*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 12 3 RMSD = 0.98 A TRANSFORM 0.0887 -0.9580 0.2728 -0.2856 0.2379 0.9284 -0.9542 -0.1603 -0.2525 84.139 77.775 119.684 A 50 ASP B 150 ASP~? A 327 GLU C 50 GLU.? A 339 ARG C 49 ARG~? ULMNm 3 1emh_d00 HYDROLASE/DNA user 7 3 RMSD = 1.07 A TRANSFORM 0.8075 0.2667 -0.5262 0.2675 -0.9605 -0.0764 -0.5258 -0.0790 -0.8469 5.700 4.327 -28.373 A 271 PRO C 134 PRO~? A 272 LEU C 135 LEU~? A 276 ARG C 149 ARG~? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 RMSD = 1.12 A TRANSFORM 0.0126 -0.2730 -0.9619 0.6210 0.7561 -0.2064 0.7837 -0.5948 0.1791 -83.545 16.417 -6.249 B 114 HIS C 87 HIS.? B 197 ASP C 89 ASP.? B 223 ALA C 83 ALA.? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.13 A TRANSFORM -0.0801 -0.5523 0.8298 -0.1272 0.8313 0.5410 -0.9886 -0.0622 -0.1368 -45.428 28.503 -24.672 B 114 HIS B 87 HIS.? B 197 ASP B 89 ASP.? B 223 ALA B 83 ALA.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 RMSD = 1.13 A TRANSFORM -0.0009 0.2646 0.9644 -0.7377 -0.6513 0.1780 0.6752 -0.7112 0.1958 -10.063 -21.668 -9.881 A 114 HIS C 87 HIS.? A 197 ASP C 89 ASP.? A 223 ALA C 83 ALA.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.14 A TRANSFORM 0.6264 -0.1852 0.7572 -0.3519 -0.9339 0.0627 0.6955 -0.3057 -0.6502 23.984 29.941 -6.846 A 229 ALA A 122 ALA~? A 257 ALA A 123 ALA~? A 328 ASP B 59 ASP.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 RMSD = 1.14 A TRANSFORM 0.0656 0.5516 -0.8315 0.2829 -0.8094 -0.5146 -0.9569 -0.2014 -0.2091 -48.442 -30.777 -29.443 A 114 HIS B 87 HIS.? A 197 ASP B 89 ASP.? A 223 ALA B 83 ALA.? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 4 3 RMSD = 1.14 A TRANSFORM -0.8615 0.1225 -0.4928 -0.0953 0.9142 0.3938 0.4988 0.3862 -0.7759 35.522 79.486 33.072 A 757 ASP B 89 ASP.? A 759 HIS B 87 HIS.? A 810 SER B 54 SER~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 7 3 RMSD = 1.15 A TRANSFORM 0.6785 -0.4730 0.5620 0.5939 0.8035 -0.0407 -0.4323 0.3614 0.8262 68.378 73.831 61.820 A 757 ASP C 89 ASP.? A 759 HIS C 87 HIS.? A 810 SER C 54 SER~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.16 A TRANSFORM 0.9771 0.1821 0.1105 0.1361 -0.1345 -0.9815 -0.1638 0.9740 -0.1562 20.950 77.250 38.665 A 757 ASP A 89 ASP.? A 759 HIS A 87 HIS.? A 810 SER A 54 SER~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 4 3 RMSD = 1.16 A TRANSFORM -0.0705 -0.6397 0.7654 0.4573 -0.7027 -0.5451 0.8865 0.3116 0.3421 -13.015 47.776 8.959 B 757 ASP B 89 ASP.? B 759 HIS B 87 HIS.? B 810 SER B 54 SER~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 7 3 RMSD = 1.17 A TRANSFORM -0.0537 -0.3523 -0.9344 -0.8424 -0.4864 0.2318 -0.5361 0.7996 -0.2706 -49.612 56.851 -13.771 B 757 ASP C 89 ASP.? B 759 HIS C 87 HIS.? B 810 SER C 54 SER~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.17 A TRANSFORM -0.2799 -0.8879 0.3650 -0.3912 0.4527 0.8012 -0.8767 0.0815 -0.4741 -11.547 54.997 22.899 B 757 ASP A 89 ASP.? B 759 HIS A 87 HIS.? B 810 SER A 54 SER~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 10 3 RMSD = 1.21 A TRANSFORM 0.6831 0.4191 0.5982 0.4621 0.3862 -0.7983 -0.5656 0.8217 0.0701 34.123 -14.129 -4.905 141 ASP C 155 ASP~? 166 GLY C 53 GLY~? 169 GLU C 50 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.21 A TRANSFORM 0.6356 0.3474 -0.6894 -0.1194 -0.8380 -0.5324 -0.7628 0.4207 -0.4911 -0.151 19.879 17.072 141 ASP A 155 ASP~? 166 GLY A 53 GLY~? 169 GLU A 50 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.22 A TRANSFORM -0.4169 0.8701 -0.2630 -0.0978 0.2448 0.9646 0.9037 0.4279 -0.0170 8.490 20.045 3.417 141 ASP B 155 ASP~? 166 GLY B 53 GLY~? 169 GLU B 50 GLU.? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 RMSD = 1.25 A TRANSFORM 0.2374 -0.9478 -0.2130 -0.0324 -0.2269 0.9734 -0.9709 -0.2241 -0.0846 -55.724 9.027 -27.799 B 114 HIS B 90 HIS~? B 197 ASP B 89 ASP.? B 223 ALA B 83 ALA.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 RMSD = 1.26 A TRANSFORM -0.2516 0.9443 0.2120 0.1854 0.2620 -0.9471 -0.9499 -0.1989 -0.2410 -38.199 -11.027 -29.584 A 114 HIS B 90 HIS~? A 197 ASP B 89 ASP.? A 223 ALA B 83 ALA.? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 10 3 RMSD = 1.26 A TRANSFORM -0.6859 -0.7102 -0.1589 0.1632 0.0627 -0.9846 0.7092 -0.7012 0.0729 -60.058 -32.109 -13.264 B 114 HIS C 90 HIS~? B 197 ASP C 89 ASP.? B 223 ALA C 83 ALA.? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 10 3 RMSD = 1.27 A TRANSFORM 0.6962 0.6998 0.1597 -0.2719 0.0511 0.9610 0.6644 -0.7125 0.2259 -33.663 27.292 -8.769 A 114 HIS C 90 HIS~? A 197 ASP C 89 ASP.? A 223 ALA C 83 ALA.? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 13 3 RMSD = 1.28 A TRANSFORM 0.9800 0.1712 0.1013 0.1296 -0.1631 -0.9781 -0.1509 0.9716 -0.1820 -8.604 24.856 92.000 B 130 SER B 0 SER~? B 166 PHE C 36 PHE.? B 182 PHE C 147 PHE~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.29 A TRANSFORM -0.1679 0.7355 -0.6564 -0.9388 -0.3224 -0.1211 -0.3007 0.5959 0.7447 25.093 28.032 23.299 A 156 HIS A 131 HIS~? A 208 ASP A 59 ASP.? A 296 SER A 45 SER~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 15 3 RMSD = 1.30 A TRANSFORM -0.4640 -0.6326 -0.6201 0.4363 0.4461 -0.7815 0.7709 -0.6331 0.0690 61.111 42.856 136.939 A 50 ASP C 150 ASP~? A 327 GLU B 50 GLU.? A 339 ARG B 49 ARG~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 RMSD = 1.30 A TRANSFORM -0.2713 0.8545 -0.4430 -0.7688 -0.4693 -0.4344 -0.5791 0.2227 0.7843 51.294 42.351 17.720 A 229 ALA A 123 ALA~? A 257 ALA A 122 ALA~? A 328 ASP B 59 ASP.? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 13 3 RMSD = 1.31 A TRANSFORM -0.6509 -0.7582 0.0386 -0.1326 0.1636 0.9776 -0.7475 0.6312 -0.2070 -37.329 76.666 34.394 D 130 SER B 0 SER~? D 166 PHE C 36 PHE.? D 182 PHE C 147 PHE~? ULMNm 3 2odj_o00 PORIN D user 7 3 RMSD = 1.33 A TRANSFORM -0.1338 0.7762 0.6162 -0.5840 0.4406 -0.6818 -0.8007 -0.4510 0.3943 37.615 -22.573 32.850 A 156 HIS C 131 HIS~? A 208 ASP C 59 ASP.? A 296 SER C 45 SER~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 13 3 RMSD = 1.33 A TRANSFORM 0.5926 0.6061 -0.5305 0.2241 0.5086 0.8313 0.7737 -0.6115 0.1656 -9.043 85.105 62.797 C 130 SER B 0 SER~? C 166 PHE C 36 PHE.? C 182 PHE C 147 PHE~? ULMNm 3 2odj_o00 PORIN D user 4 3 RMSD = 1.34 A TRANSFORM 0.4569 0.8040 -0.3806 0.7824 -0.1598 0.6019 0.4231 -0.5728 -0.7021 20.326 14.165 17.370 A 156 HIS B 131 HIS~? A 208 ASP B 59 ASP.? A 296 SER B 45 SER~? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 4 3 RMSD = 1.36 A TRANSFORM 0.5157 -0.2695 -0.8133 -0.7675 0.2765 -0.5783 0.3807 0.9225 -0.0642 -47.872 -18.075 -24.938 B 8 HIS C 18 HIS~? B 80 GLU C 23 GLU.? B 223 ARG C 126 ARG~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.36 A TRANSFORM -0.2578 -0.9338 0.2482 0.3576 -0.3309 -0.8733 0.8976 -0.1364 0.4193 -3.368 38.710 131.455 A 70 ALA A 130 ALA~? A 126 LEU A 132 LEU~? A 158 GLU A 94 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.36 A TRANSFORM 0.1803 0.4270 -0.8861 -0.8871 0.4597 0.0411 0.4249 0.7786 0.4617 26.894 6.694 134.283 C 70 ALA A 83 ALA.? C 126 LEU A 86 LEU.? C 158 GLU A 85 GLU.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.36 A TRANSFORM -0.0969 0.7380 0.6678 -0.3970 -0.6439 0.6541 0.9127 -0.2017 0.3554 -41.364 3.068 134.143 B 70 ALA A 130 ALA~? B 126 LEU A 132 LEU~? B 158 GLU A 94 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.37 A TRANSFORM -0.3706 -0.9015 0.2235 0.8996 -0.2885 0.3279 -0.2311 0.3226 0.9179 -38.510 -16.114 130.029 B 70 ALA A 92 ALA~? B 126 LEU A 86 LEU.? B 158 GLU A 85 GLU.? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 13 3 RMSD = 1.37 A TRANSFORM -0.9518 -0.0613 0.3006 -0.2305 -0.5039 -0.8325 0.2025 -0.8616 0.4655 -48.429 16.294 95.216 A 130 SER B 0 SER~? A 166 PHE C 36 PHE.? A 182 PHE C 147 PHE~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 14 3 RMSD = 1.37 A TRANSFORM -0.1171 -0.5478 0.8284 -0.3668 0.7990 0.4765 -0.9229 -0.2481 -0.2945 -4.687 44.809 146.089 A 70 ALA B 130 ALA~? A 126 LEU B 132 LEU~? A 158 GLU B 94 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.37 A TRANSFORM 0.7122 -0.5400 0.4484 0.6114 0.1633 -0.7743 0.3449 0.8256 0.4465 -28.537 44.817 134.975 A 70 ALA A 83 ALA.? A 126 LEU A 86 LEU.? A 158 GLU A 85 GLU.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 16 3 RMSD = 1.37 A TRANSFORM -0.0562 -0.1936 -0.9795 0.6948 -0.7121 0.1009 -0.7170 -0.6749 0.1745 -81.385 14.478 135.040 B 70 ALA C 92 ALA~? B 126 LEU C 86 LEU.? B 158 GLU C 85 GLU.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 10 3 RMSD = 1.37 A TRANSFORM 0.0258 -0.5404 0.8410 -0.9650 -0.2331 -0.1201 0.2609 -0.8085 -0.5275 -41.674 -1.449 125.996 B 70 ALA B 92 ALA~? B 126 LEU B 86 LEU.? B 158 GLU B 85 GLU.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 21 3 RMSD = 1.37 A TRANSFORM 0.0605 -0.2621 -0.9631 0.7908 0.6014 -0.1139 0.6091 -0.7548 0.2437 -42.038 39.539 167.819 A 70 ALA C 130 ALA~? A 126 LEU C 132 LEU~? A 158 GLU C 94 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 RMSD = 1.37 A TRANSFORM -0.8508 0.2005 0.4857 0.3170 -0.5414 0.7787 0.4191 0.8165 0.3971 -33.785 -21.823 137.251 B 70 ALA A 83 ALA.? B 126 LEU A 86 LEU.? B 158 GLU A 85 GLU.? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 14 3 RMSD = 1.38 A TRANSFORM 0.2894 -0.4386 -0.8508 0.0767 -0.8754 0.4773 -0.9541 -0.2034 -0.2197 -44.613 -1.041 149.165 B 70 ALA B 130 ALA~? B 126 LEU B 132 LEU~? B 158 GLU B 94 GLU~? ULMNm 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 21 3 RMSD = 1.38 A TRANSFORM -0.6556 -0.4574 0.6008 -0.3396 -0.5320 -0.7756 0.6744 -0.7125 0.1934 -19.444 -30.623 168.823 B 70 ALA C 130 ALA~? B 126 LEU C 132 LEU~? B 158 GLU C 94 GLU~? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.39 A TRANSFORM 0.9533 0.2144 0.2129 -0.1504 0.9477 -0.2814 -0.2621 0.2362 0.9357 -21.619 45.532 127.575 A 70 ALA A 92 ALA~? A 126 LEU A 86 LEU.? A 158 GLU A 85 GLU.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 RMSD = 1.39 A TRANSFORM -0.6049 0.7235 -0.3326 -0.7766 -0.6284 0.0455 -0.1761 0.2858 0.9420 23.846 -0.259 127.507 C 70 ALA A 92 ALA~? C 126 LEU A 86 LEU.? C 158 GLU A 85 GLU.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 16 3 RMSD = 1.39 A TRANSFORM 0.5977 -0.5495 0.5837 -0.3586 0.4680 0.8077 -0.7170 -0.6921 0.0827 26.473 67.561 128.654 A 70 ALA C 92 ALA~? A 126 LEU C 86 LEU.? A 158 GLU C 85 GLU.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 17 3 RMSD = 1.40 A TRANSFORM -0.6194 0.6653 0.4168 -0.4107 0.1779 -0.8942 -0.6691 -0.7251 0.1630 19.350 -52.599 133.801 C 70 ALA C 92 ALA~? C 126 LEU C 86 LEU.? C 158 GLU C 85 GLU.? ULMNm 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 10 3 RMSD = 1.40 A TRANSFORM -0.8364 0.0321 -0.5471 0.4827 0.5158 -0.7077 0.2595 -0.8561 -0.4470 -7.529 40.579 123.307 A 70 ALA B 92 ALA~? A 126 LEU B 86 LEU.? A 158 GLU B 85 GLU.? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 8 3 RMSD = 1.40 A TRANSFORM 0.4526 0.1800 -0.8734 0.1228 0.9575 0.2610 0.8832 -0.2254 0.4113 9.018 -12.232 132.850 C 70 ALA A 130 ALA~? C 126 LEU A 132 LEU~? C 158 GLU A 94 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 10 3 RMSD = 1.40 A TRANSFORM 0.8366 0.4176 -0.3545 0.5117 -0.3648 0.7779 0.1955 -0.8322 -0.5188 12.524 -10.428 124.425 C 70 ALA B 92 ALA~? C 126 LEU B 86 LEU.? C 158 GLU B 85 GLU.? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 2 3 RMSD = 1.41 A TRANSFORM -0.4816 -0.2992 0.8237 0.8659 -0.3078 0.3944 0.1355 0.9032 0.4073 -19.889 14.310 -15.894 B 8 HIS B 18 HIS~? B 80 GLU B 23 GLU.? B 223 ARG B 126 ARG~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 15 3 RMSD = 1.41 A TRANSFORM -0.2727 0.9621 -0.0081 0.2025 0.0491 -0.9781 -0.9405 -0.2684 -0.2082 15.182 -12.850 147.505 C 70 ALA B 130 ALA~? C 126 LEU B 132 LEU~? C 158 GLU B 94 GLU~? ULMNm 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 22 3 RMSD = 1.42 A TRANSFORM 0.6631 0.6400 0.3883 -0.3938 -0.1428 0.9080 0.6365 -0.7550 0.1573 29.692 23.887 165.810 C 70 ALA C 130 ALA~? C 126 LEU C 132 LEU~? C 158 GLU C 94 GLU~? ULMNm 3 1cns_c00 CHITINASE user 15 3 RMSD = 1.42 A TRANSFORM -0.7378 0.5124 -0.4395 0.2596 -0.3857 -0.8853 -0.6232 -0.7673 0.1516 -18.263 0.227 58.975 A 67 GLU B 94 GLU~? A 89 GLU B 69 GLU~? A 120 SER B 54 SER~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 5 3 RMSD = 1.43 A TRANSFORM 0.2787 -0.9216 -0.2701 0.4181 0.3696 -0.8298 0.8646 0.1183 0.4883 -20.941 68.000 5.894 B 757 ASP B 89 ASP.? B 759 HIS B 90 HIS~? B 810 SER B 54 SER~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.43 A TRANSFORM 0.6887 -0.0703 0.7216 0.7208 -0.0412 -0.6919 0.0784 0.9967 0.0223 53.237 9.147 -19.730 A 465 GLY C 53 GLY~? A 501 ASP C 40 ASP.? B 367 TYR C 118 TYR~? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.43 A TRANSFORM 0.9156 0.3685 0.1608 -0.3978 0.8881 0.2302 -0.0580 -0.2747 0.9598 65.759 51.427 50.184 B 550 GLN A 124 GLN~? B 591 LEU A 159 LEU~? B 633 GLU A 105 GLU~? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 RMSD = 1.43 A TRANSFORM -0.7330 0.1462 -0.6643 0.6727 0.0114 -0.7398 -0.1006 -0.9892 -0.1068 79.122 43.414 50.205 B 550 GLN B 124 GLN~? B 591 LEU B 159 LEU~? B 633 GLU B 105 GLU~? ULMNm 3 1cns_c00 CHITINASE user 6 3 RMSD = 1.43 A TRANSFORM 0.9147 0.3099 -0.2594 -0.0724 0.7571 0.6493 0.3976 -0.5751 0.7150 -31.682 2.774 50.983 A 67 GLU A 94 GLU~? A 89 GLU A 69 GLU~? A 120 SER A 54 SER~? ULMNm 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7118 -0.3931 0.5820 0.6238 0.7347 -0.2667 -0.3227 0.5529 0.7682 16.385 -14.023 3.981 A 271 GLN A 124 GLN~? A 296 GLU A 105 GLU~? A 383 TYR A 158 TYR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.44 A TRANSFORM 0.8911 0.3774 -0.2519 0.3132 -0.9133 -0.2602 -0.3283 0.1530 -0.9321 4.854 25.717 -5.582 A 465 GLY A 53 GLY~? A 501 ASP A 40 ASP.? B 367 TYR A 118 TYR~? ULMNm 3 1cns_c00 CHITINASE user 21 3 RMSD = 1.44 A TRANSFORM 0.7466 -0.0786 0.6606 -0.6214 -0.4369 0.6504 0.2375 -0.8961 -0.3751 15.298 27.423 53.627 A 67 GLU C 94 GLU~? A 89 GLU C 69 GLU~? A 120 SER C 54 SER~? ULMNm 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 6 3 RMSD = 1.45 A TRANSFORM -0.8462 -0.5300 -0.0555 -0.3190 0.5870 -0.7441 0.4269 -0.6119 -0.6658 28.831 -6.448 -2.176 A 271 GLN B 124 GLN~? A 296 GLU B 105 GLU~? A 383 TYR B 158 TYR~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 1.45 A TRANSFORM -0.6910 0.5120 -0.5102 -0.5782 0.0320 0.8152 0.4337 0.8584 0.2740 17.642 32.942 -11.521 A 465 GLY B 53 GLY~? A 501 ASP B 40 ASP.? B 367 TYR B 118 TYR~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 6 3 RMSD = 1.45 A TRANSFORM -0.1266 0.0322 0.9914 -0.9902 0.0549 -0.1282 -0.0585 -0.9980 0.0250 65.047 32.560 -43.727 D 465 GLY C 53 GLY~? D 501 ASP C 40 ASP.? E 367 TYR C 118 TYR~? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.46 A TRANSFORM 0.7651 0.3807 -0.5193 0.4985 0.1603 0.8519 0.4076 -0.9107 -0.0672 40.097 128.403 121.654 C 141 GLY B 37 GLY.? C 144 GLU B 38 GLU.? C 164 GLU B 34 GLU~? ULMNm 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 RMSD = 1.46 A TRANSFORM 0.8113 0.1098 0.5743 -0.4819 0.6818 0.5504 -0.3312 -0.7232 0.6060 7.487 33.637 38.542 A 194 SER A 99 SER~? A 292 ASP B 59 ASP.? A 322 HIS A 18 HIS.? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.46 A TRANSFORM 0.9148 -0.3956 0.0819 0.0163 -0.1662 -0.9859 0.4036 0.9033 -0.1456 49.637 39.576 157.829 F 141 GLY B 37 GLY.? F 144 GLU B 38 GLU.? F 164 GLU B 34 GLU~? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.46 A TRANSFORM -0.6203 0.5524 0.5568 -0.1348 0.6243 -0.7695 -0.7727 -0.5524 -0.3128 53.852 89.232 108.892 C 141 GLY C 37 GLY.? C 144 GLU C 38 GLU.? C 164 GLU C 34 GLU~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.46 A TRANSFORM -0.9389 0.1666 -0.3013 -0.3437 -0.4050 0.8472 0.0191 0.8990 0.4375 29.209 76.684 167.424 F 141 GLY C 37 GLY.? F 144 GLU C 38 GLU.? F 164 GLU C 34 GLU~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.46 A TRANSFORM -0.6814 -0.5514 0.4814 -0.5031 -0.1249 -0.8552 0.5316 -0.8249 -0.1923 98.908 57.128 115.060 D 141 GLY B 37 GLY.? D 144 GLU B 38 GLU.? D 164 GLU B 34 GLU~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 5 3 RMSD = 1.46 A TRANSFORM -0.9690 0.1883 -0.1597 -0.1681 -0.0297 0.9853 0.1808 0.9817 0.0604 37.254 62.630 46.690 A 757 ASP B 89 ASP.? A 759 HIS B 90 HIS~? A 810 SER B 54 SER~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.46 A TRANSFORM 0.4627 -0.6594 -0.5926 0.1535 -0.5987 0.7861 -0.8731 -0.4547 -0.1758 83.665 96.864 106.404 D 141 GLY C 37 GLY.? D 144 GLU C 38 GLU.? D 164 GLU C 34 GLU~? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.46 A TRANSFORM -0.4984 0.8343 -0.2357 -0.6843 -0.5455 -0.4840 -0.5324 -0.0800 0.8427 49.980 137.869 129.603 C 141 GLY A 37 GLY.? C 144 GLU A 38 GLU.? C 164 GLU A 34 GLU~? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.46 A TRANSFORM -0.9563 0.1124 0.2701 0.2382 0.8351 0.4958 -0.1698 0.5384 -0.8254 64.803 37.791 161.974 F 141 GLY A 37 GLY.? F 144 GLU A 38 GLU.? F 164 GLU A 34 GLU~? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.46 A TRANSFORM 0.3992 -0.8242 0.4018 0.6960 0.5576 0.4524 -0.5969 0.0990 0.7962 90.565 47.513 124.468 D 141 GLY A 37 GLY.? D 144 GLU A 38 GLU.? D 164 GLU A 34 GLU~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.47 A TRANSFORM 0.2995 0.9541 0.0035 -0.8816 0.2753 0.3833 0.3648 -0.1179 0.9236 22.485 59.459 -60.476 D 465 GLY A 53 GLY~? D 501 ASP A 40 ASP.? E 367 TYR A 118 TYR~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.47 A TRANSFORM -0.3161 -0.9157 -0.2484 -0.9352 0.3447 -0.0809 0.1597 0.2067 -0.9653 77.647 56.535 47.759 C1050 GLN A 124 GLN~? C1091 LEU A 159 LEU~? C1133 GLU A 105 GLU~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 8 3 RMSD = 1.47 A TRANSFORM -0.7178 -0.6887 -0.1018 -0.3996 0.2878 0.8704 -0.5701 0.6655 -0.4818 -23.315 99.225 -24.799 B 757 ASP C 89 ASP.? B 759 HIS C 90 HIS~? B 810 SER C 54 SER~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 RMSD = 1.47 A TRANSFORM -0.0155 -0.1372 0.9904 0.9997 0.0158 0.0179 -0.0181 0.9904 0.1369 74.703 41.330 49.455 C1050 GLN B 124 GLN~? C1091 LEU B 159 LEU~? C1133 GLU B 105 GLU~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.47 A TRANSFORM 0.9357 -0.0259 0.3517 0.3294 0.4202 -0.8455 -0.1259 0.9070 0.4018 118.193 108.176 160.519 B 141 GLY C 37 GLY.? B 144 GLU C 38 GLU.? B 164 GLU C 34 GLU~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.47 A TRANSFORM -0.8448 0.5275 -0.0897 0.0033 0.1729 0.9849 0.5351 0.8318 -0.1478 97.052 145.455 153.459 B 141 GLY B 37 GLY.? B 144 GLU B 38 GLU.? B 164 GLU B 34 GLU~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 RMSD = 1.47 A TRANSFORM -0.3430 0.0599 0.9374 -0.0897 0.9913 -0.0962 -0.9350 -0.1171 -0.3346 -15.803 71.970 20.030 B 757 ASP A 89 ASP.? B 759 HIS A 90 HIS~? B 810 SER A 54 SER~? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.47 A TRANSFORM 0.9172 -0.0422 -0.3962 -0.2554 -0.8255 -0.5032 -0.3058 0.5627 -0.7680 82.701 147.533 159.774 B 141 GLY A 37 GLY.? B 144 GLU A 38 GLU.? B 164 GLU A 34 GLU~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.48 A TRANSFORM 0.5036 -0.8599 -0.0832 -0.8236 -0.4488 -0.3468 0.2608 0.2431 -0.9343 32.817 65.518 68.825 A 50 GLN A 124 GLN~? A 91 LEU A 159 LEU~? A 133 GLU A 105 GLU~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 1.48 A TRANSFORM 0.0368 0.3337 -0.9420 0.8894 -0.4407 -0.1214 -0.4556 -0.8333 -0.3130 24.602 45.126 -54.066 D 465 GLY B 53 GLY~? D 501 ASP B 40 ASP.? E 367 TYR B 118 TYR~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 RMSD = 1.48 A TRANSFORM -0.7704 -0.1180 0.6266 0.6295 0.0156 0.7769 -0.1014 0.9929 0.0622 42.442 53.690 72.011 A 50 GLN B 124 GLN~? A 91 LEU B 159 LEU~? A 133 GLU B 105 GLU~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.48 A TRANSFORM 0.0041 0.9478 0.3188 -0.2456 0.3100 -0.9185 -0.9694 -0.0746 0.2340 109.605 58.639 182.723 E 141 GLY B 37 GLY.? E 144 GLU B 38 GLU.? E 164 GLU B 34 GLU~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 3 3 RMSD = 1.48 A TRANSFORM 0.5017 0.8630 0.0591 0.1106 -0.1318 0.9851 0.8579 -0.4877 -0.1616 106.930 101.833 186.424 E 141 GLY C 37 GLY.? E 144 GLU C 38 GLU.? E 164 GLU C 34 GLU~? ULMNm 3 1vzx_c03 2.04.01.0087 user 5 3 RMSD = 1.48 A TRANSFORM 0.4695 0.7730 0.4266 -0.0926 0.5236 -0.8469 -0.8781 0.3581 0.3174 27.768 17.731 -8.337 B1314 TYR B 76 TYR~? B1317 GLU B 77 GLU~? B1365 ARG B 104 ARG~? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.49 A TRANSFORM 0.0798 0.0039 -0.9968 0.5531 0.8318 0.0475 0.8293 -0.5551 0.0642 108.580 52.021 168.390 E 141 GLY A 37 GLY.? E 144 GLU A 38 GLU.? E 164 GLU A 34 GLU~? ULMNm 3 1vzx_c03 2.04.01.0087 user 9 3 RMSD = 1.49 A TRANSFORM 0.0342 0.9877 -0.1524 0.1247 0.1470 0.9812 0.9916 -0.0525 -0.1181 12.070 58.387 -6.153 B1314 TYR C 76 TYR~? B1317 GLU C 77 GLU~? B1365 ARG C 104 ARG~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 8 3 RMSD = 1.50 A TRANSFORM 0.8780 -0.3775 0.2944 0.3747 0.1591 -0.9134 0.2979 0.9123 0.2811 59.283 25.036 51.613 A 757 ASP C 89 ASP.? A 759 HIS C 90 HIS~? A 810 SER C 54 SER~?