*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 0.49 A TRANSFORM 0.6820 -0.5089 -0.5252 0.0680 -0.6709 0.7384 -0.7281 -0.5393 -0.4230 -13.590 32.183 137.313 D 1 ALA A 90 ALA~? D 74 ASN A 84 ASN.? D 75 GLY A 83 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 0.51 A TRANSFORM -0.4488 0.7631 -0.4650 0.5994 -0.1289 -0.7900 -0.6628 -0.6333 -0.3995 50.262 18.471 47.334 B 1 ALA A 90 ALA~? B 74 ASN A 84 ASN.? B 75 GLY A 83 GLY~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 0.53 A TRANSFORM -0.9619 0.2713 -0.0347 0.2715 0.9624 -0.0012 0.0331 -0.0106 -0.9994 12.985 54.022 138.138 A 1 ALA A 90 ALA~? A 74 ASN A 84 ASN.? A 75 GLY A 83 GLY~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 0.54 A TRANSFORM 0.1736 -0.9794 -0.1028 -0.9828 -0.1790 0.0450 -0.0624 0.0932 -0.9937 19.443 30.952 52.961 C 1 ALA A 90 ALA~? C 74 ASN A 84 ASN.? C 75 GLY A 83 GLY~? ULMNm 3 3pta_d00 TRANSFERASE/DNA user 1 3 RMSD = 0.75 A TRANSFORM 0.0326 0.4980 -0.8666 -0.5466 -0.7170 -0.4326 -0.8367 0.4878 0.2489 0.156 -21.363 63.038 A 682 SER A 119 SER~? A 683 LYS A 116 LYS~? A 684 GLN A 115 GLN~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 0.97 A TRANSFORM 0.5282 0.2136 0.8218 0.5694 -0.8071 -0.1562 0.6299 0.5504 -0.5479 -15.121 57.530 125.294 A 1 ALA A 46 ALA.? A 74 ASN A 45 ASN.? A 75 GLY A 95 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.03 A TRANSFORM 0.9734 -0.1129 0.1996 0.2242 0.2874 -0.9312 0.0478 0.9511 0.3050 28.336 24.623 26.161 B 1 ALA A 46 ALA.? B 74 ASN A 45 ASN.? B 75 GLY A 95 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.04 A TRANSFORM -0.3795 -0.9248 0.0284 0.8607 -0.3416 0.3774 -0.3393 0.1677 0.9256 39.403 -6.411 21.407 B 1 ALA A 96 ALA.? B 74 ASN A 101 ASN^? B 75 GLY A 99 GLY^? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.04 A TRANSFORM -0.9173 -0.3217 0.2345 0.0744 -0.7172 -0.6929 0.3911 -0.6182 0.6819 8.161 66.652 103.254 A 1 ALA A 96 ALA.? A 74 ASN A 101 ASN^? A 75 GLY A 99 GLY^? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.07 A TRANSFORM -0.6605 0.6966 -0.2800 0.1745 0.5052 0.8452 0.7302 0.5094 -0.4553 26.855 5.239 37.115 C 1 ALA A 46 ALA.? C 74 ASN A 45 ASN.? C 75 GLY A 95 GLY~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.07 A TRANSFORM 0.6940 0.2947 0.6569 -0.7197 0.3092 0.6217 -0.0199 -0.9042 0.4266 17.736 42.005 40.211 A 316 ALA A 110 ALA~? A 317 GLY A 107 GLY.? A 318 ASP A 40 ASP.? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.08 A TRANSFORM 0.3757 0.7042 0.6024 -0.8835 0.0759 0.4623 0.2798 -0.7059 0.6507 5.984 23.747 18.818 C 1 ALA A 96 ALA.? C 74 ASN A 101 ASN^? C 75 GLY A 99 GLY^? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.10 A TRANSFORM -0.2338 0.3848 -0.8929 -0.9608 0.0494 0.2729 0.1491 0.9217 0.3582 0.041 47.020 113.594 D 1 ALA A 46 ALA.? D 74 ASN A 45 ASN.? D 75 GLY A 95 GLY~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.10 A TRANSFORM 0.9074 0.1292 0.3999 -0.0867 0.9886 -0.1227 -0.4112 0.0767 0.9083 -32.891 51.021 111.260 D 1 ALA A 96 ALA.? D 74 ASN A 101 ASN^? D 75 GLY A 99 GLY^? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.11 A TRANSFORM 0.5171 -0.8546 0.0480 0.8505 0.5193 0.0830 -0.0958 -0.0020 0.9954 2.677 -37.062 -41.696 B 250 ALA A 110 ALA~? B 251 GLY A 107 GLY.? B 252 ASP A 40 ASP.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.13 A TRANSFORM -0.2251 0.2903 -0.9301 0.4713 0.8679 0.1568 0.8528 -0.4030 -0.3321 145.513 13.085 -24.407 A 316 ALA A 110 ALA~? A 317 GLY A 107 GLY.? A 318 ASP A 40 ASP.? ULMNm 3 2dbt_c01 CHITINASE C user 2 3 RMSD = 1.13 A TRANSFORM 0.0299 0.4693 0.8825 0.6814 0.6364 -0.3615 -0.7313 0.6121 -0.3007 43.539 70.580 26.046 B 147 GLU A 129 GLU.? B 156 GLU A 47 GLU.? B 194 ASN A 101 ASN^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.14 A TRANSFORM -0.6373 -0.6596 -0.3985 -0.6808 0.7242 -0.1098 0.3610 0.2014 -0.9106 34.897 -0.178 -14.641 A 250 ALA A 110 ALA~? A 251 GLY A 107 GLY.? A 252 ASP A 40 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.26 A TRANSFORM -0.7672 -0.1564 0.6221 -0.6227 -0.0510 -0.7808 0.1538 -0.9864 -0.0582 -0.084 70.103 29.009 179 ASP A 50 ASP~? 227 GLU A 100 GLU^? 289 ASP A 132 ASP~? ULMNm 3 2dbt_c02 CHITINASE C user 2 3 RMSD = 1.27 A TRANSFORM 0.4398 -0.1873 0.8783 -0.6797 -0.7087 0.1892 0.5870 -0.6802 -0.4390 32.417 22.549 9.202 C 147 GLU A 129 GLU.? C 156 GLU A 47 GLU.? C 194 ASN A 101 ASN^? ULMNm 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.29 A TRANSFORM 0.1641 0.7108 0.6840 -0.2981 -0.6253 0.7212 0.9403 -0.3222 0.1093 -1.186 38.476 12.076 C 581 GLU A 76 GLU~? C 596 ARG A 80 ARG~? C 647 ARG A 85 ARG.? ULMNm 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.30 A TRANSFORM 0.6370 -0.1465 0.7568 0.6445 -0.4373 -0.6272 0.4228 0.8873 -0.1841 -58.622 -22.890 6.827 D 581 GLU A 76 GLU~? D 596 ARG A 80 ARG~? D 647 ARG A 85 ARG.? ULMNm 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.30 A TRANSFORM -0.6506 0.1310 -0.7480 -0.7311 0.1585 0.6636 0.2055 0.9786 -0.0073 83.471 40.846 16.489 A 581 GLU A 76 GLU~? A 596 ARG A 80 ARG~? A 647 ARG A 85 ARG.? ULMNm 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.31 A TRANSFORM -0.1680 -0.7302 -0.6622 0.0060 0.6710 -0.7414 0.9858 -0.1285 -0.1084 25.735 -18.088 4.110 E 581 GLU A 76 GLU~? E 596 ARG A 80 ARG~? E 647 ARG A 85 ARG.? ULMNm 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.31 A TRANSFORM 0.5045 -0.8591 0.0860 -0.8633 -0.5002 0.0669 -0.0145 -0.1080 -0.9940 36.015 77.472 76.447 B 581 GLU A 76 GLU~? B 596 ARG A 80 ARG~? B 647 ARG A 85 ARG.? ULMNm 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 RMSD = 1.31 A TRANSFORM -0.4968 0.8638 -0.0835 0.8331 0.5016 0.2331 0.2432 0.0463 -0.9689 -11.722 -74.935 53.953 F 581 GLU A 76 GLU~? F 596 ARG A 80 ARG~? F 647 ARG A 85 ARG.? ULMNm 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 RMSD = 1.34 A TRANSFORM -0.2126 0.9521 0.2197 -0.6299 -0.3054 0.7141 0.7470 0.0134 0.6647 57.514 4.297 10.680 A 107 ALA A 46 ALA.? A 136 TYR A 135 TYR~? A 140 LYS A 51 LYS~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.35 A TRANSFORM 0.9249 0.1762 -0.3368 -0.3238 0.8293 -0.4554 0.1991 0.5303 0.8241 57.168 39.367 12.373 199 ASP A 132 ASP~? 218 GLU A 122 GLU.? 329 ASP A 50 ASP~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.37 A TRANSFORM 0.0256 -0.9727 -0.2305 0.4116 -0.1999 0.8892 -0.9110 -0.1176 0.3953 49.773 -24.515 15.923 A 37 ASP A 35 ASP~? A 56 ILE A 117 ILE~? A 82 TYR A 41 TYR^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.38 A TRANSFORM 0.0248 -0.9711 -0.2372 0.4391 -0.2026 0.8753 -0.8981 -0.1259 0.4214 52.749 -41.567 -12.387 B 37 ASP A 35 ASP~? B 56 ILE A 117 ILE~? B 82 TYR A 41 TYR^? ULMNm 3 1sll_c00 SIALIDASE L user 2 3 RMSD = 1.38 A TRANSFORM -0.5371 0.3810 0.7526 -0.0194 -0.8976 0.4405 0.8433 0.2220 0.4895 -3.715 6.781 27.172 318 ASP A 142 ASP~? 595 GLU A 47 GLU.? 713 TYR A 135 TYR~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 RMSD = 1.40 A TRANSFORM -0.1898 0.5938 -0.7819 -0.7908 0.3795 0.4802 0.5818 0.7095 0.3976 22.098 41.795 17.334 B 1 SER A 82 SER~? B 69 ALA A 90 ALA~? B 241 ASN A 84 ASN.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.43 A TRANSFORM -0.9729 -0.1070 0.2048 -0.1500 -0.3820 -0.9119 0.1758 -0.9180 0.3556 47.658 9.026 16.833 A 67 ASP A 50 ASP~? A 68 ALA A 136 ALA~? A 72 LEU A 133 LEU~? ULMNm 3 2dbt_c00 CHITINASE C user 3 3 RMSD = 1.44 A TRANSFORM -0.2239 -0.1472 -0.9634 0.8260 0.4960 -0.2678 0.5173 -0.8557 0.0105 80.193 20.993 -0.253 A 147 GLU A 129 GLU.? A 156 GLU A 47 GLU.? A 194 ASN A 101 ASN^? ULMNm 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 4 3 RMSD = 1.47 A TRANSFORM 0.8422 0.4867 0.2321 0.0502 0.3578 -0.9324 -0.5369 0.7969 0.2769 1.472 48.785 16.338 A 50 ASP A 142 ASP~? A 55 TYR A 135 TYR~? A 84 LYS A 51 LYS~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.49 A TRANSFORM -0.6521 -0.4050 0.6409 -0.7425 0.5120 -0.4319 -0.1532 -0.7575 -0.6346 49.578 38.329 16.138 199 ASP A 50 ASP~? 242 GLU A 65 GLU~? 329 ASP A 132 ASP~?