.9910 0.1096 -0.0770 16.407 104.477 -20.015 141 ASP A 317 ASP.? 166 GLY A 340 GLY^? 169 GLU A 355 GLU~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 22 3 RMSD = 1.09 A TRANSFORM 0.6705 0.6795 0.2979 -0.6725 0.3871 0.6308 0.3133 -0.6233 0.7165 -37.844 5.808 -59.912 D 465 GLY A 283 GLY.? D 501 ASP A 360 ASP.? E 367 TYR A 207 TYR.? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.09 A TRANSFORM -0.5901 0.7984 -0.1196 -0.7341 -0.4691 0.4909 0.3358 0.3775 0.8630 -1.215 16.318 -43.445 C 1 ALA A 264 ALA^? C 74 ASN A 297 ASN.? C 75 GLY A 296 GLY~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.10 A TRANSFORM 0.1411 0.0406 0.9892 -0.2999 0.9539 0.0036 -0.9435 -0.2972 0.1468 -25.953 -40.326 49.394 A 156 HIS A 88 HIS~? A 208 ASP A 138 ASP~? A 296 SER A 162 SER.? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 RMSD = 1.10 A TRANSFORM -0.1488 0.8825 0.4462 0.4411 0.4631 -0.7688 -0.8851 0.0824 -0.4581 -73.541 39.873 90.553 B 16 TYR A 361 TYR^? B 40 ASP A 316 ASP.? B 103 LEU A 376 LEU.? ULMNm 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.10 A TRANSFORM 0.2098 0.7753 -0.5958 -0.9126 0.3740 0.1654 0.3511 0.5090 0.7859 26.518 -16.564 -74.926 A 21 GLN A 309 GLN.? A 41 TYR A 305 TYR~? A 43 ASN A 307 ASN~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.11 A TRANSFORM -0.5343 0.1915 -0.8233 0.6827 0.6721 -0.2868 0.4984 -0.7153 -0.4898 31.205 -35.487 196.157 C 70 ALA A 172 ALA~? C 126 LEU A 176 LEU~? C 158 GLU A 179 GLU~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 RMSD = 1.11 A TRANSFORM 0.3411 -0.1560 0.9270 0.9400 0.0538 -0.3368 0.0026 0.9863 0.1650 -45.264 89.158 -23.857 A 137 ARG A 240 ARG.? A 141 THR A 243 THR~? A 235 ASP A 323 ASP.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.11 A TRANSFORM 0.4439 -0.5376 0.7169 0.4994 0.8127 0.3001 -0.7440 0.2248 0.6293 7.772 -50.005 -11.306 B 1 ALA A 264 ALA^? B 74 ASN A 297 ASN.? B 75 GLY A 296 GLY~? ULMNm 3 1euu_c00 SIALIDASE user 6 3 RMSD = 1.11 A TRANSFORM 0.7979 0.1354 -0.5874 -0.0106 0.9775 0.2109 0.6028 -0.1620 0.7813 35.848 -64.781 -30.209 92 ASP A 300 ASP~? 260 GLU A 303 GLU~? 370 TYR A 276 TYR~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 9 3 RMSD = 1.12 A TRANSFORM -0.2224 -0.6543 0.7228 -0.3802 -0.6245 -0.6822 0.8978 -0.4265 -0.1099 22.881 108.659 17.824 A 229 ALA A 293 ALA~? A 257 ALA A 292 ALA~? A 328 ASP A 268 ASP~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.13 A TRANSFORM 0.8682 0.4724 0.1517 0.1563 -0.5507 0.8200 0.4709 -0.6882 -0.5519 -71.252 -0.149 198.468 B 70 ALA A 172 ALA~? B 126 LEU A 176 LEU~? B 158 GLU A 179 GLU~? ULMNm 3 1eag_c04 PEPTIDE INHIBITOR user 4 3 RMSD = 1.13 A TRANSFORM 0.1216 -0.0460 0.9915 -0.9624 -0.2499 0.1064 0.2429 -0.9672 -0.0747 -20.390 45.281 64.968 A 32 ASP A 327 ASP~? A 35 SER A 324 SER~? A 218 ASP A 7 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 8 3 RMSD = 1.13 A TRANSFORM -0.9231 -0.0128 -0.3843 -0.3486 0.4496 0.8224 0.1622 0.8932 -0.4195 77.089 3.706 18.035 A 228 ASP A 261 ASP~? A 261 ASP A 327 ASP~? A 329 ASP A 268 ASP~? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 RMSD = 1.13 A TRANSFORM -0.3363 0.3833 -0.8602 0.9415 0.1558 -0.2987 0.0196 -0.9104 -0.4133 28.457 82.655 169.833 D 137 ARG A 240 ARG.? D 141 THR A 243 THR~? D 235 ASP A 327 ASP~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 RMSD = 1.14 A TRANSFORM -0.2776 -0.7391 0.6137 -0.7881 -0.1902 -0.5855 0.5495 -0.6462 -0.5297 11.243 71.438 192.748 A 70 ALA A 172 ALA~? A 126 LEU A 176 LEU~? A 158 GLU A 179 GLU~? ULMNm 3 2jxr_c04 LIGAND CP-081282 user 4 3 RMSD = 1.14 A TRANSFORM 0.9079 0.3692 0.1984 0.0163 0.4419 -0.8969 -0.4188 0.8176 0.3952 -63.949 97.914 -23.022 A 32 ASP A 327 ASP~? A 35 SER A 324 SER~? A 215 ASP A 7 ASP.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 12 3 RMSD = 1.14 A TRANSFORM 0.4393 0.8983 -0.0015 0.0227 -0.0128 -0.9997 -0.8981 0.4391 -0.0261 -29.296 103.047 -39.972 D 465 GLY A 187 GLY~? D 501 ASP A 54 ASP~? E 367 TYR A 257 TYR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 12 3 RMSD = 1.15 A TRANSFORM 0.2144 0.5934 0.7758 -0.3398 -0.6993 0.6288 0.9157 -0.3985 0.0517 -60.508 38.307 -29.471 A 465 GLY A 187 GLY~? A 501 ASP A 54 ASP~? B 367 TYR A 257 TYR~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.15 A TRANSFORM 0.1835 0.9830 -0.0019 -0.6805 0.1256 -0.7219 -0.7094 0.1337 0.6920 -60.284 96.200 76.978 D 1 ALA A 264 ALA^? D 74 ASN A 297 ASN.? D 75 GLY A 296 GLY~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 RMSD = 1.15 A TRANSFORM -0.1204 0.9642 -0.2364 0.4357 0.2653 0.8601 0.8920 0.0006 -0.4521 9.482 -74.073 34.582 A 67 ASP A 327 ASP~? A 68 ALA A 326 ALA~? A 72 LEU A 325 LEU~? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.15 A TRANSFORM -0.7196 -0.6314 0.2890 0.5551 -0.2730 0.7857 -0.4172 0.7258 0.5470 -6.136 -58.694 -83.898 B 603 HIS A 379 HIS.? B 646 ASP A 374 ASP~? B 739 GLY A 340 GLY^? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 RMSD = 1.16 A TRANSFORM -0.9929 -0.1183 -0.0099 0.0276 -0.3112 0.9499 -0.1155 0.9430 0.3123 39.646 42.435 -36.618 179 ASP A 49 ASP~? 214 ASP A 138 ASP~? 289 ASP A 20 ASP~? ULMNm 3 1qrz_c22 PLASMINOGEN user 2 3 RMSD = 1.16 A TRANSFORM 0.1866 -0.8955 -0.4040 -0.5152 0.2610 -0.8164 0.8365 0.3604 -0.4127 88.732 54.414 -9.108 C 603 HIS A 379 HIS.? C 646 ASP A 374 ASP~? C 739 GLY A 340 GLY^? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.19 A TRANSFORM 0.4871 0.5021 -0.7145 -0.8512 0.0899 -0.5171 -0.1954 0.8601 0.4712 39.754 90.786 -32.630 A 316 ALA A 230 ALA~? A 317 GLY A 229 GLY~? A 318 ASP A 226 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 RMSD = 1.19 A TRANSFORM 0.2976 -0.9325 0.2045 0.6597 0.0460 -0.7501 0.6901 0.3581 0.6289 97.853 53.286 -52.043 199 ASP A 63 ASP~? 218 GLU A 273 GLU~? 329 ASP A 20 ASP~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 3 3 RMSD = 1.19 A TRANSFORM -0.2452 -0.0267 0.9691 0.5142 0.8438 0.1533 -0.8219 0.5359 -0.1932 -83.845 -19.849 19.541 A1132 ASP A 268 ASP~? A1134 ALA A 292 ALA~? A1137 ASN A 297 ASN.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.19 A TRANSFORM -0.6639 0.7428 -0.0864 0.5949 0.5946 0.5409 0.4532 0.3077 -0.8366 25.260 -39.791 23.946 199 ASP A 20 ASP~? 242 GLU A 250 GLU~? 329 ASP A 63 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 7 3 RMSD = 1.21 A TRANSFORM -0.9607 0.1278 -0.2465 -0.1048 0.6552 0.7482 0.2571 0.7446 -0.6160 63.076 -3.896 35.644 A 228 ASP A 261 ASP~? A 261 ASP A 7 ASP.? A 329 ASP A 268 ASP~? ULMNm 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 3 3 RMSD = 1.22 A TRANSFORM 0.1153 0.5251 -0.8432 -0.8993 0.4157 0.1359 0.4219 0.7426 0.5202 36.029 24.867 -62.054 A 50 ASP A 327 ASP~? A 55 TYR A 290 TYR~? A 84 LYS A 284 LYS.? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 4 3 RMSD = 1.22 A TRANSFORM 0.2375 0.9700 -0.0523 0.6556 -0.1997 -0.7282 -0.7168 0.1386 -0.6834 -19.483 141.967 62.722 A 459 ASN A 298 ASN~? A 460 GLY A 296 GLY~? A 461 ASN A 297 ASN.? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.23 A TRANSFORM -0.5816 0.1747 0.7945 -0.2425 -0.9695 0.0356 0.7765 -0.1720 0.6062 9.351 104.903 -25.372 A 55 ASP A 7 ASP.? A 58 ASP A 323 ASP.? A 424 GLU A 15 GLU~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 13 3 RMSD = 1.23 A TRANSFORM -0.6092 -0.3368 0.7179 -0.7840 0.1196 -0.6092 0.1193 -0.9339 -0.3369 21.946 136.505 100.101 229 ASP A 261 ASP~? 264 GLU A 303 GLU~? 328 ASP A 268 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 1.24 A TRANSFORM -0.7528 -0.6067 0.2554 0.4957 -0.2671 0.8264 -0.4332 0.7487 0.5018 23.535 -60.448 -43.085 A 603 HIS A 379 HIS.? A 646 ASP A 374 ASP~? A 739 GLY A 340 GLY^? ULMNm 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.24 A TRANSFORM 0.2232 -0.1686 0.9601 -0.9513 0.1769 0.2522 -0.2124 -0.9697 -0.1209 -42.256 66.350 161.547 B 137 ARG A 240 ARG.? B 141 THR A 243 THR~? B 235 ASP A 323 ASP.? ULMNm 3 1bvz_c09 ALPHA-AMYLASE II user 3 3 RMSD = 1.25 A TRANSFORM 0.8295 0.5222 0.1978 0.1800 -0.5853 0.7906 0.5286 -0.6202 -0.5795 -34.901 1.603 103.852 B 325 ASP A 20 ASP~? B 354 GLU A 16 GLU~? B 421 ASP A 63 ASP~? ULMNm 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 9 3 RMSD = 1.26 A TRANSFORM -0.3248 0.4154 0.8497 0.9458 0.1407 0.2927 0.0021 0.8987 -0.4386 -45.849 7.183 54.012 C 123 HIS A 365 HIS~? C 200 ASP A 9 ASP.? C 229 LYS A 284 LYS.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.26 A TRANSFORM -0.2003 0.8773 0.4362 -0.1943 -0.4720 0.8600 0.9603 0.0875 0.2649 -39.322 -128.854 -171.642 A 420 ALA A 326 ALA~? B 182 GLY A 340 GLY^? B 183 GLY A 322 GLY^? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.26 A TRANSFORM -0.7378 -0.4326 -0.5183 -0.2862 -0.4949 0.8205 -0.6114 0.7536 0.2413 67.066 -28.053 -20.935 A 603 HIS A 380 HIS.? A 646 ASP A 316 ASP.? A 739 GLY A 340 GLY^? ULMNm 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 9 3 RMSD = 1.26 A TRANSFORM -0.1400 -0.5882 0.7965 -0.9512 -0.1436 -0.2732 0.2751 -0.7959 -0.5393 -8.742 135.221 119.067 A 123 HIS A 365 HIS~? A 200 ASP A 9 ASP.? A 229 LYS A 284 LYS.? ULMNm 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 9 3 RMSD = 1.26 A TRANSFORM -0.7326 -0.6191 -0.2829 0.2843 0.0993 -0.9536 0.6185 -0.7790 0.1033 71.344 96.096 77.403 D 123 HIS A 365 HIS~? D 200 ASP A 9 ASP.? D 229 LYS A 284 LYS.? ULMNm 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 1 3 RMSD = 1.26 A TRANSFORM 0.1753 -0.0588 -0.9828 -0.5118 0.8473 -0.1419 0.8410 0.5278 0.1184 74.888 14.871 -30.645 A 50 ASP A 7 ASP.? A 55 TYR A 290 TYR~? A 84 LYS A 284 LYS.? ULMNm 3 1qrz_c23 PLASMINOGEN user 2 3 RMSD = 1.26 A TRANSFORM 0.1486 -0.8868 -0.4376 -0.5482 0.2945 -0.7828 0.8231 0.3562 -0.4423 37.892 50.810 32.158 D 603 HIS A 379 HIS.? D 646 ASP A 374 ASP~? D 739 GLY A 340 GLY^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.27 A TRANSFORM -0.1086 -0.6933 0.7124 -0.8975 -0.2397 -0.3701 0.4274 -0.6796 -0.5963 42.223 -44.224 -58.278 A 420 ALA A 350 ALA~? B 182 GLY A 10 GLY.? B 183 GLY A 344 GLY.? ULMNm 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 9 3 RMSD = 1.27 A TRANSFORM -0.8886 0.3887 -0.2435 -0.3037 -0.1008 0.9474 0.3437 0.9158 0.2076 28.456 48.030 4.115 B 123 HIS A 365 HIS~? B 200 ASP A 9 ASP.? B 229 LYS A 284 LYS.? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 RMSD = 1.27 A TRANSFORM -0.3533 0.1406 -0.9249 -0.9355 -0.0504 0.3497 0.0026 0.9888 0.1493 46.259 70.976 -22.962 C 137 ARG A 240 ARG.? C 141 THR A 243 THR~? C 235 ASP A 323 ASP.? ULMNm 3 2odj_o01 PORIN D user 5 3 RMSD = 1.27 A TRANSFORM 0.7228 0.5910 -0.3582 -0.2762 -0.2280 -0.9337 -0.6334 0.7738 -0.0015 -40.475 77.807 47.008 B 156 HIS A 365 HIS~? B 208 ASP A 374 ASP~? B 296 SER A 330 SER~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 13 3 RMSD = 1.27 A TRANSFORM -0.4288 0.6651 0.6113 -0.5292 -0.7334 0.4267 0.7321 -0.1405 0.6665 -42.062 52.935 -64.079 A 465 GLY A 187 GLY~? A 501 ASP A 54 ASP~? B 367 TYR A 290 TYR~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 13 3 RMSD = 1.28 A TRANSFORM 0.1758 0.9812 0.0801 0.6469 -0.0538 -0.7607 -0.7420 0.1856 -0.6442 -30.669 80.401 -4.798 D 465 GLY A 187 GLY~? D 501 ASP A 54 ASP~? E 367 TYR A 290 TYR~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 6 3 RMSD = 1.29 A TRANSFORM 0.9832 -0.1724 0.0602 0.1534 0.9587 0.2395 -0.0990 -0.2263 0.9690 36.503 -24.730 -0.031 199 ASP A 32 ASP~? 242 GLU A 100 GLU~? 329 ASP A 43 ASP~? ULMNm 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 RMSD = 1.29 A TRANSFORM -0.8122 -0.5240 -0.2564 -0.4086 0.8247 -0.3909 0.4163 -0.2127 -0.8840 94.419 29.179 107.390 A 325 ASP A 20 ASP~? A 354 GLU A 16 GLU~? A 421 ASP A 63 ASP~? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.30 A TRANSFORM -0.0305 0.8001 -0.5991 -0.4792 0.5143 0.7112 0.8772 0.3088 0.3678 106.759 -3.382 -39.706 B 55 ASP A 7 ASP.? B 58 ASP A 323 ASP.? B 424 GLU A 15 GLU~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 11 3 RMSD = 1.30 A TRANSFORM -0.2401 -0.5753 0.7819 0.3165 0.7151 0.6233 -0.9177 0.3971 0.0104 16.630 -67.505 -0.064 A 229 ALA A 331 ALA~? A 257 ALA A 336 ALA.? A 328 ASP A 360 ASP.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.32 A TRANSFORM -0.6849 -0.7063 -0.1792 -0.4423 0.5984 -0.6681 0.5791 -0.3783 -0.7222 110.981 -82.375 -66.968 A 420 ALA A 359 ALA.? B 182 GLY A 322 GLY^? B 183 GLY A 340 GLY^? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 8 3 RMSD = 1.32 A TRANSFORM 0.5162 0.8233 0.2359 -0.8564 0.4936 0.1515 0.0083 -0.2802 0.9599 -46.771 21.170 30.025 A 241 ASP A 268 ASP~? A 265 GLU A 250 GLU~? A 369 ASP A 261 ASP~? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.32 A TRANSFORM 0.9350 -0.1349 -0.3281 -0.0212 0.9020 -0.4312 0.3541 0.4101 0.8405 -29.653 -35.081 -51.559 D 603 HIS A 358 HIS.? D 646 ASP A 360 ASP.? D 739 GLY A 352 GLY~? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.32 A TRANSFORM -0.0928 -0.5825 0.8075 -0.3080 0.7880 0.5331 -0.9469 -0.1992 -0.2525 30.369 -82.344 103.177 A 198 GLY A 10 GLY.? A 228 SER A 324 SER~? A 549 ASP A 327 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.33 A TRANSFORM -0.1636 0.9854 0.0474 -0.9864 -0.1626 -0.0242 -0.0162 -0.0507 0.9986 -15.864 12.780 -72.326 A 250 ALA A 293 ALA~? A 251 GLY A 296 GLY~? A 252 ASP A 261 ASP~? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 1 3 RMSD = 1.33 A TRANSFORM -0.1801 0.6878 0.7032 0.1884 -0.6775 0.7110 0.9654 0.2605 -0.0076 -44.178 91.438 -15.318 313 ASP A 9 ASP.? 315 GLU A 15 GLU~? 390 TYR A 185 TYR~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.33 A TRANSFORM 0.2401 0.6919 0.6809 0.6991 0.3634 -0.6158 -0.6735 0.6239 -0.3965 -128.811 15.652 145.860 B 70 ALA A 326 ALA~? B 126 LEU A 325 LEU~? B 158 GLU A 353 GLU~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 RMSD = 1.33 A TRANSFORM -0.8917 -0.1504 0.4268 -0.3979 -0.1887 -0.8978 0.2156 -0.9704 0.1085 19.085 130.496 77.028 179 ASP A 49 ASP~? 214 ASP A 268 ASP~? 289 ASP A 20 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.34 A TRANSFORM 0.0589 -0.9447 0.3227 0.4444 -0.2647 -0.8558 0.8939 0.1938 0.4042 165.236 82.798 -78.809 A 316 ALA A 230 ALA~? A 317 GLY A 229 GLY~? A 318 ASP A 226 ASP~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 5 3 RMSD = 1.34 A TRANSFORM -0.0831 -0.9569 0.2781 -0.7531 -0.1225 -0.6464 0.6526 -0.2632 -0.7105 116.663 81.547 145.486 B 382 ARG A 200 ARG.? B 451 GLU A 195 GLU~? B 540 GLU A 179 GLU~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.34 A TRANSFORM 0.1851 -0.8012 0.5690 0.9817 0.1768 -0.0704 -0.0442 0.5716 0.8193 31.310 1.643 -75.829 A 465 GLY A 37 GLY.? A 501 ASP A 108 ASP.? B 367 TYR A 209 TYR.? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.34 A TRANSFORM -0.0441 -0.4014 -0.9148 -0.0475 -0.9138 0.4033 -0.9979 0.0613 0.0212 78.839 33.032 41.256 A 603 HIS A 358 HIS.? A 646 ASP A 360 ASP.? A 739 GLY A 352 GLY~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.34 A TRANSFORM 0.4504 0.6569 0.6046 0.8127 -0.0213 -0.5823 -0.3696 0.7536 -0.5435 -81.634 -5.588 -30.677 B 250 ALA A 230 ALA~? B 251 GLY A 229 GLY~? B 252 ASP A 226 ASP~? ULMNm 3 3hde_o00 LYSOZYME user 1 3 RMSD = 1.35 A TRANSFORM -0.4731 0.8031 -0.3621 0.6888 0.5935 0.4164 0.5493 -0.0524 -0.8340 -13.788 -92.912 16.428 A 35 GLU A 15 GLU~? A 44 ASP A 7 ASP.? A 50 THR A 238 THR.? ULMNm 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 RMSD = 1.35 A TRANSFORM 0.7389 0.5848 0.3346 -0.1526 0.6290 -0.7623 -0.6563 0.5123 0.5540 -64.516 69.799 -12.942 B 112 PHE A 6 PHE^? B 210 ASP A 323 ASP.? B 244 LYS A 284 LYS.? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.35 A TRANSFORM -0.8021 0.4849 0.3485 -0.3737 0.0476 -0.9263 -0.4658 -0.8733 0.1430 -20.285 116.362 194.557 B 109 ASP A 63 ASP~? B 182 GLU A 16 GLU~? B 286 ASN A 57 ASN~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.35 A TRANSFORM 0.4565 -0.0026 -0.8897 -0.6129 -0.7258 -0.3123 -0.6450 0.6879 -0.3329 51.549 108.766 134.911 A 70 ALA A 326 ALA~? A 126 LEU A 325 LEU~? A 158 GLU A 353 GLU~? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.35 A TRANSFORM -0.7592 -0.4907 -0.4276 0.6336 -0.7075 -0.3130 -0.1489 -0.5086 0.8480 26.277 86.537 -14.464 B 603 HIS A 88 HIS~? B 646 ASP A 91 ASP~? B 739 GLY A 37 GLY.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 9 3 RMSD = 1.35 A TRANSFORM -0.7699 -0.6177 0.1604 -0.1551 0.4249 0.8919 -0.6190 0.6618 -0.4229 42.963 -93.941 143.530 C 70 ALA A 326 ALA~? C 126 LEU A 325 LEU~? C 158 GLU A 353 GLU~? ULMNm 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.36 A TRANSFORM -0.7512 0.3697 -0.5468 -0.4131 0.3829 0.8263 0.5149 0.8466 -0.1349 40.641 -12.247 47.217 A 109 ASP A 63 ASP~? A 182 GLU A 16 GLU~? A 286 ASN A 57 ASN~? ULMNm 3 1diz_c00 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 RMSD = 1.36 A TRANSFORM -0.2633 0.8856 0.3825 -0.9323 -0.1318 -0.3368 -0.2479 -0.4453 0.8604 -78.492 79.924 114.289 A 222 TYR A 27 TYR~? A 238 ASP A 32 ASP~? A 272 TRP A 44 TRP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.36 A TRANSFORM 0.0969 0.9678 -0.2321 0.0433 0.2289 0.9725 0.9943 -0.1043 -0.0198 -38.500 12.417 -7.465 A 603 HIS A 88 HIS~? A 646 ASP A 91 ASP~? A 739 GLY A 37 GLY.? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.36 A TRANSFORM -0.6249 -0.4320 -0.6503 0.5246 0.3845 -0.7596 0.5782 -0.8158 -0.0137 44.921 52.478 112.191 B 34 SER A 76 SER~? B 37 ASN A 75 ASN.? B 45 THR A 238 THR.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 RMSD = 1.37 A TRANSFORM -0.6503 -0.6141 0.4473 -0.7589 0.4978 -0.4198 0.0351 -0.6124 -0.7897 54.684 55.788 11.384 D 465 GLY A 37 GLY.? D 501 ASP A 108 ASP.? E 367 TYR A 209 TYR.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 14 3 RMSD = 1.37 A TRANSFORM 0.8236 0.1345 -0.5510 -0.4167 -0.5156 -0.7487 -0.3848 0.8462 -0.3686 29.973 180.686 -17.299 193 ASP A 63 ASP~? 231 ASP A 327 ASP~? 294 ASP A 20 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 18 3 RMSD = 1.37 A TRANSFORM -0.3135 -0.7969 0.5164 0.5400 0.2977 0.7872 -0.7811 0.5257 0.3370 14.326 -65.229 -30.106 141 ASP A 268 ASP~? 166 GLY A 10 GLY.? 169 GLU A 16 GLU~? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.37 A TRANSFORM 0.1183 0.9506 -0.2870 0.0034 0.2886 0.9574 0.9930 -0.1142 0.0309 -38.428 8.633 54.766 C 603 HIS A 88 HIS~? C 646 ASP A 91 ASP~? C 739 GLY A 37 GLY.? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 3 3 RMSD = 1.37 A TRANSFORM 0.1349 -0.5914 0.7950 -0.9873 -0.1478 0.0575 0.0835 -0.7927 -0.6038 -17.647 114.051 78.394 A 459 ASN A 297 ASN.? A 460 GLY A 296 GLY~? A 461 ASN A 298 ASN~? ULMNm 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 RMSD = 1.37 A TRANSFORM 0.4501 -0.8025 -0.3918 -0.7831 -0.1438 -0.6051 0.4292 0.5791 -0.6931 92.711 49.459 -9.963 A 94 GLU A 109 GLU.? A 198 CYH A 34 CYH.? A 206 CYH A 125 CYH.? ULMNm 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 RMSD = 1.37 A TRANSFORM 0.4501 -0.8025 -0.3918 -0.7831 -0.1438 -0.6051 0.4292 0.5791 -0.6931 92.711 49.459 -9.963 A 94 GLU A 109 GLU.? A 198 CYH A 34 CYH.? A 206 CYH A 125 CYH.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.38 A TRANSFORM -0.4149 -0.4029 -0.8158 0.6950 0.4383 -0.5699 0.5872 -0.8034 0.0982 93.003 4.893 27.622 141 ASP A 7 ASP.? 166 GLY A 371 GLY~? 169 GLU A 378 GLU.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.38 A TRANSFORM 0.8066 -0.3818 0.4512 -0.1730 -0.8824 -0.4375 0.5652 0.2749 -0.7778 12.386 101.153 36.517 A 229 ALA A 237 ALA^? A 257 ALA A 293 ALA~? A 328 ASP A 268 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 5 3 RMSD = 1.38 A TRANSFORM -0.1232 0.9817 0.1451 -0.9126 -0.0546 -0.4052 -0.3898 -0.1824 0.9027 -29.477 139.058 -15.355 A 228 ASP A 226 ASP~? A 261 ASP A 316 ASP.? A 329 ASP A 374 ASP~? ULMNm 3 1diz_c01 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 RMSD = 1.38 A TRANSFORM 0.2880 -0.8805 -0.3766 -0.9175 -0.1411 -0.3718 0.2742 0.4527 -0.8485 77.423 81.281 117.324 B 222 TYR A 27 TYR~? B 238 ASP A 32 ASP~? B 272 TRP A 44 TRP~? ULMNm 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 RMSD = 1.39 A TRANSFORM 0.3147 -0.9383 -0.1433 0.0331 0.1617 -0.9863 0.9486 0.3057 0.0820 101.829 70.408 -10.732 A 107 ALA A 292 ALA~? A 136 TYR A 302 TYR~? A 140 LYS A 301 LYS~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.39 A TRANSFORM -0.5251 -0.0915 0.8461 -0.6013 -0.6637 -0.4449 0.6023 -0.7424 0.2935 -15.806 75.022 -11.057 A 250 ALA A 230 ALA~? A 251 GLY A 229 GLY~? A 252 ASP A 226 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 6 3 RMSD = 1.39 A TRANSFORM 0.8869 -0.0473 -0.4595 -0.0425 0.9822 -0.1831 0.4600 0.1819 0.8691 27.328 25.205 -18.662 A 228 ASP A 32 ASP~? A 260 ASP A 54 ASP~? A 329 ASP A 43 ASP~? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.39 A TRANSFORM 0.9397 -0.1775 -0.2922 0.0396 0.9054 -0.4226 0.3396 0.3856 0.8579 24.438 -37.102 -89.284 C 603 HIS A 358 HIS.? C 646 ASP A 360 ASP.? C 739 GLY A 352 GLY~? ULMNm 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 RMSD = 1.39 A TRANSFORM 0.6810 0.6548 0.3279 0.1871 -0.5886 0.7865 0.7080 -0.4742 -0.5233 -65.778 20.136 67.503 A 112 PHE A 6 PHE^? A 210 ASP A 323 ASP.? A 244 LYS A 284 LYS.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.40 A TRANSFORM -0.8648 -0.2579 -0.4308 0.0588 -0.9041 0.4232 -0.4986 0.3407 0.7971 92.488 103.423 -13.040 A 228 ASP A 49 ASP~? A 261 ASP A 9 ASP.? A 329 ASP A 20 ASP~? ULMNm 3 1itx_c00 GLYCOSYL HYDROLASE user 1 3 RMSD = 1.40 A TRANSFORM -0.9707 -0.1852 -0.1529 0.1433 -0.9575 0.2501 -0.1928 0.2209 0.9561 45.847 42.003 -34.475 A 202 ASP A 9 ASP.? A 204 GLU A 15 GLU~? A 279 TYR A 185 TYR~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 12 3 RMSD = 1.40 A TRANSFORM 0.3750 0.9200 -0.1137 -0.2883 0.2322 0.9290 0.8811 -0.3156 0.3523 -54.263 -32.306 -19.019 141 ASP A 51 ASP~? 166 GLY A 187 GLY~? 169 GLU A 192 GLU~? ULMNm 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.41 A TRANSFORM -0.2175 -0.9635 0.1561 -0.9702 0.1960 -0.1424 0.1066 -0.1824 -0.9774 64.085 18.374 64.153 A 21 GLN A 182 GLN~? A 41 TYR A 185 TYR~? A 43 ASN A 77 ASN~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 RMSD = 1.41 A TRANSFORM -0.4648 -0.7763 0.4259 -0.5028 -0.1646 -0.8486 0.7288 -0.6086 -0.3138 33.087 73.935 22.778 A 14 GLU A 28 GLU~? A 61 GLU A 45 GLU~? A 162 HIS A 41 HIS.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.41 A TRANSFORM 0.8112 -0.3495 0.4689 -0.3774 0.2996 0.8762 -0.4467 -0.8878 0.1111 32.511 -59.290 47.604 A 37 ASP A 9 ASP.? A 56 ILE A 208 ILE.? A 82 TYR A 185 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.41 A TRANSFORM 0.8124 -0.3532 0.4638 -0.3587 0.3243 0.8753 -0.4596 -0.8775 0.1368 35.837 -77.392 18.288 B 37 ASP A 9 ASP.? B 56 ILE A 208 ILE.? B 82 TYR A 185 TYR~? ULMNm 3 1bf2_c00 ISOAMYLASE user 1 3 RMSD = 1.42 A TRANSFORM -0.3434 -0.7573 0.5554 -0.2383 0.6423 0.7285 -0.9084 0.1178 -0.4011 117.025 3.804 75.395 375 ASP A 20 ASP~? 435 GLU A 16 GLU~? 510 ASP A 63 ASP~? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 3 3 RMSD = 1.42 A TRANSFORM 0.7137 0.5180 0.4716 0.2498 -0.8171 0.5196 0.6545 -0.2530 -0.7125 -68.038 -14.735 110.333 B 16 TYR A 290 TYR~? B 40 ASP A 323 ASP.? B 103 ASP A 7 ASP.? ULMNm 3 1euu_c00 SIALIDASE user 1 3 RMSD = 1.43 A TRANSFORM -0.1905 0.9794 -0.0676 -0.8313 -0.1976 -0.5195 -0.5221 -0.0428 0.8518 -38.917 40.493 -8.091 92 ASP A 9 ASP.? 260 GLU A 244 GLU~? 370 TYR A 185 TYR~? ULMNm 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.43 A TRANSFORM 0.6369 -0.2745 0.7204 -0.7370 0.0573 0.6734 -0.2261 -0.9599 -0.1658 -20.019 -7.008 77.439 A 18 SER A 40 SER.? A 20 HIS A 39 HIS.? A 22 LEU A 122 LEU~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 RMSD = 1.43 A TRANSFORM -0.4173 0.9087 0.0138 -0.7281 -0.3252 -0.6034 -0.5438 -0.2618 0.7973 4.818 96.824 -24.742 A 229 ALA A 293 ALA~? A 257 ALA A 237 ALA^? A 328 ASP A 268 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 17 3 RMSD = 1.43 A TRANSFORM -0.7812 -0.5608 0.2742 0.4569 -0.8130 -0.3609 0.4253 -0.1567 0.8914 85.811 142.330 -32.790 229 ASP A 374 ASP~? 264 GLU A 233 GLU^? 328 ASP A 226 ASP~? ULMNm 3 1sll_c00 SIALIDASE L user 7 3 RMSD = 1.43 A TRANSFORM 0.7045 0.6903 0.1647 -0.6803 0.5909 0.4336 0.2020 -0.4175 0.8859 -37.345 -38.445 -14.028 318 ASP A 300 ASP~? 595 GLU A 303 GLU~? 713 TYR A 276 TYR~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 RMSD = 1.44 A TRANSFORM 0.4123 0.7942 -0.4464 0.7493 -0.5743 -0.3297 -0.5182 -0.1985 -0.8319 29.718 60.837 84.048 A 229 ALA A 292 ALA~? A 257 ALA A 293 ALA~? A 328 ASP A 261 ASP~? ULMNm 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.44 A TRANSFORM -0.3959 0.8740 0.2819 -0.6771 -0.0705 -0.7325 -0.6203 -0.4809 0.6197 -55.983 120.990 45.814 179 ASP A 20 ASP~? 204 GLU A 16 GLU~? 289 ASP A 63 ASP~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 26 3 RMSD = 1.44 A TRANSFORM 0.5822 -0.5555 -0.5937 0.3733 0.8313 -0.4117 0.7223 0.0180 0.6913 84.949 28.095 -109.225 D 465 GLY A 340 GLY^? D 501 ASP A 218 ASP~? E 367 TYR A 302 TYR~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 6 3 RMSD = 1.44 A TRANSFORM -0.4192 0.7540 0.5057 0.2187 -0.4568 0.8623 0.8812 0.4721 0.0266 -24.177 -29.440 -24.698 A 67 ASP A 327 ASP~? A 68 ALA A 326 ALA~? A 72 LEU A 329 LEU~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.45 A TRANSFORM -0.8277 -0.5279 -0.1902 0.5526 -0.7080 -0.4396 0.0974 -0.4690 0.8778 19.994 88.651 43.063 D 603 HIS A 88 HIS~? D 646 ASP A 91 ASP~? D 739 GLY A 37 GLY.? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 3 3 RMSD = 1.45 A TRANSFORM 0.7715 0.4953 0.3993 -0.2586 0.8176 -0.5145 -0.5813 0.2937 0.7588 -63.960 -22.689 27.281 A 16 TYR A 290 TYR~? A 40 ASP A 323 ASP.? A 103 ASP A 7 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 14 3 RMSD = 1.45 A TRANSFORM 0.2955 0.6871 -0.6638 0.8226 -0.5364 -0.1889 -0.4858 -0.4902 -0.7237 -20.494 26.467 73.137 141 ASP A 54 ASP~? 166 GLY A 206 GLY.? 169 GLU A 244 GLU~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 RMSD = 1.45 A TRANSFORM -0.2201 0.4577 0.8614 0.5974 -0.6349 0.4900 0.7711 0.6225 -0.1337 -34.591 9.619 -24.498 A 229 ALA A 264 ALA^? A 257 ALA A 292 ALA~? A 328 ASP A 261 ASP~? ULMNm 3 2dbt_c02 CHITINASE C user 1 3 RMSD = 1.46 A TRANSFORM -0.7044 -0.4269 0.5671 0.0407 0.7733 0.6327 -0.7086 0.4688 -0.5273 56.931 -53.111 27.519 C 147 GLU A 16 GLU~? C 156 GLU A 211 GLU.? C 194 ASN A 77 ASN~? ULMNm 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM 0.6168 0.3276 0.7157 0.7868 -0.2290 -0.5732 -0.0239 0.9166 -0.3990 -56.407 58.576 44.267 A 241 ASP A 20 ASP~? A 295 GLU A 16 GLU~? A 369 ASP A 63 ASP~? ULMNm 3 2dbt_c01 CHITINASE C user 1 3 RMSD = 1.46 A TRANSFORM -0.0132 -0.7664 0.6423 -0.0312 -0.6417 -0.7663 0.9994 -0.0301 -0.0154 62.232 143.826 -4.783 B 147 GLU A 16 GLU~? B 156 GLU A 211 GLU.? B 194 ASN A 77 ASN~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 19 3 RMSD = 1.46 A TRANSFORM 0.2395 -0.4245 -0.8732 0.8120 -0.4055 0.4199 -0.5323 -0.8096 0.2476 144.942 -37.386 43.378 A 37 ASP A 374 ASP~? A 56 ILE A 339 ILE^? A 82 TYR A 361 TYR^? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.46 A TRANSFORM 0.6229 0.6507 -0.4342 0.4183 -0.7461 -0.5180 -0.6610 0.1410 -0.7370 -6.037 159.973 54.026 193 ASP A 20 ASP~? 231 ASP A 7 ASP.? 294 ASP A 49 ASP~? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 RMSD = 1.46 A TRANSFORM -0.3231 0.4775 0.8171 0.5499 0.7974 -0.2486 -0.7702 0.3690 -0.5202 -40.352 -29.401 34.030 A 16 TYR A 207 TYR.? A 40 ASP A 51 ASP~? A 103 LEU A 24 LEU~? ULMNm 3 3hde_o00 LYSOZYME user 5 3 RMSD = 1.46 A TRANSFORM -0.4176 -0.0214 -0.9084 0.7316 0.5850 -0.3501 0.5389 -0.8108 -0.2287 60.750 -46.220 17.790 A 35 GLU A 244 GLU~? A 44 ASP A 9 ASP.? A 50 THR A 238 THR.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 14 3 RMSD = 1.46 A TRANSFORM 0.0439 -0.9320 0.3599 0.7487 -0.2078 -0.6295 0.6614 0.2971 0.6887 57.532 117.637 -60.342 A 228 ASP A 360 ASP.? A 260 ASP A 374 ASP~? A 329 ASP A 316 ASP.? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 RMSD = 1.47 A TRANSFORM -0.3811 0.1854 0.9058 -0.2882 0.9071 -0.3069 -0.8785 -0.3780 -0.2923 67.713 44.252 186.265 B1198 GLY A 10 GLY.? B1228 SER A 324 SER~? B1549 ASP A 327 ASP~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 RMSD = 1.47 A TRANSFORM -0.1501 0.4176 0.8961 -0.5516 -0.7876 0.2747 0.8205 -0.4531 0.3486 -42.985 64.121 24.523 B 16 TYR A 207 TYR.? B 40 ASP A 51 ASP~? B 103 LEU A 24 LEU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.47 A TRANSFORM -0.3202 -0.7740 -0.5462 -0.9309 0.3641 0.0299 0.1758 0.5180 -0.8371 55.827 23.768 150.894 A 70 ALA A 172 ALA~? A 126 LEU A 176 LEU~? A 158 GLU A 112 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.47 A TRANSFORM 0.9781 0.1213 0.1691 0.1902 -0.8505 -0.4904 0.0843 0.5119 -0.8549 -56.258 61.874 154.857 B 70 ALA A 172 ALA~? B 126 LEU A 176 LEU~? B 158 GLU A 112 GLU~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 2 3 RMSD = 1.48 A TRANSFORM 0.2635 0.6958 0.6681 0.7809 0.2528 -0.5712 -0.5664 0.6723 -0.4767 -101.945 47.873 28.043 A1132 ASP A 268 ASP~? A1134 ALA A 264 ALA^? A1137 ASN A 297 ASN.? ULMNm 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 2 3 RMSD = 1.48 A TRANSFORM 0.7818 0.1874 -0.5947 0.6082 -0.4394 0.6611 -0.1375 -0.8785 -0.4575 18.067 -15.016 86.780 A 267 GLU A 192 GLU~? A 369 ARG A 200 ARG.? A 372 TYR A 191 TYR~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 23 3 RMSD = 1.48 A TRANSFORM -0.4156 -0.7099 0.5686 -0.9086 0.2953 -0.2955 0.0418 -0.6395 -0.7677 5.297 36.816 97.481 141 ASP A 317 ASP.? 166 GLY A 340 GLY^? 169 GLU A 368 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 25 3 RMSD = 1.49 A TRANSFORM -0.5809 -0.3731 -0.7234 0.6504 0.3216 -0.6882 0.4894 -0.8703 0.0558 89.196 23.689 38.697 141 ASP A 327 ASP~? 166 GLY A 371 GLY~? 169 GLU A 378 GLU.? ULMNm 3 2odj_o00 PORIN D user 4 3 RMSD = 1.49 A TRANSFORM 0.6918 -0.7105 0.1285 0.1502 0.3156 0.9369 -0.7063 -0.6289 0.3251 27.289 -69.745 66.970 A 156 HIS A 365 HIS~? A 208 ASP A 374 ASP~? A 296 SER A 330 SER~? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.49 A TRANSFORM -0.0600 -0.9631 -0.2625 0.9402 0.0338 -0.3389 0.3353 -0.2672 0.9035 55.775 39.343 -22.347 D 603 HIS A 380 HIS.? D 646 ASP A 360 ASP.? D 739 GLY A 371 GLY~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 19 3 RMSD = 1.50 A TRANSFORM 0.2352 -0.4182 -0.8774 0.8296 -0.3839 0.4054 -0.5063 -0.8233 0.2566 147.897 -54.548 15.038 B 37 ASP A 374 ASP~? B 56 ILE A 339 ILE^? B 82 TYR A 361 TYR^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 9 3 RMSD = 1.50 A TRANSFORM -0.4309 0.0417 -0.9015 0.7791 -0.4868 -0.3949 -0.4553 -0.8725 0.1773 122.290 52.481 68.295 A 67 ASP A 360 ASP.? A 68 ALA A 359 ALA.? A 72 LEU A 354 LEU~? ULMNm 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 RMSD = 1.50 A TRANSFORM -0.9815 -0.1901 0.0213 0.0084 0.0682 0.9976 -0.1911 0.9794 -0.0653 33.691 -35.658 42.891 C 151 SER A 289 SER~? C 164 TYR A 290 TYR~? C 168 LYS A 284 LYS.?