*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.70 A TRANSFORM 0.4306 -0.4006 0.8087 -0.0069 0.8946 0.4468 -0.9025 -0.1980 0.3824 17.834 -180.445 -129.516 A 420 ALA B 58 ALA~? B 182 GLY B 52 GLY~? B 183 GLY B 53 GLY~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.71 A TRANSFORM 0.5723 0.0546 -0.8182 -0.5555 -0.7082 -0.4358 -0.6033 0.7039 -0.3749 80.526 -60.242 -132.289 A 420 ALA A 58 ALA~? B 182 GLY A 52 GLY~? B 183 GLY A 53 GLY~? ULMNm 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 RMSD = 1.02 A TRANSFORM 0.5232 0.4578 -0.7187 0.2876 -0.8888 -0.3568 -0.8022 -0.0200 -0.5968 38.365 100.644 87.124 A 18 HIS A 121 HIS^? A 91 ARG A 101 ARG^? A 129 SER B 123 SER^? ULMNm 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 RMSD = 1.06 A TRANSFORM 0.1424 -0.6815 0.7178 0.7607 0.5393 0.3612 -0.6333 0.4946 0.5952 17.073 -2.890 1.597 A 18 HIS B 121 HIS^? A 91 ARG B 101 ARG^? A 129 SER A 123 SER^? ULMNm 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 RMSD = 1.11 A TRANSFORM 0.7493 -0.0733 0.6582 -0.2421 0.8947 0.3753 -0.6164 -0.4406 0.6526 -18.229 -38.193 30.108 B 18 HIS A 121 HIS^? B 91 ARG A 101 ARG^? B 129 SER B 123 SER^? ULMNm 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 RMSD = 1.12 A TRANSFORM 0.6464 -0.3892 -0.6562 -0.7287 -0.5697 -0.3800 -0.2260 0.7238 -0.6519 64.384 68.976 43.398 B 18 HIS B 121 HIS^? B 91 ARG B 101 ARG^? B 129 SER A 123 SER^? ULMNm 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 4 3 RMSD = 1.17 A TRANSFORM 0.9618 0.0746 -0.2636 0.1793 0.5563 0.8114 0.2071 -0.8276 0.5216 63.975 -7.099 101.330 C 95 ASP B 27 ASP~? C 117 GLU B 29 GLU~? C 131 GLU B 25 GLU~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 5 3 RMSD = 1.21 A TRANSFORM 0.0909 0.2231 0.9705 0.9448 -0.3274 -0.0132 0.3148 0.9182 -0.2406 -52.238 31.369 -31.589 A 14 GLU B 90 GLU^? A 61 GLU B 20 GLU~? A 162 HIS B 73 HIS^? ULMNm 3 2dbt_c01 CHITINASE C user 10 3 RMSD = 1.24 A TRANSFORM -0.5165 0.8147 0.2635 0.3172 0.4679 -0.8249 -0.7954 -0.3424 -0.5001 0.541 68.987 57.529 B 147 GLU B 20 GLU~? B 156 GLU B 18 GLU~? B 194 ASN B 26 ASN~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 RMSD = 1.25 A TRANSFORM -0.0653 -0.2302 -0.9709 0.9516 -0.3072 0.0089 -0.3003 -0.9234 0.2391 69.262 29.390 29.357 A 14 GLU A 90 GLU^? A 61 GLU A 20 GLU~? A 162 HIS A 73 HIS^? ULMNm 3 2dbt_c02 CHITINASE C user 12 3 RMSD = 1.29 A TRANSFORM 0.1495 0.7470 0.6478 -0.2194 -0.6137 0.7584 0.9641 -0.2555 0.0722 -19.543 32.313 15.989 C 147 GLU B 20 GLU~? C 156 GLU B 18 GLU~? C 194 ASN B 26 ASN~? ULMNm 3 2dbt_c01 CHITINASE C user 4 3 RMSD = 1.30 A TRANSFORM -0.9034 -0.3350 -0.2676 -0.0304 -0.5725 0.8194 -0.4276 0.7484 0.5070 81.623 32.454 -45.429 B 147 GLU A 20 GLU~? B 156 GLU A 18 GLU~? B 194 ASN A 26 ASN~? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 RMSD = 1.31 A TRANSFORM 0.0601 0.1888 0.9802 0.6804 0.7107 -0.1786 -0.7303 0.6777 -0.0857 46.565 45.661 -15.331 B 137 GLY A 52 GLY~? B 175 ARG A 43 ARG^? B 242 TYR A 44 TYR^? ULMNm 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 RMSD = 1.32 A TRANSFORM -0.0578 -0.1928 -0.9795 0.1176 -0.9757 0.1851 -0.9914 -0.1045 0.0791 165.528 105.250 12.622 B 137 GLY B 52 GLY~? B 175 ARG B 43 ARG^? B 242 TYR B 44 TYR^? ULMNm 3 2dbt_c00 CHITINASE C user 5 3 RMSD = 1.33 A TRANSFORM -0.4210 -0.2680 -0.8666 0.7003 0.5112 -0.4983 0.5765 -0.8166 -0.0276 134.088 39.189 36.504 A 147 GLU A 29 GLU~? A 156 GLU A 18 GLU~? A 194 ASN A 26 ASN~? ULMNm 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 3 RMSD = 1.34 A TRANSFORM 0.5047 -0.7798 0.3703 -0.2622 -0.5471 -0.7949 0.8225 0.3041 -0.4806 66.958 126.712 96.198 C 95 ASP A 27 ASP~? C 117 GLU A 29 GLU~? C 131 GLU A 25 GLU~? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.34 A TRANSFORM 0.2757 -0.3961 -0.8758 0.1874 -0.8715 0.4531 -0.9428 -0.2891 -0.1661 67.612 -7.788 42.194 C 124 ALA A 22 ALA~? C 126 ARG A 70 ARG.? C 138 GLU A 18 GLU~? ULMNm 3 2dbt_c00 CHITINASE C user 10 3 RMSD = 1.35 A TRANSFORM 0.2235 -0.8316 -0.5084 0.4728 0.5487 -0.6895 0.8524 -0.0862 0.5158 131.241 11.645 -12.397 A 147 GLU B 20 GLU~? A 156 GLU B 18 GLU~? A 194 ASN B 26 ASN~? ULMNm 3 2dbt_c02 CHITINASE C user 5 3 RMSD = 1.35 A TRANSFORM -0.3313 -0.6793 -0.6548 0.1966 0.6291 -0.7520 0.9228 -0.3779 -0.0749 114.347 52.484 29.301 C 147 GLU A 20 GLU~? C 156 GLU A 18 GLU~? C 194 ASN A 26 ASN~? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.35 A TRANSFORM 0.4697 0.1596 0.8683 0.6656 0.5821 -0.4671 -0.5799 0.7973 0.1672 -48.642 -28.061 -25.505 C 124 ALA B 22 ALA~? C 126 ARG B 70 ARG.? C 138 GLU B 18 GLU~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 1 3 RMSD = 1.37 A TRANSFORM 0.4602 -0.4512 0.7647 0.0424 -0.8491 -0.5265 0.8868 0.2747 -0.3716 -24.307 64.240 9.479 A 271 PRO A 97 PRO^? A 272 LEU A 98 LEU^? A 276 ARG A 101 ARG^? ULMNm 3 2dbt_c00 CHITINASE C user 4 3 RMSD = 1.41 A TRANSFORM 0.6797 0.5226 0.5147 0.0444 -0.7297 0.6823 0.7321 -0.4409 -0.5192 15.164 0.304 57.674 A 147 GLU A 20 GLU~? A 156 GLU A 18 GLU~? A 194 ASN A 26 ASN~? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.42 A TRANSFORM 0.2810 -0.3874 -0.8781 -0.1811 0.8771 -0.4449 0.9425 0.2840 0.1763 67.407 9.635 39.511 E 124 ALA A 22 ALA~? E 126 ARG A 70 ARG.? E 138 GLU A 18 GLU~? ULMNm 3 2dbt_c02 CHITINASE C user 7 3 RMSD = 1.42 A TRANSFORM 0.6363 -0.0583 0.7693 -0.5587 -0.7224 0.4074 0.5320 -0.6890 -0.4922 -2.054 18.554 67.289 C 147 GLU A 29 GLU~? C 156 GLU A 18 GLU~? C 194 ASN A 26 ASN~? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.42 A TRANSFORM -0.3482 0.9367 0.0379 -0.0719 -0.0670 0.9952 0.9347 0.3438 0.0907 -32.637 -65.822 43.759 D 124 ALA A 22 ALA~? D 126 ARG A 70 ARG.? D 138 GLU A 18 GLU~? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.43 A TRANSFORM 0.4688 0.1494 0.8706 -0.6641 -0.5902 0.4589 0.5824 -0.7933 -0.1775 -48.202 31.395 107.850 E 124 ALA B 22 ALA~? E 126 ARG B 70 ARG.? E 138 GLU B 18 GLU~? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 14 3 RMSD = 1.43 A TRANSFORM -0.8400 -0.5421 -0.0220 -0.0309 0.0883 -0.9956 0.5416 -0.8357 -0.0910 39.568 29.960 107.961 D 124 ALA B 22 ALA~? D 126 ARG B 70 ARG.? D 138 GLU B 18 GLU~? ULMNm 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 3 3 RMSD = 1.43 A TRANSFORM -0.6328 0.7570 0.1628 0.0691 0.2646 -0.9619 -0.7712 -0.5974 -0.2198 10.911 70.389 89.880 16 ALA B 120 ALA^? 19 HIS A 121 HIS^? 22 HIS B 121 HIS^? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.43 A TRANSFORM 0.0736 -0.5715 0.8173 0.3953 -0.7357 -0.5500 0.9156 0.3636 0.1718 -46.133 60.501 37.651 F 124 ALA A 22 ALA~? F 126 ARG A 70 ARG.? F 138 GLU A 18 GLU~? ULMNm 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 2 3 RMSD = 1.43 A TRANSFORM -0.9653 -0.2025 -0.1648 -0.1077 -0.2663 0.9579 -0.2378 0.9424 0.2353 72.573 -4.161 -5.423 16 ALA A 120 ALA^? 19 HIS B 121 HIS^? 22 HIS A 121 HIS^? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 RMSD = 1.44 A TRANSFORM 0.3900 0.4068 -0.8261 0.7644 0.3572 0.5367 0.5134 -0.8408 -0.1717 -6.770 -46.842 111.387 F 124 ALA B 22 ALA~? F 126 ARG B 70 ARG.? F 138 GLU B 18 GLU~? ULMNm 3 2dbt_c00 CHITINASE C user 6 3 RMSD = 1.46 A TRANSFORM 0.1194 0.2062 -0.9712 0.1173 0.9684 0.2201 0.9859 -0.1402 0.0914 125.442 -18.850 6.793 A 147 GLU A 61 GLU~? A 156 GLU A 29 GLU~? A 194 ASN A 26 ASN~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.46 A TRANSFORM 0.3864 0.1829 0.9040 -0.4644 -0.8083 0.3620 0.7969 -0.5597 -0.2274 -41.881 25.356 189.237 C 70 ALA B 33 ALA~? C 126 LEU B 34 LEU~? C 158 GLU B 18 GLU~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 3 3 RMSD = 1.46 A TRANSFORM 0.6441 0.0817 -0.7606 0.5252 0.6757 0.5173 0.5562 -0.7327 0.3922 29.639 -60.363 16.883 A 271 PRO B 97 PRO^? A 272 LEU B 98 LEU^? A 276 ARG B 101 ARG^? ULMNm 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 RMSD = 1.47 A TRANSFORM -0.3524 0.9350 0.0405 0.0566 0.0644 -0.9963 -0.9341 -0.3488 -0.0756 -32.738 68.476 37.670 B 124 ALA A 22 ALA~? B 126 ARG A 70 ARG.? B 138 GLU A 18 GLU~? ULMNm 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 14 3 RMSD = 1.47 A TRANSFORM -0.8427 -0.5378 -0.0234 0.0210 -0.0763 0.9969 -0.5379 0.8396 0.0756 39.410 -28.121 -25.383 B 124 ALA B 22 ALA~? B 126 ARG B 70 ARG.? B 138 GLU B 18 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.48 A TRANSFORM 0.2860 0.5548 -0.7813 0.5892 0.5411 0.6000 0.7557 -0.6319 -0.1722 -5.450 -22.367 190.178 A 70 ALA B 33 ALA~? A 126 LEU B 34 LEU~? A 158 GLU B 18 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 RMSD = 1.49 A TRANSFORM -0.5809 -0.8008 -0.1456 -0.0406 0.2072 -0.9775 0.8130 -0.5619 -0.1528 17.789 32.083 187.450 B 70 ALA B 33 ALA~? B 126 LEU B 34 LEU~? B 158 GLU B 18 GLU~? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.50 A TRANSFORM -0.0229 0.8080 0.5887 -0.6175 0.4517 -0.6440 -0.7863 -0.3782 0.4886 -28.882 93.475 22.277 B 194 SER A 123 SER^? B 292 ASP B 94 ASP.? B 322 HIS A 73 HIS^? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.50 A TRANSFORM 0.1960 -0.3798 -0.9041 0.1161 0.9245 -0.3631 0.9737 -0.0338 0.2253 77.663 -17.735 141.433 C 70 ALA A 33 ALA~? C 126 LEU A 34 LEU~? C 158 GLU A 18 GLU~? ULMNm 3 2dbt_c01 CHITINASE C user 6 3 RMSD = 1.50 A TRANSFORM 0.1863 0.5685 0.8013 0.5244 0.6322 -0.5704 -0.8308 0.5265 -0.1803 -19.827 86.682 8.441 B 147 GLU A 29 GLU~? B 156 GLU A 18 GLU~? B 194 ASN A 26 ASN~?