*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.62 A TRANSFORM -0.1212 -0.8212 -0.5576 0.9599 -0.2400 0.1449 -0.2528 -0.5177 0.8174 64.438 -98.953 -162.109 A 420 ALA A 124 ALA~? B 182 GLY A 131 GLY.? B 183 GLY A 132 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.95 A TRANSFORM 0.9177 0.0288 0.3963 -0.1705 0.9295 0.3272 -0.3589 -0.3678 0.8578 29.955 -121.264 -165.617 A 420 ALA A 124 ALA~? B 182 GLY A 133 GLY.? B 183 GLY A 132 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.07 A TRANSFORM 0.8195 -0.3642 -0.4425 -0.4404 -0.8942 -0.0797 -0.3666 0.2602 -0.8932 52.729 -63.700 -93.660 A 183 GLY A 133 GLY.? B 419 GLY A 132 GLY.? B 420 ALA A 127 ALA~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.08 A TRANSFORM 0.9191 -0.3709 -0.1334 -0.2425 -0.2653 -0.9332 0.3107 0.8900 -0.3338 10.247 96.071 128.868 A 1 ALA A 124 ALA~? A 74 ASN A 86 ASN~? A 75 GLY A 83 GLY~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.10 A TRANSFORM 0.1716 0.5030 0.8471 -0.9738 0.2166 0.0687 -0.1490 -0.8367 0.5270 0.559 -58.847 -17.729 D 49 ASP A 121 ASP~? D 86 HIS A 79 HIS~? D 250 ALA A 118 ALA.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.11 A TRANSFORM 0.5911 -0.0088 -0.8065 -0.3003 0.9257 -0.2302 0.7486 0.3783 0.5445 70.116 14.238 9.230 B 1 ALA A 124 ALA~? B 74 ASN A 86 ASN~? B 75 GLY A 83 GLY~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.12 A TRANSFORM 0.9008 0.3931 0.1842 0.1910 -0.7399 0.6451 0.3899 -0.5459 -0.7416 4.672 -101.009 -93.209 A 183 GLY A 47 GLY.? B 419 GLY A 49 GLY.? B 420 ALA A 54 ALA~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.13 A TRANSFORM -0.1401 0.5059 0.8511 0.9048 -0.2838 0.3176 0.4022 0.8146 -0.4180 -18.091 10.675 46.668 C 1 ALA A 124 ALA~? C 74 ASN A 86 ASN~? C 75 GLY A 83 GLY~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.15 A TRANSFORM -0.5765 0.5537 0.6009 0.7966 0.2173 0.5641 0.1818 0.8038 -0.5664 -50.998 -28.782 52.598 B 49 ASP A 121 ASP~? B 86 HIS A 79 HIS~? B 250 ALA A 118 ALA.? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.15 A TRANSFORM 0.9808 -0.1928 -0.0302 0.1258 0.5062 0.8532 -0.1492 -0.8406 0.5207 21.840 -61.160 16.364 A 49 ASP A 121 ASP~? A 86 HIS A 79 HIS~? A 250 ALA A 118 ALA.? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.15 A TRANSFORM 0.9808 -0.1928 -0.0302 0.1258 0.5062 0.8532 -0.1492 -0.8406 0.5207 21.840 -61.160 16.364 A 49 ASP A 121 ASP~? A 86 HIS A 79 HIS~? A 250 ALA A 118 ALA.? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.16 A TRANSFORM 0.5836 -0.5594 -0.5887 0.7969 0.2548 0.5478 -0.1565 -0.7888 0.5944 -11.223 4.485 6.967 E 49 ASP A 121 ASP~? E 86 HIS A 79 HIS~? E 250 ALA A 118 ALA.? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.18 A TRANSFORM -0.4719 0.8588 0.1993 -0.3232 -0.3789 0.8672 0.8203 0.3448 0.4563 -29.264 13.220 101.884 D 1 ALA A 124 ALA~? D 74 ASN A 86 ASN~? D 75 GLY A 83 GLY~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.22 A TRANSFORM 0.8008 0.2641 0.5376 0.5908 -0.4958 -0.6365 0.0984 0.8273 -0.5530 32.027 17.124 16.586 C 49 ASP A 121 ASP~? C 86 HIS A 79 HIS~? C 250 ALA A 118 ALA.? ULMNm 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.27 A TRANSFORM -0.9431 -0.1863 -0.2755 -0.2056 0.9777 0.0425 0.2615 0.0967 -0.9604 48.859 7.670 113.404 D 107 ASP A 121 ASP~? D 246 ASP A 72 ASP.? D 275 HIS A 79 HIS~? ULMNm 3 1foh_c02 PHENOL HYDROXYLASE user 1 3 RMSD = 1.27 A TRANSFORM -0.0656 -0.9669 0.2464 0.0473 -0.2497 -0.9672 0.9967 -0.0518 0.0622 46.156 122.262 25.686 C 54 ASP A 9 ASP.? C 281 ARG A 12 ARG~? C 289 TYR A 15 TYR~? ULMNm 3 1foh_c01 PHENOL HYDROXYLASE user 1 3 RMSD = 1.27 A TRANSFORM 0.4094 0.8656 -0.2883 -0.2586 -0.1930 -0.9465 -0.8749 0.4621 0.1448 82.584 130.493 103.971 B 54 ASP A 9 ASP.? B 281 ARG A 12 ARG~? B 289 TYR A 15 TYR~? ULMNm 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.27 A TRANSFORM 0.2621 0.2277 -0.9378 0.1210 -0.9718 -0.2022 -0.9574 -0.0605 -0.2823 64.422 74.331 91.782 B 107 ASP A 121 ASP~? B 246 ASP A 72 ASP.? B 275 HIS A 79 HIS~? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.29 A TRANSFORM -0.2409 -0.6777 0.6947 0.6438 -0.6473 -0.4082 0.7263 0.3489 0.5922 100.419 76.330 -26.603 B 55 ASP A 6 ASP.? B 58 ASP A 9 ASP.? B 424 GLU A 64 GLU~? ULMNm 3 1foh_c03 PHENOL HYDROXYLASE user 1 3 RMSD = 1.30 A TRANSFORM -0.6858 -0.6709 0.2821 -0.0082 0.3946 0.9188 -0.7278 0.6278 -0.2761 86.475 -0.375 125.561 D 54 ASP A 9 ASP.? D 281 ARG A 12 ARG~? D 289 TYR A 15 TYR~? ULMNm 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 RMSD = 1.31 A TRANSFORM 0.9056 0.3901 -0.1667 0.1434 0.0884 0.9857 0.3992 -0.9165 0.0241 37.385 -8.016 50.260 A 54 ASP A 9 ASP.? A 281 ARG A 12 ARG~? A 289 TYR A 15 TYR~? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 RMSD = 1.31 A TRANSFORM 0.5556 -0.4371 -0.7072 -0.3988 0.6063 -0.6880 0.7295 0.6643 0.1625 83.908 74.175 -13.694 A 55 ASP A 6 ASP.? A 58 ASP A 9 ASP.? A 424 GLU A 64 GLU~? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 RMSD = 1.31 A TRANSFORM -0.6227 0.0539 0.7806 0.7177 0.4368 0.5424 -0.3117 0.8980 -0.3106 -14.376 9.135 11.766 A 10 ASP A 121 ASP~? A 186 ASN A 86 ASN~? A 260 ALA A 127 ALA~? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.32 A TRANSFORM 0.7808 0.5962 -0.1865 0.5338 -0.7919 -0.2967 -0.3246 0.1321 -0.9366 38.341 -48.053 -91.187 A 183 GLY A 133 GLY.? B 419 GLY A 131 GLY.? B 420 ALA A 127 ALA~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 RMSD = 1.35 A TRANSFORM -0.8565 0.3692 -0.3608 -0.1539 0.4845 0.8611 0.4927 0.7931 -0.3582 21.114 -30.555 52.587 B 317 GLU A 134 GLU.? B 319 ASP A 135 ASP~? B 359 ARG A 137 ARG~? ULMNm 3 1dhp_c01 DIHYDRODIPICOLINATE SYNTHASE user 1 3 RMSD = 1.37 A TRANSFORM 0.6889 -0.7171 0.1061 0.6876 0.6000 -0.4089 0.2295 0.3546 0.9064 2.865 138.867 69.193 B 133 TYR A 129 TYR~? B 138 ARG A 91 ARG.? B 161 LYS A 128 LYS~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.40 A TRANSFORM 0.1453 0.3216 -0.9357 0.9806 0.0790 0.1795 0.1316 -0.9436 -0.3039 -6.824 -17.468 -1.295 B 114 HIS A 71 HIS~? B 197 ASP A 6 ASP.? B 223 ALA A 16 ALA~? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 RMSD = 1.40 A TRANSFORM -0.1430 -0.3350 0.9313 -0.9894 0.0714 -0.1263 -0.0242 -0.9395 -0.3417 -86.725 10.783 1.494 A 114 HIS A 71 HIS~? A 197 ASP A 6 ASP.? A 223 ALA A 16 ALA~? ULMNm 3 2bsq_d00 TRANSCRIPTION user 1 3 RMSD = 1.42 A TRANSFORM -0.8331 -0.4728 -0.2870 0.2614 0.1206 -0.9577 0.4874 -0.8729 0.0231 21.654 21.240 26.488 E 3 SER A 50 SER.? E 5 VAL A 55 VAL~? E 7 ARG A 56 ARG~? ULMNm 3 1kim_c00 THYMIDINE KINASE user 1 3 RMSD = 1.45 A TRANSFORM -0.7819 -0.2959 -0.5488 -0.5713 -0.0125 0.8207 -0.2497 0.9551 -0.1592 73.170 69.427 55.426 A 83 GLU A 26 GLU~? A 163 ARG A 22 ARG~? A 222 ARG A 29 ARG~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.46 A TRANSFORM -0.4002 0.0530 0.9149 0.8100 0.4875 0.3261 -0.4287 0.8715 -0.2380 -77.625 -23.323 149.454 B 70 ALA A 65 ALA~? B 126 LEU A 62 LEU~? B 158 GLU A 63 GLU~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.46 A TRANSFORM 0.6226 0.0974 0.7765 -0.3930 0.8969 0.2026 -0.6767 -0.4313 0.5967 5.202 4.741 -11.798 A 229 ALA A 113 ALA~? A 257 ALA A 115 ALA~? A 328 ASP A 117 ASP.? ULMNm 3 1dhp_c00 DIHYDRODIPICOLINATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM -0.6801 0.7231 -0.1203 -0.6576 -0.6744 -0.3359 -0.3240 -0.1494 0.9342 31.325 98.563 53.497 A 133 TYR A 129 TYR~? A 138 ARG A 91 ARG.? A 161 LYS A 128 LYS~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.46 A TRANSFORM 0.8858 0.4279 -0.1795 -0.0917 -0.2178 -0.9717 -0.4548 0.8772 -0.1537 -7.660 84.426 143.284 A 70 ALA A 65 ALA~? A 126 LEU A 62 LEU~? A 158 GLU A 63 GLU~? ULMNm 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 RMSD = 1.47 A TRANSFORM -0.1011 -0.0192 -0.9947 0.9815 -0.1653 -0.0966 -0.1625 -0.9861 0.0356 115.046 16.017 37.750 A 314 TRP A 37 TRP~? A 317 GLU A 27 GLU~? A 365 ARG A 77 ARG~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.47 A TRANSFORM -0.5321 -0.3893 -0.7519 -0.7541 -0.1858 0.6299 -0.3849 0.9022 -0.1947 50.861 -30.439 145.556 C 70 ALA A 65 ALA~? C 126 LEU A 62 LEU~? C 158 GLU A 63 GLU~?