*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1nw9_c01 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 2 4 RMSD = 1.14 A TRANSFORM 0.4029 0.6483 -0.6461 -0.8654 0.0401 -0.4995 0.2979 -0.7603 -0.5772 19.348 50.963 133.468 B 178 ARG B 40 ARG~? B 237 HIS B 36 HIS~? B 277 GLY A 155 GLY~? B 287 CYH B 75 CYH~? ULMNm 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 1 4 RMSD = 1.24 A TRANSFORM 0.5810 0.7300 0.3598 0.8138 -0.5156 -0.2681 0.0102 -0.4486 0.8937 40.368 79.610 17.225 A 193 ALA A 58 ALA~? A 194 GLY A 57 GLY~? B 457 ALA A 96 ALA~? B 458 ALA A 93 ALA~? ULMNm 4 1nw9_c01 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 1 4 RMSD = 1.25 A TRANSFORM -0.1330 -0.7272 -0.6734 0.9886 -0.0489 -0.1424 -0.0706 0.6847 -0.7254 78.035 10.036 97.405 B 178 ARG A 40 ARG~? B 237 HIS A 36 HIS~? B 277 GLY B 155 GLY.? B 287 CYH A 75 CYH~? ULMNm 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 2 4 RMSD = 1.26 A TRANSFORM -0.6697 -0.6941 0.2639 -0.7155 0.5079 -0.4797 -0.1989 0.5101 0.8368 115.926 79.175 -8.505 A 193 ALA B 58 ALA~? A 194 GLY B 57 GLY~? B 457 ALA B 96 ALA~? B 458 ALA B 93 ALA~? ULMNm 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 1 4 RMSD = 1.27 A TRANSFORM -0.4500 -0.5134 -0.7307 -0.6614 0.7414 -0.1136 -0.6001 -0.4322 0.6731 65.005 131.799 35.738 A 457 ALA A 96 ALA~? A 458 ALA A 93 ALA~? B 193 ALA A 58 ALA~? B 194 GLY A 57 GLY~? ULMNm 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 2 4 RMSD = 1.29 A TRANSFORM 0.6198 0.4541 -0.6401 0.6466 -0.7577 0.0886 0.4447 0.4688 0.7632 8.016 152.311 -16.247 A 457 ALA B 96 ALA~? A 458 ALA B 93 ALA~? B 193 ALA B 58 ALA~? B 194 GLY B 57 GLY~? ULMNm 4 1wd8_c00 PROTEIN-ARGININE DEIMINASE TYPE IV user 2 4 RMSD = 1.42 A TRANSFORM -0.9049 0.3286 0.2706 -0.4249 -0.7356 -0.5276 -0.0257 0.5924 -0.8052 34.518 102.288 7.478 A 350 ASP B 32 ASP~? A 471 HIS B 34 HIS~? A 473 ASP B 37 ASP~? A 645 CYH B 75 CYH~? ULMNm 4 1wd8_c00 PROTEIN-ARGININE DEIMINASE TYPE IV user 1 4 RMSD = 1.46 A TRANSFORM 0.7534 -0.3759 0.5396 0.6153 0.6924 -0.3768 0.2320 -0.6159 -0.7529 16.414 32.274 43.526 A 350 ASP A 32 ASP~? A 471 HIS A 34 HIS~? A 473 ASP A 37 ASP~? A 645 CYH A 75 CYH~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 0.79 A TRANSFORM -0.9995 0.0294 -0.0103 0.0221 0.4372 -0.8991 0.0220 0.8989 0.4376 15.689 6.815 -32.750 141 ASP A 22 ASP~? 166 GLY A 138 GLY~? 169 GLU A 145 GLU~? ULMNm 3 1ddj_c14 PLASMINOGEN user 5 3 RMSD = 0.87 A TRANSFORM 0.5914 0.4309 -0.6816 -0.2822 -0.6812 -0.6755 0.7554 -0.5919 0.2812 -4.567 108.658 69.864 C 603 HIS B 119 HIS~? C 646 ASP B 86 ASP~? C 739 GLY B 78 GLY.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 RMSD = 0.90 A TRANSFORM -0.0354 0.8969 0.4408 0.6718 0.3479 -0.6539 0.7399 -0.2730 0.6149 -42.365 47.044 5.339 179 ASP B 26 ASP.? 227 GLU A 178 GLU~? 289 ASP B 32 ASP~? ULMNm 3 2odj_o00 PORIN D user 30 3 RMSD = 0.90 A TRANSFORM -0.9909 0.0735 -0.1127 -0.1302 -0.3126 0.9409 -0.0339 -0.9470 -0.3193 25.212 17.073 60.473 A 156 HIS B 142 HIS~? A 208 ASP A 28 ASP~? A 296 SER A 61 SER~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 8 3 RMSD = 0.90 A TRANSFORM 0.2908 -0.1581 -0.9436 0.7441 0.6573 0.1192 -0.6015 0.7368 -0.3088 34.262 -7.389 -32.948 A 465 GLY B 179 GLY.? A 501 ASP A 37 ASP~? B 367 TYR B 114 TYR~? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 7 3 RMSD = 0.93 A TRANSFORM -0.4238 -0.5780 -0.6973 -0.6776 -0.3084 0.6676 0.6010 -0.7555 0.2610 65.457 58.048 -31.132 D 465 GLY B 179 GLY.? D 501 ASP A 37 ASP~? E 367 TYR B 114 TYR~? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 0.94 A TRANSFORM -0.3982 -0.4706 -0.7874 0.3786 0.6975 -0.6084 -0.8355 0.5404 0.0996 49.149 50.036 66.290 C 603 HIS A 119 HIS~? C 646 ASP A 86 ASP~? C 739 GLY A 78 GLY.? ULMNm 3 1ddj_c12 PLASMINOGEN user 4 3 RMSD = 0.95 A TRANSFORM 0.5565 0.4038 -0.7261 -0.2797 -0.7319 -0.6214 0.7823 -0.5490 0.2943 0.758 110.987 3.838 A 603 HIS B 119 HIS~? A 646 ASP B 86 ASP~? A 739 GLY B 78 GLY.? ULMNm 3 1ddj_c15 PLASMINOGEN user 3 3 RMSD = 0.96 A TRANSFORM 0.4940 -0.7313 -0.4702 0.8509 0.2955 0.4345 0.1788 0.6147 -0.7682 -17.951 -0.959 42.831 D 603 HIS A 119 HIS~? D 646 ASP A 86 ASP~? D 739 GLY A 155 GLY~? ULMNm 3 2odj_o01 PORIN D user 23 3 RMSD = 0.96 A TRANSFORM -0.1270 0.4576 0.8801 0.6675 -0.6168 0.4170 -0.7337 -0.6404 0.2271 -40.464 2.045 127.736 B 156 HIS B 43 HIS~? B 208 ASP B 52 ASP~? B 296 SER B 106 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 30 3 RMSD = 0.97 A TRANSFORM -0.4744 0.0265 0.8799 0.3401 0.9275 0.1554 0.8119 -0.3730 0.4490 51.224 -37.881 -2.552 A 229 ALA B 10 ALA~? A 257 ALA B 9 ALA~? A 328 ASP B 4 ASP.? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 0.98 A TRANSFORM 0.7312 -0.3978 0.5542 -0.5570 0.1210 0.8216 0.3939 0.9095 0.1331 -50.407 27.747 14.098 D 603 HIS A 119 HIS~? D 646 ASP A 86 ASP~? D 739 GLY A 78 GLY.? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 0.98 A TRANSFORM 0.2164 0.9690 0.1194 0.6729 -0.0594 -0.7373 0.7073 -0.2399 0.6649 10.918 -26.443 -14.613 A 250 ALA A 58 ALA~? A 251 GLY A 57 GLY~? A 252 ASP A 4 ASP.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 0.99 A TRANSFORM -0.2107 0.3330 -0.9191 0.6562 -0.6487 -0.3855 0.7245 0.6844 0.0819 67.719 19.725 -36.165 A 37 ASP A 26 ASP.? A 56 ILE B 150 ILE~? A 82 TYR B 175 TYR~? ULMNm 3 2odj_o01 PORIN D user 5 3 RMSD = 1.00 A TRANSFORM -0.0081 -0.4279 0.9038 -0.7837 0.5641 0.2601 0.6211 0.7062 0.3399 -15.858 -6.953 53.468 B 156 HIS A 43 HIS~? B 208 ASP A 52 ASP~? B 296 SER A 106 SER~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.00 A TRANSFORM -0.1415 0.8557 0.4977 0.4606 -0.3881 0.7983 -0.8763 -0.3422 0.3392 0.716 19.646 51.698 A 316 ALA A 19 ALA~? A 317 GLY A 20 GLY~? A 318 ASP A 22 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 1.00 A TRANSFORM -0.6410 0.2738 0.7170 -0.1067 -0.9569 0.2701 -0.7601 -0.0966 -0.6426 23.343 -9.426 -32.643 B 250 ALA A 58 ALA~? B 251 GLY A 57 GLY~? B 252 ASP A 4 ASP.? ULMNm 3 1ddj_c13 PLASMINOGEN user 6 3 RMSD = 1.01 A TRANSFORM -0.6380 0.6080 0.4725 0.3713 -0.2946 0.8805 -0.6746 -0.7373 0.0378 -54.408 29.895 25.947 B 603 HIS B 119 HIS~? B 646 ASP B 86 ASP~? B 739 GLY B 78 GLY.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 RMSD = 1.01 A TRANSFORM -0.4765 0.8334 -0.2799 -0.7203 -0.5526 -0.4192 0.5041 -0.0019 -0.8637 26.190 29.986 -6.868 A 37 ASP B 131 ASP~? A 56 ILE B 97 ILE~? A 82 TYR B 114 TYR~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 13 3 RMSD = 1.01 A TRANSFORM -0.6635 0.2425 0.7078 0.1390 0.9695 -0.2018 0.7352 0.0355 0.6770 52.555 25.210 8.268 229 ASP B 11 ASP~? 264 GLU B 50 GLU.? 328 ASP B 4 ASP.? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.01 A TRANSFORM -0.2124 0.3394 -0.9163 0.6328 -0.6668 -0.3936 0.7446 0.6634 0.0732 70.335 4.340 -63.131 B 37 ASP A 26 ASP.? B 56 ILE B 150 ILE~? B 82 TYR B 175 TYR~? ULMNm 3 1ddj_c15 PLASMINOGEN user 5 3 RMSD = 1.02 A TRANSFORM -0.8065 0.4530 0.3799 0.3546 -0.1435 0.9239 -0.4731 -0.8799 0.0449 -43.919 19.104 92.956 D 603 HIS B 119 HIS~? D 646 ASP B 86 ASP~? D 739 GLY B 78 GLY.? ULMNm 3 2odj_o00 PORIN D user 29 3 RMSD = 1.03 A TRANSFORM -0.9759 0.2174 -0.0192 -0.0934 -0.3363 0.9371 -0.1973 -0.9163 -0.3484 19.114 17.429 61.530 A 156 HIS B 142 HIS~? A 208 ASP A 28 ASP~? A 296 SER A 60 SER~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 35 3 RMSD = 1.04 A TRANSFORM -0.5168 0.6773 -0.5236 0.8004 0.5993 -0.0147 -0.3038 0.4267 0.8518 -13.044 -36.945 -13.584 141 ASP B 102 ASP~? 166 GLY B 20 GLY~? 169 GLU A 145 GLU~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 RMSD = 1.04 A TRANSFORM -0.4710 0.8367 -0.2796 -0.7379 -0.5473 -0.3949 0.4835 -0.0203 -0.8751 28.862 13.462 -33.442 B 37 ASP B 131 ASP~? B 56 ILE B 97 ILE~? B 82 TYR B 114 TYR~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.05 A TRANSFORM -0.3563 -0.4411 -0.8237 0.3610 0.7481 -0.5568 -0.8618 0.4958 0.1073 51.026 49.280 4.315 A 603 HIS A 119 HIS~? A 646 ASP A 86 ASP~? A 739 GLY A 78 GLY.? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.06 A TRANSFORM 0.5757 -0.2585 -0.7757 0.5689 0.8081 0.1529 -0.5873 0.5294 -0.6123 156.537 -7.694 -5.429 A 316 ALA A 19 ALA~? A 317 GLY A 20 GLY~? A 318 ASP A 22 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.06 A TRANSFORM -0.1503 -0.8963 -0.4171 -0.9523 0.0180 0.3045 0.2655 -0.4430 0.8563 64.645 15.703 18.361 B 99 ARG B 73 ARG~? B 101 ASP B 69 ASP~? B 132 ASP B 86 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.06 A TRANSFORM 0.1686 0.8829 0.4383 0.9762 -0.0880 -0.1982 0.1364 -0.4613 0.8767 -41.516 11.429 20.248 A 99 ARG B 73 ARG~? A 101 ASP B 69 ASP~? A 132 ASP B 86 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.06 A TRANSFORM 0.1863 0.8966 -0.4018 0.8628 0.0463 0.5034 -0.4700 0.4404 0.7650 -1.273 -25.956 3.137 B 99 ARG A 73 ARG~? B 101 ASP A 69 ASP~? B 132 ASP A 86 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.06 A TRANSFORM -0.2095 -0.8839 0.4182 -0.9132 0.0240 -0.4068 -0.3496 0.4671 0.8122 24.393 49.808 -2.012 A 99 ARG A 73 ARG~? A 101 ASP A 69 ASP~? A 132 ASP A 86 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 1.07 A TRANSFORM 0.9531 0.0920 0.2884 0.1454 -0.9748 -0.1695 -0.2655 -0.2035 0.9424 125.705 27.725 1.723 A 316 ALA A 58 ALA~? A 317 GLY A 57 GLY~? A 318 ASP A 4 ASP.? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.08 A TRANSFORM 0.1646 0.8759 0.4535 0.9753 -0.0758 -0.2075 0.1474 -0.4765 0.8668 -41.482 10.948 21.105 A 99 ARG B 73 ARG~? A 101 ASP B 69 ASP~? A 132 ASP B 86 ASP~? ULMNm 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.08 A TRANSFORM -0.2092 -0.8765 0.4336 -0.9096 0.0116 -0.4154 -0.3591 0.4813 0.7996 23.821 50.061 -1.654 A 99 ARG A 73 ARG~? A 101 ASP A 69 ASP~? A 132 ASP A 86 ASP~? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 RMSD = 1.09 A TRANSFORM -0.1527 -0.8789 -0.4519 -0.9586 0.0205 0.2840 0.2403 -0.4765 0.8457 64.369 15.806 20.684 B 99 ARG B 73 ARG~? B 101 ASP B 69 ASP~? B 132 ASP B 86 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.09 A TRANSFORM -0.9609 0.1210 -0.2490 0.1430 0.9871 -0.0721 -0.2371 0.1049 0.9658 23.073 -47.130 -61.547 B 250 ALA A 19 ALA~? B 251 GLY A 20 GLY~? B 252 ASP A 22 ASP~? ULMNm 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 RMSD = 1.09 A TRANSFORM 0.1971 0.8788 -0.4346 0.8735 0.0439 0.4848 -0.4451 0.4752 0.7590 -0.584 -26.013 2.118 B 99 ARG A 73 ARG~? B 101 ASP A 69 ASP~? B 132 ASP A 86 ASP~? ULMNm 3 1ula_c00 PURINE NUCLEOSIDE PHOSPHORYLASE (E.Cuser 7 3 RMSD = 1.09 A TRANSFORM 0.3880 -0.8517 -0.3523 0.3276 -0.2299 0.9164 0.8615 0.4710 -0.1898 36.409 4.663 -11.434 86 HIS B 143 HIS~? 89 GLU B 146 GLU~? 243 ASN B 74 ASN~? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.10 A TRANSFORM 0.5573 -0.5633 0.6101 -0.5737 0.2700 0.7733 0.6003 0.7809 0.1727 -42.932 29.375 -52.813 B 603 HIS A 119 HIS~? B 646 ASP A 86 ASP~? B 739 GLY A 78 GLY.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 RMSD = 1.11 A TRANSFORM -0.8645 -0.1110 0.4903 -0.2409 -0.7646 -0.5978 -0.4412 0.6349 -0.6342 5.163 22.926 13.216 141 ASP A 41 ASP~? 166 GLY A 53 GLY~? 169 GLU A 95 GLU~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.12 A TRANSFORM -0.2607 -0.9144 -0.3098 0.9121 -0.3385 0.2314 0.3165 0.2222 -0.9222 55.154 -17.058 0.076 A 250 ALA A 19 ALA~? A 251 GLY A 20 GLY~? A 252 ASP A 22 ASP~? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 11 3 RMSD = 1.12 A TRANSFORM 0.0803 0.3313 0.9401 -0.9156 0.3974 -0.0618 0.3941 0.8558 -0.3352 -55.173 14.136 -80.519 B 8 HIS B 143 HIS~? B 80 GLU B 146 GLU~? B 223 ARG B 48 ARG~? ULMNm 3 1ula_c00 PURINE NUCLEOSIDE PHOSPHORYLASE (E.Cuser 9 3 RMSD = 1.12 A TRANSFORM 0.6794 0.5680 -0.4646 0.6461 -0.1629 0.7457 -0.3479 0.8068 0.4776 -17.933 1.528 -19.837 86 HIS B 147 HIS~? 89 GLU B 146 GLU~? 243 ASN B 161 ASN~? ULMNm 3 1qrz_c15 PLASMINOGEN user 2 3 RMSD = 1.13 A TRANSFORM -0.2300 0.8249 0.5164 -0.9556 -0.2918 0.0404 -0.1840 0.4841 -0.8554 -57.873 16.070 46.826 D 603 HIS A 101 HIS~? D 646 ASP A 102 ASP~? D 741 SER A 61 SER~? ULMNm 3 1ula_c00 PURINE NUCLEOSIDE PHOSPHORYLASE (E.Cuser 1 3 RMSD = 1.13 A TRANSFORM -0.3440 0.6583 -0.6695 -0.6300 0.3669 0.6845 -0.6963 -0.6572 -0.2885 5.714 7.535 58.687 86 HIS A 143 HIS~? 89 GLU A 146 GLU~? 243 ASN A 74 ASN~? ULMNm 3 1qrz_c15 PLASMINOGEN user 4 3 RMSD = 1.13 A TRANSFORM 0.0283 -0.8205 0.5710 0.9480 0.2032 0.2450 0.3171 -0.5344 -0.7835 -7.441 -40.952 67.979 D 603 HIS B 101 HIS~? D 646 ASP B 102 ASP~? D 741 SER B 61 SER~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 11 3 RMSD = 1.13 A TRANSFORM -0.5492 0.8333 -0.0627 0.6257 0.3603 -0.6918 0.5539 0.4192 0.7193 -5.439 49.682 -17.424 179 ASP A 149 ASP~? 227 GLU A 178 GLU~? 289 ASP B 26 ASP.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 33 3 RMSD = 1.14 A TRANSFORM -0.5562 0.7598 0.3365 -0.7769 -0.3317 -0.5352 0.2951 0.5591 -0.7748 18.595 80.905 -7.437 A 229 ALA B 30 ALA~? A 257 ALA B 29 ALA~? A 328 ASP B 26 ASP.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 28 3 RMSD = 1.14 A TRANSFORM 0.7459 0.0814 0.6611 0.4276 0.7025 -0.5689 0.5107 -0.7070 -0.4892 -35.155 -40.966 36.316 141 ASP B 41 ASP~? 166 GLY B 53 GLY~? 169 GLU B 95 GLU~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 18 3 RMSD = 1.14 A TRANSFORM 0.2630 0.9538 0.1453 -0.8350 0.1496 0.5295 -0.4833 0.2606 -0.8358 2.381 43.576 37.040 199 ASP B 26 ASP.? 242 GLU A 121 GLU.? 329 ASP B 32 ASP~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 4 3 RMSD = 1.15 A TRANSFORM 0.6379 -0.5428 0.5463 0.5925 0.7991 0.1022 0.4920 -0.2585 -0.8313 2.413 -48.495 11.888 274 HIS A 142 HIS~? 320 HIS A 147 HIS~? 375 ASP A 149 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 12 3 RMSD = 1.15 A TRANSFORM 0.4641 0.7639 -0.4484 -0.2055 -0.3996 -0.8934 0.8616 -0.5068 0.0285 -16.143 22.991 -10.944 141 ASP A 102 ASP~? 166 GLY A 53 GLY~? 169 GLU A 50 GLU.? ULMNm 3 1qrz_c13 PLASMINOGEN user 4 3 RMSD = 1.16 A TRANSFORM -0.3118 0.2422 0.9187 -0.9446 -0.1838 -0.2721 -0.1030 0.9526 -0.2861 -53.476 33.846 -54.348 B 603 HIS B 101 HIS~? B 646 ASP B 102 ASP~? B 741 SER B 61 SER~? ULMNm 3 1qrz_c13 PLASMINOGEN user 2 3 RMSD = 1.16 A TRANSFORM 0.1221 -0.1916 0.9738 0.9600 0.2718 -0.0669 0.2518 -0.9431 -0.2172 -50.619 -21.819 1.646 B 603 HIS A 101 HIS~? B 646 ASP A 102 ASP~? B 741 SER A 61 SER~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 9 3 RMSD = 1.17 A TRANSFORM -0.7335 0.5804 0.3536 -0.6464 -0.7565 -0.0991 -0.2099 0.3013 -0.9301 -3.643 31.429 7.241 274 HIS B 142 HIS~? 320 HIS B 147 HIS~? 375 ASP B 149 ASP~? ULMNm 3 1a0j_c03 TRYPSIN user 2 3 RMSD = 1.17 A TRANSFORM -0.6072 -0.3792 -0.6982 0.7825 -0.1331 -0.6083 -0.1377 0.9157 -0.3776 43.726 12.147 87.999 D 57 HIS A 119 HIS~? D 102 ASP A 69 ASP~? D 195 SER A 118 SER~? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 1.17 A TRANSFORM 0.3478 0.4696 0.8115 -0.0201 0.8691 -0.4943 0.9373 -0.1557 -0.3117 -10.572 10.457 31.417 A 156 HIS A 34 HIS~? A 208 ASP A 22 ASP~? A 296 SER A 61 SER~? ULMNm 3 1a0j_c01 TRYPSIN user 2 3 RMSD = 1.18 A TRANSFORM 0.1898 0.7702 -0.6089 0.9612 -0.2722 -0.0447 0.2002 0.5768 0.7920 36.444 30.061 20.687 B 57 HIS A 119 HIS~? B 102 ASP A 69 ASP~? B 195 SER A 118 SER~? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 4 3 RMSD = 1.18 A TRANSFORM 0.1660 -0.9831 -0.0775 0.2807 -0.0282 0.9594 0.9453 0.1810 -0.2712 44.713 -16.104 4.384 A 101 VAL B 151 VAL~? A 102 PHE B 157 PHE~? A 169 CYH B 130 CYH~? ULMNm 3 1qrz_c14 PLASMINOGEN user 2 3 RMSD = 1.18 A TRANSFORM -0.1626 0.8430 0.5127 -0.9701 -0.2313 0.0728 -0.1800 0.4856 -0.8555 -5.526 15.302 8.506 C 603 HIS A 101 HIS~? C 646 ASP A 102 ASP~? C 741 SER A 61 SER~? ULMNm 3 1qrz_c14 PLASMINOGEN user 4 3 RMSD = 1.19 A TRANSFORM -0.0381 -0.8326 0.5526 0.9491 0.1429 0.2807 0.3126 -0.5351 -0.7848 48.768 -37.953 29.909 C 603 HIS B 101 HIS~? C 646 ASP B 102 ASP~? C 741 SER B 61 SER~? ULMNm 3 1a0j_c02 TRYPSIN user 2 3 RMSD = 1.19 A TRANSFORM 0.6504 -0.7226 0.2343 0.7589 0.6046 -0.2421 -0.0333 -0.3353 -0.9415 29.403 16.602 99.687 C 57 HIS A 119 HIS~? C 102 ASP A 69 ASP~? C 195 SER A 118 SER~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 4 3 RMSD = 1.19 A TRANSFORM -0.6461 -0.6260 -0.4366 -0.6031 0.0682 0.7947 0.4677 -0.7768 0.4217 70.996 29.878 97.313 B 223 HIS A 142 HIS~? B 262 HIS A 147 HIS~? B 312 ASP A 149 ASP~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 42 3 RMSD = 1.19 A TRANSFORM 0.4697 -0.7953 0.3831 0.8136 0.2215 -0.5376 -0.3427 -0.5642 -0.7511 20.225 62.628 65.450 179 ASP B 149 ASP~? 214 ASP A 41 ASP~? 289 ASP A 26 ASP.? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 9 3 RMSD = 1.20 A TRANSFORM 0.7846 0.5833 -0.2103 0.3386 -0.1190 0.9334 -0.5194 0.8035 0.2909 -2.217 16.624 67.155 B 223 HIS B 142 HIS~? B 262 HIS B 147 HIS~? B 312 ASP B 149 ASP~? ULMNm 3 1a0j_c00 TRYPSIN user 2 3 RMSD = 1.21 A TRANSFORM -0.3187 0.0806 0.9444 -0.8785 -0.3993 -0.2624 -0.3560 0.9133 -0.1981 12.205 74.552 55.348 A 57 HIS A 119 HIS~? A 102 ASP A 69 ASP~? A 195 SER A 118 SER~? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 31 3 RMSD = 1.21 A TRANSFORM 0.8131 -0.2379 -0.5313 -0.2362 -0.9690 0.0724 0.5321 -0.0666 0.8441 22.746 147.434 -20.575 193 ASP B 28 ASP~? 231 ASP B 86 ASP~? 294 ASP B 22 ASP~? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 4 3 RMSD = 1.21 A TRANSFORM -0.4190 -0.9003 0.1177 0.4513 -0.3190 -0.8334 -0.7879 0.2961 -0.5400 69.695 49.239 91.097 A 223 HIS A 142 HIS~? A 262 HIS A 147 HIS~? A 312 ASP A 149 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 36 3 RMSD = 1.21 A TRANSFORM -0.4058 -0.7453 -0.5291 0.4547 0.3375 -0.8242 -0.7928 0.5751 -0.2019 51.768 -17.611 -11.364 141 ASP B 102 ASP~? 166 GLY B 53 GLY~? 169 GLU B 50 GLU.? ULMNm 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 6 3 RMSD = 1.22 A TRANSFORM -0.5577 0.5846 -0.5893 0.5346 0.7960 0.2837 -0.6349 0.1568 0.7565 -9.060 -51.123 22.991 A 317 GLU B 56 GLU.? A 319 ASP B 52 ASP~? A 359 ARG B 49 ARG.? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 9 3 RMSD = 1.22 A TRANSFORM 0.4233 0.8673 0.2620 -0.1664 0.3587 -0.9185 0.8906 -0.3452 -0.2962 -8.082 38.763 74.168 A 223 HIS B 142 HIS~? A 262 HIS B 147 HIS~? A 312 ASP B 149 ASP~? ULMNm 3 1a0j_c03 TRYPSIN user 5 3 RMSD = 1.22 A TRANSFORM 0.7601 0.3116 -0.5702 -0.6355 0.1733 -0.7524 0.1356 -0.9343 -0.3297 -10.283 30.860 142.666 D 57 HIS B 119 HIS~? D 102 ASP B 69 ASP~? D 195 SER B 118 SER~? ULMNm 3 2odj_o01 PORIN D user 27 3 RMSD = 1.22 A TRANSFORM 0.0063 0.9601 0.2796 0.2787 0.2668 -0.9226 0.9604 -0.0837 0.2659 -37.602 -8.021 62.170 B 156 HIS B 142 HIS~? B 208 ASP A 28 ASP~? B 296 SER A 61 SER~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.22 A TRANSFORM -0.7999 -0.1692 0.5758 -0.5742 0.4945 -0.6525 0.1743 0.8526 0.4927 25.552 77.215 28.694 C 603 HIS A 119 HIS~? C 646 ASP A 86 ASP~? C 739 GLY A 155 GLY~? ULMNm 3 1a0j_c01 TRYPSIN user 5 3 RMSD = 1.23 A TRANSFORM -0.1276 -0.7717 -0.6231 -0.9092 0.3421 -0.2374 -0.3963 -0.5362 0.7453 92.971 49.650 72.425 B 57 HIS B 119 HIS~? B 102 ASP B 69 ASP~? B 195 SER B 118 SER~? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 RMSD = 1.23 A TRANSFORM -0.1304 0.9850 -0.1130 -0.4725 0.0384 0.8805 -0.8716 -0.1682 -0.4604 -14.993 -4.221 57.110 A 101 VAL A 151 VAL~? A 102 PHE A 157 PHE~? A 169 CYH A 130 CYH~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 16 3 RMSD = 1.23 A TRANSFORM -0.3729 0.8884 -0.2679 0.4649 -0.0710 -0.8825 0.8030 0.4536 0.3865 46.852 32.806 -15.367 A 229 ALA A 47 ALA~? A 257 ALA A 46 ALA~? A 328 ASP A 52 ASP~? ULMNm 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 5 3 RMSD = 1.24 A TRANSFORM -0.0599 -0.2523 -0.9658 0.9421 0.3054 -0.1383 -0.3299 0.9182 -0.2194 35.518 -24.744 26.464 B 317 GLU A 145 GLU~? B 319 ASP A 149 ASP~? B 359 ARG A 153 ARG~? ULMNm 3 1a0j_c02 TRYPSIN user 5 3 RMSD = 1.24 A TRANSFORM -0.6242 0.7760 0.0907 -0.7424 -0.5529 -0.3783 0.2434 0.3034 -0.9213 7.530 86.656 70.198 C 57 HIS B 119 HIS~? C 102 ASP B 69 ASP~? C 195 SER B 118 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 38 3 RMSD = 1.24 A TRANSFORM 0.3805 -0.9101 -0.1643 -0.2572 0.0665 -0.9641 -0.8883 -0.4091 0.2088 89.395 41.823 51.449 A 229 ALA B 47 ALA~? A 257 ALA B 46 ALA~? A 328 ASP B 52 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 RMSD = 1.24 A TRANSFORM 0.8497 0.3106 0.4261 0.4932 -0.1822 -0.8506 0.1866 -0.9329 0.3080 -11.066 52.779 103.048 A 241 ASP A 22 ASP~? A 265 GLU B 172 GLU~? A 369 ASP A 28 ASP~? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 14 3 RMSD = 1.25 A TRANSFORM -0.0809 0.8920 -0.4448 -0.9846 -0.1409 -0.1036 0.1551 -0.4295 -0.8896 35.518 74.941 43.694 199 ASP A 149 ASP~? 242 GLU A 167 GLU.? 329 ASP B 26 ASP.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 1 3 RMSD = 1.25 A TRANSFORM 0.3110 0.9465 0.0867 0.0301 -0.1009 0.9944 -0.9499 0.3066 0.0599 -26.685 -25.793 -11.653 14 ASP A 37 ASP~? 16 HIS A 34 HIS~? 67 GLY B 179 GLY.? ULMNm 3 1dco_c00 DCOH user 5 3 RMSD = 1.25 A TRANSFORM 0.3657 -0.4653 0.8061 -0.5952 0.5489 0.5869 0.7155 0.6944 0.0763 51.393 11.261 -3.634 A 62 HIS B 119 HIS~? A 63 HIS B 147 HIS~? A 89 ASP B 69 ASP~? ULMNm 3 1a0j_c00 TRYPSIN user 5 3 RMSD = 1.26 A TRANSFORM 0.1201 -0.0756 0.9899 0.9417 0.3243 -0.0895 0.3142 -0.9429 -0.1102 10.323 10.822 102.152 A 57 HIS B 119 HIS~? A 102 ASP B 69 ASP~? A 195 SER B 118 SER~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 4 3 RMSD = 1.26 A TRANSFORM 0.7192 -0.5931 0.3619 0.4834 0.0529 -0.8738 -0.4991 -0.8034 -0.3247 -30.259 37.153 77.561 A1132 ASP B 32 ASP~? A1134 ALA B 30 ALA~? A1137 ASN B 33 ASN~? ULMNm 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 11 3 RMSD = 1.26 A TRANSFORM -0.5159 0.5037 0.6929 -0.8400 -0.1389 -0.5244 0.1679 0.8526 -0.4948 23.492 32.106 -31.197 D 199 HIS B 147 HIS~? D 246 HIS B 159 HIS~? D 255 TYR B 83 TYR~? ULMNm 3 1js4_c01 ENDO-EXOCELLULASE E4 user 6 3 RMSD = 1.27 A TRANSFORM 0.5418 -0.6030 -0.5855 -0.6128 -0.7602 0.2158 0.5752 -0.2419 0.7814 140.748 88.314 12.096 B 55 ASP B 149 ASP~? B 58 ASP A 22 ASP~? B 424 GLU B 145 GLU~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.27 A TRANSFORM 0.2543 0.5447 -0.7992 -0.2914 0.8311 0.4737 -0.9222 -0.1124 -0.3700 19.980 49.338 47.825 E 98 SER B 118 SER~? E 123 HIS B 119 HIS~? E 172 ASP B 69 ASP~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.27 A TRANSFORM 0.1347 0.9849 -0.1086 -0.4339 0.1572 0.8871 -0.8908 0.0724 -0.4485 20.495 73.828 41.223 D 98 SER B 118 SER~? D 123 HIS B 119 HIS~? D 172 ASP B 69 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 9 3 RMSD = 1.27 A TRANSFORM -0.2491 -0.4815 0.8403 0.5809 -0.7685 -0.2681 -0.7749 -0.4214 -0.4712 44.081 29.441 21.931 A 229 ALA A 10 ALA~? A 257 ALA A 9 ALA~? A 328 ASP A 4 ASP.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 17 3 RMSD = 1.27 A TRANSFORM -0.0064 0.5694 0.8220 -0.9762 0.1746 -0.1286 0.2168 0.8033 -0.5547 -8.671 95.163 0.482 A 228 ASP B 26 ASP.? A 260 ASP B 69 ASP~? A 329 ASP B 32 ASP~? ULMNm 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 12 3 RMSD = 1.27 A TRANSFORM 0.5219 -0.4554 -0.7213 0.8435 0.4016 0.3567 -0.1272 0.7946 -0.5937 117.245 -12.145 -27.072 A 199 HIS B 147 HIS~? A 246 HIS B 159 HIS~? A 255 TYR B 83 TYR~? ULMNm 3 1rtf_c03 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 RMSD = 1.27 A TRANSFORM 0.2847 -0.8683 -0.4061 -0.7219 0.0845 -0.6868 -0.6307 -0.4887 0.6028 14.713 56.080 54.868 B 57 HIS A 119 HIS~? B 102 ASP A 69 ASP~? B 195 SER A 118 SER~? ULMNm 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 11 3 RMSD = 1.27 A TRANSFORM -0.0782 0.5034 0.8605 0.9878 -0.0778 0.1352 -0.1350 -0.8605 0.4912 20.402 18.198 22.653 B 199 HIS B 147 HIS~? B 246 HIS B 159 HIS~? B 255 TYR B 83 TYR~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.28 A TRANSFORM 0.1922 -0.3367 -0.9218 -0.0806 0.9307 -0.3567 -0.9780 -0.1429 -0.1518 42.535 33.690 51.866 F 98 SER B 118 SER~? F 123 HIS B 119 HIS~? F 172 ASP B 69 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 35 3 RMSD = 1.28 A TRANSFORM -0.3866 -0.7205 -0.5756 0.8096 -0.5641 0.1623 0.4417 0.4032 -0.8015 108.861 31.965 2.432 199 ASP B 32 ASP~? 218 GLU B 152 GLU~? 329 ASP B 26 ASP.? ULMNm 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 12 3 RMSD = 1.28 A TRANSFORM 0.1337 -0.5857 -0.7994 -0.9837 -0.1766 -0.0351 0.1207 -0.7910 0.5998 123.453 18.742 18.509 C 199 HIS B 147 HIS~? C 246 HIS B 159 HIS~? C 255 TYR B 83 TYR~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 36 3 RMSD = 1.28 A TRANSFORM 0.7191 -0.4866 0.4961 0.6462 0.2057 -0.7349 -0.2556 -0.8491 -0.4624 16.153 57.733 76.040 A 228 ASP B 26 ASP.? A 261 ASP A 131 ASP~? A 329 ASP A 149 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 1.29 A TRANSFORM -0.8355 -0.1594 0.5259 -0.5190 0.5433 -0.6599 0.1806 0.8243 0.5366 29.894 75.960 -35.087 A 603 HIS A 119 HIS~? A 646 ASP A 86 ASP~? A 739 GLY A 155 GLY~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 18 3 RMSD = 1.29 A TRANSFORM 0.4132 0.6913 0.5927 0.1545 0.5882 -0.7938 0.8974 -0.4196 -0.1363 -25.985 27.001 92.616 A 241 ASP B 149 ASP~? A 265 GLU B 171 GLU~? A 369 ASP A 26 ASP.? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.29 A TRANSFORM -0.1695 0.5750 0.8004 -0.4234 -0.7759 0.4677 -0.8900 0.2596 -0.3750 132.890 65.812 88.202 N 98 SER B 118 SER~? N 123 HIS B 119 HIS~? N 172 ASP B 69 ASP~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.29 A TRANSFORM -0.0054 -0.9435 -0.3314 -0.0207 0.3314 -0.9433 -0.9998 -0.0018 0.0213 68.667 40.643 50.544 G 98 SER B 118 SER~? G 123 HIS B 119 HIS~? G 172 ASP B 69 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.29 A TRANSFORM 0.2067 0.6651 -0.7176 -0.3305 0.7377 0.5886 -0.9209 -0.1155 -0.3723 106.089 26.503 97.892 I 98 SER B 118 SER~? I 123 HIS B 119 HIS~? I 172 ASP B 69 ASP~? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 RMSD = 1.30 A TRANSFORM -0.3675 -0.6025 0.7085 0.1447 0.7155 0.6835 0.9187 -0.3537 0.1758 36.358 -27.683 9.672 30 GLY A 137 GLY~? 48 HIS A 142 HIS~? 99 ASP B 26 ASP.? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.30 A TRANSFORM -0.0877 0.7076 0.7012 -0.4574 -0.6539 0.6027 -0.8849 0.2679 -0.3810 40.456 91.872 37.453 C 98 SER B 118 SER~? C 123 HIS B 119 HIS~? C 172 ASP B 69 ASP~? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 RMSD = 1.30 A TRANSFORM 0.2373 0.7469 0.6211 0.9552 -0.0630 -0.2891 0.1768 -0.6619 0.7284 16.064 20.738 4.704 A 261 GLY B 179 GLY.? B 17 GLN B 174 GLN~? B 140 GLU B 177 GLU~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 31 3 RMSD = 1.30 A TRANSFORM -0.1640 0.9714 0.1718 0.3464 -0.1064 0.9320 -0.9236 -0.2123 0.3191 14.271 9.878 45.182 199 ASP B 26 ASP.? 218 GLU B 56 GLU.? 329 ASP B 32 ASP~? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 5 3 RMSD = 1.30 A TRANSFORM 0.5434 0.3888 0.7440 -0.1873 -0.8078 0.5589 -0.8183 0.4430 0.3662 7.808 131.867 4.475 B 106 ASN B 133 ASN~? B 108 HIS B 143 HIS~? B 144 ASP A 108 ASP~? ULMNm 3 1js4_c00 ENDO-EXOCELLULASE E4 user 7 3 RMSD = 1.31 A TRANSFORM -0.8402 -0.4766 0.2588 -0.4911 0.8710 0.0096 0.2300 0.1191 0.9659 75.608 19.148 -1.399 A 55 ASP B 149 ASP~? A 58 ASP A 22 ASP~? A 424 GLU B 145 GLU~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 1.31 A TRANSFORM 0.0300 -0.9326 0.3596 -0.5896 0.2740 0.7598 0.8072 0.2348 0.5416 59.776 22.547 -2.978 A 316 ALA B 19 ALA~? A 317 GLY B 20 GLY~? A 318 ASP B 22 ASP~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.31 A TRANSFORM 0.2041 -0.1540 -0.9668 -0.1126 0.9773 -0.1795 -0.9725 -0.1455 -0.1822 123.767 7.401 101.811 J 98 SER B 118 SER~? J 123 HIS B 119 HIS~? J 172 ASP B 69 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 1.31 A TRANSFORM -0.3915 0.3984 -0.8295 -0.6037 -0.7915 -0.0952 0.6944 -0.4635 -0.5504 152.192 72.660 -1.920 A 316 ALA B 19 ALA~? A 317 GLY B 20 GLY~? A 318 ASP B 22 ASP~? ULMNm 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 14 3 RMSD = 1.31 A TRANSFORM -0.9646 -0.1033 -0.2426 -0.0458 0.9717 -0.2316 -0.2597 0.2123 0.9421 90.291 32.192 34.914 229 ASP B 11 ASP~? 264 GLU B 56 GLU.? 328 ASP B 4 ASP.? ULMNm 3 2odj_o00 PORIN D user 13 3 RMSD = 1.31 A TRANSFORM -0.5847 0.6854 -0.4340 -0.7005 -0.1568 0.6962 -0.4091 -0.7111 -0.5718 12.528 28.069 66.184 A 156 HIS A 143 HIS~? A 208 ASP A 26 ASP.? A 296 SER A 61 SER~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.31 A TRANSFORM 0.0629 0.9959 0.0652 -0.4550 -0.0295 0.8900 -0.8883 0.0857 -0.4513 109.714 51.774 90.944 H 98 SER B 118 SER~? H 123 HIS B 119 HIS~? H 172 ASP B 69 ASP~? ULMNm 3 1sca_c00 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 RMSD = 1.31 A TRANSFORM 0.7829 -0.4002 -0.4764 -0.6197 -0.4339 -0.6540 -0.0550 -0.8072 0.5877 78.234 104.074 67.351 32 ASP A 69 ASP~? 64 HIS A 119 HIS~? 221 SER A 118 SER~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.32 A TRANSFORM -0.0365 -0.9939 -0.1043 0.2597 -0.1102 0.9594 0.9650 -0.0079 -0.2622 90.187 65.442 4.724 D 98 SER A 118 SER~? D 123 HIS A 119 HIS~? D 172 ASP A 69 ASP~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.32 A TRANSFORM -0.0490 -0.5739 -0.8174 0.2528 -0.7989 0.5458 0.9663 0.1799 -0.1843 65.698 90.469 -1.952 E 98 SER A 118 SER~? E 123 HIS A 119 HIS~? E 172 ASP A 69 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.32 A TRANSFORM 0.1678 -0.2246 -0.9599 -0.9844 0.0149 -0.1755 -0.0537 -0.9743 0.2186 63.519 16.569 19.893 A 67 ASP A 41 ASP~? A 68 ALA A 42 ALA~? A 72 LEU A 8 LEU~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.32 A TRANSFORM 0.9908 -0.1298 -0.0377 -0.1351 -0.9576 -0.2544 0.0031 -0.2572 0.9664 -12.042 24.602 -50.461 B 250 ALA B 19 ALA~? B 251 GLY B 20 GLY~? B 252 ASP B 22 ASP~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.32 A TRANSFORM -0.2222 -0.1014 0.9697 -0.2929 -0.9417 -0.1656 -0.9300 0.3208 -0.1795 66.590 87.117 39.245 B 98 SER B 118 SER~? B 123 HIS B 119 HIS~? B 172 ASP B 69 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.32 A TRANSFORM -0.0298 0.3076 -0.9511 0.2192 -0.9263 -0.3065 0.9752 0.2176 0.0398 28.258 89.728 -2.127 F 98 SER A 118 SER~? F 123 HIS A 119 HIS~? F 172 ASP A 69 ASP~? ULMNm 3 1t0u_c01 URIDINE PHOSPHORYLASE user 10 3 RMSD = 1.33 A TRANSFORM -0.5644 -0.6543 0.5033 -0.3794 0.7471 0.5458 0.7332 -0.1171 0.6699 -2.342 -16.716 -66.770 B 8 HIS B 143 HIS~? B 80 GLU B 146 GLU~? B 223 ARG A 173 ARG~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 1.33 A TRANSFORM 0.3399 0.9351 -0.1002 -0.9366 0.3462 0.0546 -0.0857 -0.0753 -0.9935 -21.956 1.151 15.017 A 250 ALA B 19 ALA~? A 251 GLY B 20 GLY~? A 252 ASP B 22 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.33 A TRANSFORM -0.2732 -0.2668 0.9242 -0.2525 -0.9072 -0.3365 -0.9282 0.3253 -0.1805 157.467 56.203 89.465 M 98 SER B 118 SER~? M 123 HIS B 119 HIS~? M 172 ASP B 69 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 34 3 RMSD = 1.33 A TRANSFORM -0.2813 0.5568 -0.7815 0.1624 -0.7751 -0.6107 0.9458 0.2987 -0.1276 -12.054 41.253 -30.068 141 ASP B 102 ASP~? 166 GLY A 138 GLY~? 169 GLU A 146 GLU~? ULMNm 3 1rtf_c03 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 5 3 RMSD = 1.33 A TRANSFORM -0.1303 0.8747 -0.4667 0.8330 -0.1587 -0.5300 0.5377 0.4579 0.7080 -35.314 29.111 -0.138 B 57 HIS B 119 HIS~? B 102 ASP B 69 ASP~? B 195 SER B 118 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.33 A TRANSFORM 0.2263 0.0556 0.9725 0.9220 -0.3343 -0.1955 -0.3142 -0.9408 0.1269 33.119 21.415 17.306 A 229 ALA A 7 ALA~? A 257 ALA A 9 ALA~? A 328 ASP A 4 ASP.? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.33 A TRANSFORM 0.0497 -0.5489 0.8344 0.2628 0.8132 0.5193 0.9636 -0.1935 -0.1847 163.457 -3.016 63.949 N 98 SER A 118 SER~? N 123 HIS A 119 HIS~? N 172 ASP A 69 ASP~? ULMNm 3 2odj_o01 PORIN D user 1 3 RMSD = 1.33 A TRANSFORM -0.9228 0.1364 0.3604 0.0019 -0.9336 0.3583 -0.3854 -0.3313 -0.8612 -9.535 2.905 97.713 B 156 HIS A 34 HIS~? B 208 ASP A 22 ASP~? B 296 SER A 61 SER~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.34 A TRANSFORM -0.1838 -0.9159 0.3569 -0.0447 -0.3550 -0.9338 -0.9819 0.1876 -0.0244 165.533 31.737 96.034 L 98 SER B 118 SER~? L 123 HIS B 119 HIS~? L 172 ASP B 69 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.34 A TRANSFORM -0.2033 -0.8249 0.5274 -0.0644 -0.5262 -0.8479 -0.9770 0.2063 -0.0539 78.601 65.082 45.412 A 98 SER B 118 SER~? A 123 HIS B 119 HIS~? A 172 ASP B 69 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.34 A TRANSFORM -0.2033 -0.8249 0.5274 -0.0644 -0.5262 -0.8479 -0.9770 0.2063 -0.0539 78.601 65.082 45.412 A 98 SER B 118 SER~? A 123 HIS B 119 HIS~? A 172 ASP B 69 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 RMSD = 1.34 A TRANSFORM 0.0730 0.1680 -0.9831 0.9933 -0.1012 0.0565 0.0900 0.9806 0.1743 50.941 -22.459 -47.657 A 67 ASP B 41 ASP~? A 68 ALA B 42 ALA~? A 72 LEU B 8 LEU~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.34 A TRANSFORM -0.0095 -0.6893 -0.7244 0.2611 -0.7010 0.6637 0.9653 0.1828 -0.1866 157.539 59.968 47.968 I 98 SER A 118 SER~? I 123 HIS A 119 HIS~? I 172 ASP A 69 ASP~? ULMNm 3 2odj_o01 PORIN D user 12 3 RMSD = 1.34 A TRANSFORM 0.4161 0.7390 0.5299 0.7675 0.0272 -0.6405 0.4877 -0.6732 0.5559 -44.142 -16.745 76.128 B 156 HIS A 143 HIS~? B 208 ASP A 26 ASP.? B 296 SER A 61 SER~? ULMNm 3 2odj_o01 PORIN D user 26 3 RMSD = 1.34 A TRANSFORM 0.1666 0.9358 0.3106 0.2315 0.2691 -0.9349 0.9585 -0.2276 0.1718 -38.850 -7.355 68.156 B 156 HIS B 142 HIS~? B 208 ASP A 28 ASP~? B 296 SER A 60 SER~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 18 3 RMSD = 1.34 A TRANSFORM 0.9832 -0.0571 -0.1731 -0.1290 -0.8890 -0.4394 0.1288 -0.4543 0.8815 -12.785 35.141 -5.093 14 ASP B 149 ASP~? 16 HIS B 147 HIS~? 67 GLY A 137 GLY~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.34 A TRANSFORM 0.0005 0.9363 -0.3511 0.2323 -0.3416 -0.9107 0.9727 0.0811 0.2177 6.944 59.852 4.927 G 98 SER A 118 SER~? G 123 HIS A 119 HIS~? G 172 ASP A 69 ASP~? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.34 A TRANSFORM 0.0960 0.0459 0.9943 -0.7467 0.6638 0.0414 0.6581 0.7465 -0.0980 22.185 103.522 -23.754 B 106 ASN A 133 ASN~? B 108 HIS A 143 HIS~? B 144 ASP A 108 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.34 A TRANSFORM -0.0007 -0.6888 0.7250 0.2783 0.6962 0.6617 0.9605 -0.2023 -0.1912 83.190 29.571 13.955 C 98 SER A 118 SER~? C 123 HIS A 119 HIS~? C 172 ASP A 69 ASP~? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 RMSD = 1.35 A TRANSFORM -0.8321 0.4987 -0.2428 -0.2157 0.1125 0.9700 -0.5110 -0.8594 -0.0140 49.553 92.903 50.294 B 106 ASN A 133 ASN~? B 108 HIS A 143 HIS~? B 144 ASP A 149 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 7 3 RMSD = 1.35 A TRANSFORM 0.0010 -0.8661 -0.4999 -0.0088 0.4999 -0.8660 -1.0000 -0.0053 0.0071 150.876 9.446 100.450 K 98 SER B 118 SER~? K 123 HIS B 119 HIS~? K 172 ASP B 69 ASP~? ULMNm 3 2odj_o01 PORIN D user 10 3 RMSD = 1.35 A TRANSFORM 0.2755 0.7455 0.6070 0.9098 0.0017 -0.4150 0.3104 -0.6665 0.6778 -41.489 -21.061 78.612 B 156 HIS A 143 HIS~? B 208 ASP A 22 ASP~? B 296 SER A 61 SER~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 28 3 RMSD = 1.35 A TRANSFORM 0.1233 -0.7162 -0.6869 0.5754 0.6156 -0.5385 -0.8085 0.3289 -0.4880 79.645 -25.224 19.208 A 229 ALA B 9 ALA~? A 257 ALA B 10 ALA~? A 328 ASP B 4 ASP.? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.35 A TRANSFORM -0.0188 0.1238 -0.9921 0.2188 -0.9677 -0.1249 0.9756 0.2194 0.0089 121.783 65.234 47.861 J 98 SER A 118 SER~? J 123 HIS A 119 HIS~? J 172 ASP A 69 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 18 3 RMSD = 1.35 A TRANSFORM 0.6202 0.7687 0.1563 0.0760 -0.2572 0.9634 -0.7807 0.5856 0.2180 -52.806 10.490 1.071 141 ASP B 14 ASP~? 166 GLY A 138 GLY~? 169 GLU A 107 GLU~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 RMSD = 1.36 A TRANSFORM 0.9429 -0.2239 0.2467 0.3041 0.8809 -0.3627 0.1361 -0.4170 -0.8987 -13.229 -3.979 116.539 A 241 ASP B 32 ASP~? A 265 GLU A 178 GLU~? A 369 ASP B 26 ASP.? ULMNm 3 2odj_o00 PORIN D user 21 3 RMSD = 1.36 A TRANSFORM -0.4761 -0.0273 0.8790 -0.2331 -0.9599 -0.1561 -0.8479 0.2791 -0.4506 16.374 76.047 53.225 A 156 HIS B 34 HIS~? A 208 ASP B 26 ASP.? A 296 SER B 61 SER~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 3 3 RMSD = 1.36 A TRANSFORM -0.0768 0.9491 0.3054 0.1437 -0.2926 0.9454 -0.9866 -0.1165 0.1139 10.550 11.857 103.836 B 223 HIS A 43 HIS~? B 262 HIS A 36 HIS~? B 312 ASP A 41 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.36 A TRANSFORM 0.0000 -0.9968 0.0805 0.2656 0.0776 0.9610 0.9641 -0.0214 -0.2647 177.083 30.359 55.413 H 98 SER A 118 SER~? H 123 HIS A 119 HIS~? H 172 ASP A 69 ASP~? ULMNm 3 2c3x_p00 ALPHA-AMYLASE G-6 user 1 3 RMSD = 1.36 A TRANSFORM 0.3791 -0.7841 -0.4914 0.2234 -0.4378 0.8709 0.8980 0.4399 -0.0091 25.562 35.718 57.296 A 26 HIS A 34 HIS~? A 76 ASN A 74 ASN~? A 81 ASP A 32 ASP~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 49 3 RMSD = 1.36 A TRANSFORM -0.8366 0.5479 0.0009 0.4256 0.6509 -0.6286 0.3450 0.5255 0.7777 17.795 31.520 -5.445 A 228 ASP B 102 ASP~? A 261 ASP B 52 ASP~? A 329 ASP B 94 ASP~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 11 3 RMSD = 1.36 A TRANSFORM -0.1957 0.6575 0.7276 -0.9113 0.1522 -0.3827 0.3623 0.7380 -0.5693 13.177 14.372 5.189 A 44 HIS B 147 HIS~? A 45 HIS B 143 HIS~? A 261 PHE B 112 PHE.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 RMSD = 1.36 A TRANSFORM 0.5443 -0.8317 -0.1093 0.8198 0.5551 -0.1411 -0.1781 0.0128 -0.9839 59.358 -41.488 10.097 A 37 ASP A 131 ASP~? A 56 ILE A 97 ILE~? A 82 TYR A 114 TYR~? ULMNm 3 1dco_c00 DCOH user 1 3 RMSD = 1.36 A TRANSFORM -0.5428 0.4605 0.7023 0.5131 -0.4802 0.7114 -0.6649 -0.7466 -0.0244 38.672 20.050 73.510 A 62 HIS A 119 HIS~? A 63 HIS A 147 HIS~? A 89 ASP A 69 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 25 3 RMSD = 1.37 A TRANSFORM 0.4668 0.0594 0.8824 0.3724 -0.9182 -0.1352 -0.8021 -0.3917 0.4507 -29.628 34.067 34.195 141 ASP B 28 ASP~? 166 GLY A 137 GLY~? 169 GLU B 107 GLU~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.37 A TRANSFORM 0.0169 0.1320 0.9911 0.2488 0.9595 -0.1320 0.9684 -0.2488 0.0167 51.237 12.641 17.397 B 98 SER A 118 SER~? B 123 HIS A 119 HIS~? B 172 ASP A 69 ASP~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 9 3 RMSD = 1.37 A TRANSFORM -0.0365 0.9515 0.3055 0.0887 -0.3014 0.9493 -0.9954 -0.0618 0.0734 -30.436 -24.846 15.886 14 ASP A 86 ASP~? 16 HIS A 119 HIS~? 67 GLY A 179 GLY.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 11 3 RMSD = 1.38 A TRANSFORM -0.8676 -0.0451 -0.4952 0.2116 0.8677 -0.4497 -0.4500 0.4950 0.7433 29.599 -29.262 -23.331 14 ASP A 149 ASP~? 16 HIS A 147 HIS~? 67 GLY B 138 GLY~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.38 A TRANSFORM 0.0634 0.3001 0.9518 0.2458 0.9196 -0.3063 0.9672 -0.2534 0.0154 129.034 -14.439 67.988 M 98 SER A 118 SER~? M 123 HIS A 119 HIS~? M 172 ASP A 69 ASP~? ULMNm 3 1sca_c00 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 4 3 RMSD = 1.38 A TRANSFORM -0.6409 0.4432 -0.6268 0.7676 0.3669 -0.5255 0.0029 0.8179 0.5753 79.557 46.088 13.573 32 ASP B 69 ASP~? 64 HIS B 119 HIS~? 221 SER B 118 SER~? ULMNm 3 2odj_o00 PORIN D user 12 3 RMSD = 1.38 A TRANSFORM -0.5220 0.7673 -0.3724 -0.6678 -0.0961 0.7381 -0.5306 -0.6340 -0.5626 7.923 24.859 65.172 A 156 HIS A 143 HIS~? A 208 ASP A 26 ASP.? A 296 SER A 60 SER~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 27 3 RMSD = 1.38 A TRANSFORM 0.1803 0.9382 0.2954 -0.5920 0.3433 -0.7292 0.7855 0.0434 -0.6173 -55.312 27.403 -16.094 141 ASP B 37 ASP~? 166 GLY B 20 GLY~? 169 GLU A 145 GLU~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.38 A TRANSFORM 0.0320 0.8457 0.5327 0.1924 0.5178 -0.8336 0.9808 -0.1292 0.1461 16.712 26.950 14.183 A 98 SER A 118 SER~? A 123 HIS A 119 HIS~? A 172 ASP A 69 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.38 A TRANSFORM 0.0320 0.8457 0.5327 0.1924 0.5178 -0.8336 0.9808 -0.1292 0.1461 16.712 26.950 14.183 A 98 SER A 118 SER~? A 123 HIS A 119 HIS~? A 172 ASP A 69 ASP~? ULMNm 3 1luc_c00 BACTERIAL LUCIFERASE user 6 3 RMSD = 1.38 A TRANSFORM 0.0203 -0.5403 0.8412 0.9798 -0.1568 -0.1243 -0.1990 -0.8267 -0.5262 46.486 -17.133 68.415 A 44 HIS A 147 HIS~? A 45 HIS A 143 HIS~? A 261 PHE A 112 PHE.? ULMNm 3 1ddj_c13 PLASMINOGEN user 3 3 RMSD = 1.38 A TRANSFORM 0.5420 -0.8050 -0.2413 0.8160 0.4356 0.3799 0.2007 0.4028 -0.8930 -20.898 1.380 -14.859 B 603 HIS A 119 HIS~? B 646 ASP A 86 ASP~? B 739 GLY A 155 GLY~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 RMSD = 1.38 A TRANSFORM -0.2349 0.8460 -0.4786 0.1467 0.5176 0.8430 -0.9609 -0.1278 0.2457 13.196 -37.674 37.415 A 67 ASP B 86 ASP~? A 68 ALA B 89 ALA~? A 72 LEU B 88 LEU~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.38 A TRANSFORM 0.0403 0.9323 0.3595 0.2025 0.3447 -0.9166 0.9784 -0.1097 0.1749 98.409 5.466 63.415 L 98 SER A 118 SER~? L 123 HIS A 119 HIS~? L 172 ASP A 69 ASP~? ULMNm 3 2odj_o00 PORIN D user 26 3 RMSD = 1.39 A TRANSFORM 0.6213 0.7404 -0.2564 -0.7630 0.4974 -0.4128 0.1781 -0.4521 -0.8740 -41.199 16.984 61.089 A 156 HIS B 43 HIS~? A 208 ASP B 52 ASP~? A 296 SER B 106 SER~? ULMNm 3 2c3x_p00 ALPHA-AMYLASE G-6 user 3 3 RMSD = 1.39 A TRANSFORM -0.2420 0.7657 -0.5959 -0.4416 0.4600 0.7703 -0.8640 -0.4496 -0.2268 -12.658 23.711 126.643 A 26 HIS B 34 HIS~? A 76 ASN B 74 ASN~? A 81 ASP B 32 ASP~? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 8 3 RMSD = 1.39 A TRANSFORM -0.0552 -0.9364 0.3467 -0.3475 0.3435 0.8725 0.9360 0.0723 0.3444 73.259 3.785 55.579 B 223 HIS B 43 HIS~? B 262 HIS B 36 HIS~? B 312 ASP B 41 ASP~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 RMSD = 1.39 A TRANSFORM 0.5388 -0.8354 -0.1088 0.8285 0.5488 -0.1113 -0.1527 0.0302 -0.9878 62.493 -58.300 -18.731 B 37 ASP A 131 ASP~? B 56 ILE A 97 ILE~? B 82 TYR A 114 TYR~? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 RMSD = 1.39 A TRANSFORM 0.4364 0.3420 0.8322 -0.5674 -0.6132 0.5496 -0.6983 0.7121 0.0735 -10.001 32.472 10.083 30 GLY B 137 GLY~? 48 HIS B 142 HIS~? 99 ASP A 22 ASP~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 RMSD = 1.40 A TRANSFORM -0.8920 -0.0378 0.4505 -0.4134 -0.3352 -0.8466 -0.1830 0.9414 -0.2833 30.408 79.687 55.606 A 241 ASP B 26 ASP.? A 265 GLU A 178 GLU~? A 369 ASP B 32 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.40 A TRANSFORM 0.0337 0.8563 -0.5154 0.2181 -0.5096 -0.8323 0.9753 0.0844 0.2039 94.222 40.194 54.576 K 98 SER A 118 SER~? K 123 HIS A 119 HIS~? K 172 ASP A 69 ASP~? ULMNm 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 8 3 RMSD = 1.40 A TRANSFORM 0.1450 0.9102 0.3880 -0.2487 -0.3460 0.9047 -0.9577 0.2277 -0.1762 -43.056 62.554 16.676 B 74 ASN B 133 ASN~? B 192 ASP B 69 ASP~? B 195 HIS B 119 HIS~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.40 A TRANSFORM 0.9697 -0.1187 -0.2134 0.0856 0.9837 -0.1581 -0.2287 -0.1351 -0.9641 35.094 17.145 15.502 A 229 ALA A 7 ALA~? A 257 ALA A 9 ALA~? A 328 ASP A 14 ASP~? ULMNm 3 1ro7_c03 ALPHA-2,3/8-SIALYLTRANSFERASE user 2 3 RMSD = 1.40 A TRANSFORM 0.1328 0.9866 -0.0945 0.8169 -0.1630 -0.5533 0.5613 0.0037 0.8276 -68.227 -30.436 3.375 D 129 ARG B 160 ARG~? D 156 TYR B 175 TYR~? D 188 HIS B 159 HIS~? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 3 3 RMSD = 1.40 A TRANSFORM -0.5645 0.5950 0.5721 -0.2639 0.5266 -0.8081 0.7821 0.6072 0.1403 20.829 50.706 50.681 A 223 HIS A 43 HIS~? A 262 HIS A 36 HIS~? A 312 ASP A 41 ASP~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 RMSD = 1.40 A TRANSFORM 0.3802 -0.8380 -0.3915 -0.2935 -0.5107 0.8081 0.8771 0.1923 0.4401 56.758 4.058 -14.193 A 67 ASP A 86 ASP~? A 68 ALA A 89 ALA~? A 72 LEU A 88 LEU~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.40 A TRANSFORM 0.4822 0.4776 -0.7344 0.7994 0.1031 0.5919 -0.3585 0.8725 0.3321 9.863 -9.150 1.128 A 99 ARG A 73 ARG~? A 101 ASP A 86 ASP~? A 132 ASP A 69 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 RMSD = 1.41 A TRANSFORM -0.4804 -0.4511 0.7521 -0.8452 0.0092 -0.5344 -0.2341 0.8924 0.3857 12.454 32.991 -1.892 B 99 ARG A 73 ARG~? B 101 ASP A 86 ASP~? B 132 ASP A 69 ASP~? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 8 3 RMSD = 1.41 A TRANSFORM -0.3382 -0.4708 -0.8148 -0.9145 -0.0400 0.4026 0.2222 -0.8813 0.4170 57.453 34.391 47.586 A 99 ARG B 73 ARG~? A 101 ASP B 86 ASP~? A 132 ASP B 69 ASP~? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 8 3 RMSD = 1.41 A TRANSFORM 0.3310 0.4451 0.8320 0.9395 -0.0730 -0.3347 0.0882 -0.8925 0.4423 -33.162 -4.458 51.356 B 99 ARG B 73 ARG~? B 101 ASP B 86 ASP~? B 132 ASP B 69 ASP~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 32 3 RMSD = 1.41 A TRANSFORM -0.2398 0.9554 0.1725 0.6225 0.0150 0.7824 -0.7449 -0.2950 0.5984 17.493 -0.623 36.937 199 ASP B 26 ASP.? 218 GLU B 95 GLU~? 329 ASP B 32 ASP~? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 3 3 RMSD = 1.41 A TRANSFORM -0.9112 -0.4112 0.0261 0.3360 -0.7781 -0.5307 -0.2385 0.4748 -0.8472 27.163 9.666 17.436 274 HIS A 43 HIS~? 320 HIS A 36 HIS~? 375 ASP A 41 ASP~? ULMNm 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 22 3 RMSD = 1.41 A TRANSFORM -0.5393 0.8373 -0.0898 -0.3823 -0.3385 -0.8598 0.7503 0.4293 -0.5027 -5.119 109.554 2.277 179 ASP A 149 ASP~? 214 ASP B 41 ASP~? 289 ASP B 26 ASP.? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.41 A TRANSFORM -0.2105 -0.2908 0.9333 0.2056 -0.9465 -0.2486 -0.9557 -0.1396 -0.2591 46.056 66.274 29.947 199 ASP A 22 ASP~? 242 GLU B 107 GLU~? 329 ASP A 28 ASP~? ULMNm 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 3 3 RMSD = 1.42 A TRANSFORM -0.1648 -0.9108 0.3785 0.0279 0.3793 0.9248 0.9859 -0.1630 0.0371 23.289 30.265 -12.546 B 74 ASN A 133 ASN~? B 192 ASP A 69 ASP~? B 195 HIS A 119 HIS~?