*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 0.51 A TRANSFORM 0.1260 0.9828 0.1348 0.6195 0.0282 -0.7845 -0.7748 0.1824 -0.6053 -47.781 16.297 6.855 A 99 ARG A 104 ARG~? A 101 ASP A 231 ASP.? A 132 ASP A 100 ASP.? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.53 A TRANSFORM -0.1395 -0.9769 -0.1622 -0.7168 -0.0134 0.6972 -0.6832 0.2135 -0.6983 70.616 9.106 5.484 B 99 ARG A 104 ARG~? B 101 ASP A 231 ASP.? B 132 ASP A 100 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.61 A TRANSFORM 0.1165 0.9838 0.1365 0.6381 0.0312 -0.7693 -0.7611 0.1767 -0.6241 -47.921 15.974 7.249 A 99 ARG A 104 ARG~? A 101 ASP A 231 ASP.? A 132 ASP A 100 ASP.? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 0.62 A TRANSFORM -0.1123 -0.9823 -0.1497 -0.7094 -0.0262 0.7043 -0.6958 0.1853 -0.6939 70.787 9.623 7.280 B 99 ARG A 104 ARG~? B 101 ASP A 231 ASP.? B 132 ASP A 100 ASP.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.82 A TRANSFORM 0.2144 0.9717 0.0993 0.1291 0.0726 -0.9890 -0.9682 0.2248 -0.1099 -30.054 -90.879 -127.476 A 420 ALA A 45 ALA~? B 182 GLY A 38 GLY.? B 183 GLY A 37 GLY.? ULMNm 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 RMSD = 0.91 A TRANSFORM 0.4155 -0.0080 0.9096 -0.3992 0.8969 0.1902 -0.8173 -0.4421 0.3695 9.522 -63.085 121.703 A 16 TYR A 112 TYR~? A 40 ASP A 230 ASP.? A 103 ASP A 228 ASP~? ULMNm 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 RMSD = 0.93 A TRANSFORM 0.3370 -0.0543 0.9399 0.3933 -0.8990 -0.1929 0.8554 0.4347 -0.2816 14.302 26.012 23.515 B 16 TYR A 112 TYR~? B 40 ASP A 230 ASP.? B 103 ASP A 228 ASP~? ULMNm 3 1wbf_p00 PROTEIN (AGGLUTININ) user 1 3 RMSD = 0.95 A TRANSFORM -0.9766 0.2116 0.0378 0.2141 0.9730 0.0863 -0.0185 0.0924 -0.9956 -5.771 -83.298 28.393 A 44 ASN A 63 ASN~? A 213 PRO A 60 PRO~? A 219 ASN A 53 ASN~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 0.97 A TRANSFORM 0.0126 -0.9690 -0.2466 0.8149 0.1529 -0.5591 0.5795 -0.1939 0.7916 109.744 -113.036 -136.169 A 420 ALA A 71 ALA~? B 182 GLY A 37 GLY.? B 183 GLY A 38 GLY.? ULMNm 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 RMSD = 1.04 A TRANSFORM 0.3695 -0.0988 -0.9240 -0.3148 -0.9488 -0.0244 -0.8743 0.2999 -0.3817 28.485 95.865 8.862 A 10 ASP A 36 ASP~? A 186 ASN A 44 ASN~? A 260 ALA A 50 ALA~? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 RMSD = 1.11 A TRANSFORM -0.9336 -0.3580 0.0140 0.3581 -0.9335 0.0150 0.0077 0.0190 0.9998 40.011 63.217 35.199 B 16 TYR A 83 TYR^? B 40 ASP A 231 ASP.? B 103 LEU A 109 LEU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.12 A TRANSFORM -0.3941 0.6398 0.6598 -0.8170 0.0850 -0.5704 -0.4210 -0.7638 0.4892 -36.161 2.924 197.107 C 70 ALA A 33 ALA~? C 126 LEU A 32 LEU~? C 158 GLU A 80 GLU^? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 RMSD = 1.12 A TRANSFORM -0.9090 -0.3792 -0.1728 -0.3838 0.9234 -0.0071 0.1623 0.0599 -0.9849 38.894 -26.157 7.346 A 16 TYR A 83 TYR^? A 40 ASP A 231 ASP.? A 103 LEU A 109 LEU~? ULMNm 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 RMSD = 1.13 A TRANSFORM -0.5603 0.3413 0.7547 0.7690 0.5529 0.3209 -0.3078 0.7602 -0.5722 -12.974 -54.112 -15.793 C 124 ALA A 234 ALA^? C 126 ARG A 203 ARG^? C 138 GLU A 227 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.13 A TRANSFORM 0.8616 -0.4610 0.2124 0.0475 0.4899 0.8705 -0.5053 -0.7399 0.4440 11.767 -6.013 196.023 A 70 ALA A 33 ALA~? A 126 LEU A 32 LEU~? A 158 GLU A 80 GLU^? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.14 A TRANSFORM 0.1845 0.8984 0.3985 -0.9625 0.0830 0.2584 0.1991 -0.4312 0.8800 -56.793 -2.183 165.449 C 70 ALA A 29 ALA~? C 126 LEU A 32 LEU~? C 158 GLU A 80 GLU^? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.14 A TRANSFORM -0.5169 -0.2615 -0.8151 0.7201 -0.6477 -0.2488 -0.4629 -0.7156 0.5231 -4.355 38.857 195.365 B 70 ALA A 33 ALA~? B 126 LEU A 32 LEU~? B 158 GLU A 80 GLU^? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.15 A TRANSFORM 0.1662 0.7956 0.5826 -0.1597 0.6047 -0.7803 -0.9731 0.0367 0.2276 12.869 -37.835 4.139 A 37 ASP A 229 ASP.? A 56 ILE A 81 ILE^? A 82 TYR A 83 TYR^? ULMNm 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 RMSD = 1.16 A TRANSFORM 0.9549 0.2924 -0.0511 -0.1097 0.5076 0.8546 0.2758 -0.8105 0.5168 -46.635 -28.346 102.072 F 124 ALA A 234 ALA^? F 126 ARG A 203 ARG^? F 138 GLU A 227 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.17 A TRANSFORM 0.7564 -0.5581 -0.3413 0.6445 0.7249 0.2431 0.1117 -0.4038 0.9080 23.618 -22.358 163.562 A 70 ALA A 29 ALA~? A 126 LEU A 32 LEU~? A 158 GLU A 80 GLU^? ULMNm 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 RMSD = 1.17 A TRANSFORM -0.3960 -0.6091 -0.6872 0.8920 -0.0776 -0.4453 0.2179 -0.7893 0.5740 44.631 -14.761 102.020 D 124 ALA A 234 ALA^? D 126 ARG A 203 ARG^? D 138 GLU A 227 GLU~? ULMNm 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 RMSD = 1.18 A TRANSFORM -0.3947 -0.6068 -0.6899 -0.8960 0.0879 0.4353 -0.2035 0.7900 -0.5784 44.484 16.743 -20.081 B 124 ALA A 234 ALA^? B 126 ARG A 203 ARG^? B 138 GLU A 227 GLU~? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.18 A TRANSFORM 0.1059 0.2669 0.9579 -0.1589 0.9555 -0.2487 -0.9816 -0.1259 0.1436 -45.874 -12.107 4.258 A 81 ASP A 36 ASP~? A 99 GLY A 37 GLY.? A 125 ASN A 44 ASN~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.18 A TRANSFORM 0.1603 0.7929 0.5879 -0.1296 0.6073 -0.7838 -0.9785 0.0494 0.2001 15.964 -54.696 -24.241 B 37 ASP A 229 ASP.? B 56 ILE A 81 ILE^? B 82 TYR A 83 TYR^? ULMNm 3 2dbt_c01 CHITINASE C user 1 3 RMSD = 1.19 A TRANSFORM 0.0755 0.7790 0.6225 0.7931 0.3315 -0.5110 -0.6044 0.5323 -0.5927 9.193 38.161 4.064 B 147 GLU A 84 GLU^? B 156 GLU A 96 GLU^? B 194 ASN A 132 ASN^? ULMNm 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 RMSD = 1.20 A TRANSFORM -0.5787 0.3212 0.7497 -0.7495 -0.5717 -0.3336 0.3215 -0.7550 0.5716 -11.556 57.370 97.450 E 124 ALA A 234 ALA^? E 126 ARG A 203 ARG^? E 138 GLU A 227 GLU~? ULMNm 3 2dbt_c00 CHITINASE C user 1 3 RMSD = 1.20 A TRANSFORM -0.2083 -0.4986 -0.8414 0.9075 0.2222 -0.3564 0.3646 -0.8379 0.4062 100.895 -6.477 38.780 A 147 GLU A 84 GLU^? A 156 GLU A 96 GLU^? A 194 ASN A 132 ASN^? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 RMSD = 1.21 A TRANSFORM 0.7995 0.4716 0.3719 -0.6006 0.6255 0.4980 0.0022 -0.6215 0.7834 1.465 -32.794 46.320 A 67 ASP A 36 ASP~? A 68 ALA A 33 ALA~? A 72 LEU A 47 LEU~? ULMNm 3 2dbt_c02 CHITINASE C user 1 3 RMSD = 1.22 A TRANSFORM 0.3642 0.1307 0.9221 -0.7970 -0.4684 0.3812 0.4818 -0.8738 -0.0664 28.103 60.713 44.352 C 147 GLU A 84 GLU^? C 156 GLU A 96 GLU^? C 194 ASN A 132 ASN^? ULMNm 3 1vom_c00 MYOSIN user 1 3 RMSD = 1.23 A TRANSFORM -0.6744 0.6903 0.2621 -0.5378 -0.2161 -0.8149 -0.5059 -0.6905 0.5170 45.993 73.062 14.857 233 ASN A 132 ASN^? 457 GLY A 177 GLY^? 459 GLU A 165 GLU^? ULMNm 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.23 A TRANSFORM -0.8568 -0.5130 -0.0523 0.5144 -0.8574 -0.0174 -0.0359 -0.0418 0.9985 37.191 98.152 35.018 C 137 ARG A 203 ARG^? C 141 THR A 237 THR^? C 235 ASP A 178 ASP^? ULMNm 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.23 A TRANSFORM -0.9815 -0.1877 0.0367 -0.1883 0.9152 -0.3563 0.0333 -0.3566 -0.9337 29.950 -27.860 29.678 A 16 TYR A 83 TYR^? A 40 ASP A 229 ASP.? A 103 LEU A 109 LEU~? ULMNm 3 1vom_c00 MYOSIN user 2 3 RMSD = 1.23 A TRANSFORM 0.0125 0.9961 0.0870 -0.8577 0.0554 -0.5112 -0.5141 -0.0683 0.8550 8.872 70.130 -24.101 233 ASN A 180 ASN.? 457 GLY A 162 GLY.? 459 GLU A 164 GLU^? ULMNm 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 RMSD = 1.25 A TRANSFORM -0.9755 -0.0968 0.1975 0.1650 -0.9159 0.3659 0.1455 0.3895 0.9095 27.242 64.415 15.112 B 16 TYR A 83 TYR^? B 40 ASP A 229 ASP.? B 103 LEU A 109 LEU~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.27 A TRANSFORM 0.0873 0.9768 -0.1955 -0.8807 -0.0160 -0.4734 -0.4656 0.2135 0.8589 -23.514 -80.863 -151.688 A 420 ALA A 33 ALA~? B 182 GLY A 38 GLY.? B 183 GLY A 37 GLY.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.31 A TRANSFORM 0.0717 0.9432 -0.3243 0.9910 -0.0304 0.1306 0.1133 -0.3307 -0.9369 -58.434 -38.462 169.942 C 70 ALA A 56 ALA~? C 126 LEU A 197 LEU.? C 158 GLU A 138 GLU^? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 RMSD = 1.32 A TRANSFORM 0.8229 -0.5060 0.2583 -0.5516 -0.8205 0.1501 0.1360 -0.2660 -0.9543 -29.447 76.891 166.048 B 70 ALA A 56 ALA~? B 126 LEU A 197 LEU.? B 158 GLU A 138 GLU^? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.33 A TRANSFORM -0.8816 -0.4706 -0.0350 -0.4249 0.8237 -0.3754 0.2055 -0.3161 -0.9262 55.996 -5.715 164.822 A 70 ALA A 56 ALA~? A 126 LEU A 197 LEU.? A 158 GLU A 138 GLU^? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 1 3 RMSD = 1.34 A TRANSFORM -0.8644 -0.5023 -0.0214 0.2313 -0.4352 0.8701 -0.4464 0.7472 0.4924 29.617 61.801 -37.759 A1132 ASP A 62 ASP~? A1134 ALA A 66 ALA~? A1137 ASN A 63 ASN~? ULMNm 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.35 A TRANSFORM 0.8597 0.5095 0.0377 -0.5106 0.8594 0.0279 -0.0182 -0.0433 0.9989 -36.961 62.764 34.566 A 137 ARG A 203 ARG^? A 141 THR A 237 THR^? A 235 ASP A 178 ASP^? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.35 A TRANSFORM 0.2908 -0.9031 0.3159 -0.7773 -0.0305 0.6284 -0.5579 -0.4283 -0.7108 68.082 28.568 43.360 A 99 ARG A 104 ARG~? A 101 ASP A 100 ASP.? A 132 ASP A 231 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.39 A TRANSFORM -0.3367 -0.9323 -0.1319 -0.9400 0.3410 -0.0104 0.0547 0.1205 -0.9912 96.568 12.998 46.954 A 316 ALA A 34 ALA~? A 317 GLY A 37 GLY.? A 318 ASP A 36 ASP~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 RMSD = 1.42 A TRANSFORM -0.9644 0.2458 -0.0972 0.2633 0.8611 -0.4350 -0.0232 -0.4451 -0.8952 53.946 -71.514 -6.637 B 37 ASP A 231 ASP.? B 56 ILE A 106 ILE~? B 82 TYR A 83 TYR^? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.42 A TRANSFORM -0.0561 0.4084 0.9111 0.7611 0.6081 -0.2257 -0.6462 0.6807 -0.3450 -20.575 0.254 94.768 D 1 ALA A 87 ALA^? D 74 ASN A 88 ASN.? D 75 GLY A 118 GLY.? ULMNm 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 RMSD = 1.42 A TRANSFORM -0.8331 -0.5530 -0.0087 -0.5462 0.8251 -0.1447 0.0873 -0.1158 -0.9894 36.058 65.363 108.259 D 137 ARG A 203 ARG^? D 141 THR A 237 THR^? D 235 ASP A 178 ASP^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.42 A TRANSFORM -0.3556 -0.4641 0.8113 -0.9314 0.1034 -0.3491 0.0781 -0.8797 -0.4690 82.033 133.200 184.346 C 141 GLY A 177 GLY^? C 144 GLU A 164 GLU^? C 164 GLU A 165 GLU^? ULMNm 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 3 RMSD = 1.42 A TRANSFORM -0.1956 -0.9594 0.2033 -0.7499 0.2799 0.5995 -0.6320 -0.0352 -0.7742 127.237 63.708 76.517 C 95 ASP A 224 ASP~? C 117 GLU A 227 GLU~? C 131 GLU A 220 GLU~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.42 A TRANSFORM 0.3764 0.2844 -0.8817 0.9255 -0.0721 0.3718 0.0422 -0.9560 -0.2904 69.885 50.336 184.305 D 141 GLY A 177 GLY^? D 144 GLU A 164 GLU^? D 164 GLU A 165 GLU^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.43 A TRANSFORM -0.5362 -0.6130 -0.5803 -0.8441 0.3901 0.3679 0.0009 0.6870 -0.7266 84.368 -88.786 -161.620 A 183 GLY A 37 GLY.? B 419 GLY A 38 GLY.? B 420 ALA A 34 ALA~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.43 A TRANSFORM -0.5505 -0.8301 -0.0892 0.6540 -0.4952 0.5719 -0.5189 0.2565 0.8155 118.709 68.552 148.836 F 141 GLY A 177 GLY^? F 144 GLU A 164 GLU^? F 164 GLU A 165 GLU^? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.43 A TRANSFORM -0.7130 -0.6551 -0.2501 -0.3712 0.0500 0.9272 -0.5949 0.7539 -0.2788 77.143 28.734 2.392 B 1 ALA A 87 ALA^? B 74 ASN A 88 ASN.? B 75 GLY A 118 GLY.? ULMNm 3 2dbt_c00 CHITINASE C user 2 3 RMSD = 1.45 A TRANSFORM -0.8704 -0.1954 -0.4519 0.3582 0.3785 -0.8535 0.3378 -0.9048 -0.2594 94.886 -3.289 44.652 A 147 GLU A 84 GLU^? A 156 GLU A 96 GLU^? A 194 ASN A 238 ASN.? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.45 A TRANSFORM -0.5422 0.7275 0.4205 0.6230 0.0123 0.7821 0.5638 0.6860 -0.4599 64.946 51.223 122.432 E 141 GLY A 177 GLY^? E 144 GLU A 164 GLU^? E 164 GLU A 165 GLU^? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 RMSD = 1.46 A TRANSFORM -0.9624 0.2528 -0.0992 0.2695 0.8447 -0.4625 -0.0331 -0.4719 -0.8811 50.658 -54.238 22.623 A 37 ASP A 231 ASP.? A 56 ILE A 106 ILE~? A 82 TYR A 83 TYR^? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.47 A TRANSFORM 0.1220 0.9343 0.3349 -0.4115 0.3547 -0.8396 -0.9032 -0.0354 0.4277 -22.786 -1.674 58.127 C 1 ALA A 87 ALA^? C 74 ASN A 88 ASN.? C 75 GLY A 118 GLY.? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.47 A TRANSFORM -0.5281 -0.0956 -0.8438 0.0027 -0.9938 0.1109 -0.8492 0.0563 0.5251 2.833 106.655 140.397 A 1 ALA A 87 ALA^? A 74 ASN A 88 ASN.? A 75 GLY A 118 GLY.? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 RMSD = 1.48 A TRANSFORM -0.7970 -0.5878 -0.1388 -0.2874 0.1670 0.9431 -0.5312 0.7916 -0.3020 51.475 68.379 73.478 A 270 ASN A 114 ASN~? A 384 ASN A 212 ASN~? A 385 GLU A 214 GLU~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 RMSD = 1.48 A TRANSFORM -0.2918 -0.5521 -0.7810 0.3600 -0.8199 0.4451 -0.8862 -0.1513 0.4380 67.599 152.626 25.871 193 ASP A 100 ASP.? 231 ASP A 62 ASP~? 294 ASP A 231 ASP.? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.49 A TRANSFORM 0.4576 0.8657 0.2028 -0.6673 0.4851 -0.5652 -0.5877 0.1233 0.7996 27.049 117.417 155.387 B 141 GLY A 177 GLY^? B 144 GLU A 164 GLU^? B 164 GLU A 165 GLU^? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.49 A TRANSFORM 0.2706 -0.9561 0.1125 0.7822 0.1503 -0.6046 0.5612 0.2516 0.7885 36.162 38.447 111.872 A 1 ALA A 87 ALA^? A 74 ASN A 88 ASN.? A 75 GLY A 90 GLY.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 RMSD = 1.49 A TRANSFORM -0.5475 0.3240 0.7715 0.7879 0.5101 0.3449 -0.2818 0.7967 -0.5346 -7.196 -20.574 -71.243 A 49 ASP A 229 ASP.? A 147 THR A 105 THR~? A 294 ASP A 100 ASP.?