*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 4 1qfw_p00 GONADOTROPIN ALPHA SUBUNIT user 1 4 RMSD = 1.23 A TRANSFORM 0.0112 -0.7334 0.6797 0.9160 -0.2651 -0.3012 0.4011 0.6259 0.6688 135.062 -43.105 -106.918 A 25 ILE D 171 ILE~? A 52 ASN A 67 ASN~? A 53 VAL A 64 VAL~? A 78 ASN D 175 ASN~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 RMSD = 0.59 A TRANSFORM -0.3014 -0.9410 -0.1535 -0.9282 0.2527 0.2732 -0.2183 0.2249 -0.9496 140.388 78.053 50.502 A 14 GLU A 97 GLU~? A 61 GLU A 92 GLU~? A 162 HIS A 100 HIS~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 4 3 RMSD = 0.59 A TRANSFORM -0.3021 0.8698 0.3900 -0.7122 -0.4779 0.5142 0.6336 -0.1224 0.7639 -53.844 108.425 -104.668 A 14 GLU C 97 GLU~? A 61 GLU C 92 GLU~? A 162 HIS C 100 HIS~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 5 3 RMSD = 0.60 A TRANSFORM 0.2544 -0.8230 0.5078 0.6999 0.5191 0.4906 -0.6674 0.2306 0.7081 44.316 -115.641 -16.779 A 14 GLU D 97 GLU~? A 61 GLU D 92 GLU~? A 162 HIS D 100 HIS~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 3 3 RMSD = 0.61 A TRANSFORM 0.2507 0.9562 -0.1509 0.9366 -0.2002 0.2875 0.2447 -0.2134 -0.9458 -88.889 -53.222 50.640 A 14 GLU B 97 GLU~? A 61 GLU B 92 GLU~? A 162 HIS B 100 HIS~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 0.73 A TRANSFORM 0.4768 -0.7461 -0.4647 0.8150 0.5733 -0.0843 0.3293 -0.3385 0.8815 74.524 -130.483 9.261 A 316 ALA A 60 ALA~? A 317 GLY A 59 GLY~? A 318 ASP A 62 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 3 3 RMSD = 0.78 A TRANSFORM 0.4807 0.8767 0.0185 0.7520 -0.4013 -0.5230 -0.4511 0.2653 -0.8521 -101.375 -13.704 132.614 A 316 ALA C 60 ALA~? A 317 GLY C 59 GLY~? A 318 ASP C 62 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 4 3 RMSD = 0.78 A TRANSFORM -0.5365 -0.8168 0.2122 -0.5182 0.1205 -0.8467 0.6660 -0.5642 -0.4879 137.710 87.916 98.572 A 316 ALA D 60 ALA~? A 317 GLY D 59 GLY~? A 318 ASP D 62 ASP~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 6 3 RMSD = 0.79 A TRANSFORM 0.6904 0.1420 -0.7094 0.4934 -0.8096 0.3181 -0.5291 -0.5696 -0.6290 55.556 72.851 276.372 A 50 ASP A 159 ASP~? A 327 GLU D 137 GLU~? A 339 ARG B 136 ARG~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 4 3 RMSD = 0.79 A TRANSFORM 0.7694 -0.6180 0.1613 -0.5116 -0.4451 0.7350 -0.3825 -0.6480 -0.6586 35.573 13.015 85.741 B 250 ALA D 60 ALA~? B 251 GLY D 59 GLY~? B 252 ASP D 62 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 4 3 RMSD = 0.80 A TRANSFORM 0.1031 0.8875 0.4490 -0.8581 -0.1490 0.4914 0.5031 -0.4360 0.7462 10.363 53.168 -25.685 A 316 ALA D 60 ALA~? A 317 GLY D 59 GLY~? A 318 ASP D 62 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 0.80 A TRANSFORM -0.1929 -0.7108 0.6765 -0.1021 -0.6711 -0.7343 0.9759 -0.2107 0.0569 92.902 92.019 -137.497 B 250 ALA A 60 ALA~? B 251 GLY A 59 GLY~? B 252 ASP A 62 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 0.80 A TRANSFORM -0.8000 0.5528 -0.2333 0.1039 -0.2553 -0.9613 -0.5910 -0.7932 0.1468 181.538 71.094 146.762 A 316 ALA A 60 ALA~? A 317 GLY A 59 GLY~? A 318 ASP A 62 ASP~? ULMNm 3 1lio_c01 ADENOSINE KINASE user 2 3 RMSD = 0.82 A TRANSFORM -0.5041 0.7542 -0.4208 -0.7912 -0.5986 -0.1251 -0.3462 0.2698 0.8985 24.244 130.681 11.411 A 316 ALA B 60 ALA~? A 317 GLY B 59 GLY~? A 318 ASP B 62 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 4 3 RMSD = 0.83 A TRANSFORM 0.7614 0.4931 -0.4209 -0.6281 0.7221 -0.2901 0.1609 0.4853 0.8594 -46.543 -47.564 -119.081 A 250 ALA D 60 ALA~? A 251 GLY D 59 GLY~? A 252 ASP D 62 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 0.86 A TRANSFORM -0.2728 0.5346 0.7998 0.1759 0.8451 -0.5049 -0.9459 0.0029 -0.3246 -32.377 -112.453 115.236 A 250 ALA A 60 ALA~? A 251 GLY A 59 GLY~? A 252 ASP A 62 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 RMSD = 0.86 A TRANSFORM -0.7512 0.5663 -0.3392 0.2808 0.7391 0.6122 0.5974 0.3646 -0.7143 93.391 -150.933 -110.090 B 250 ALA C 60 ALA~? B 251 GLY C 59 GLY~? B 252 ASP C 62 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 3 3 RMSD = 0.87 A TRANSFORM -0.2755 -0.6458 0.7120 0.6728 0.3995 0.6227 -0.6866 0.6506 0.3245 184.756 -137.033 18.088 A 316 ALA C 60 ALA~? A 317 GLY C 59 GLY~? A 318 ASP C 62 ASP~? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 RMSD = 0.91 A TRANSFORM 0.1367 0.6728 0.7271 0.0768 0.7246 -0.6849 -0.9876 0.1495 0.0474 -72.359 -55.420 10.677 B 250 ALA B 60 ALA~? B 251 GLY B 59 GLY~? B 252 ASP B 62 ASP~? ULMNm 3 1lij_c01 ADENOSINE KINASE user 2 3 RMSD = 0.91 A TRANSFORM 0.8320 -0.4931 -0.2542 -0.1039 0.3115 -0.9445 0.5450 0.8123 0.2079 130.332 39.534 -112.621 A 316 ALA B 60 ALA~? A 317 GLY B 59 GLY~? A 318 ASP B 62 ASP~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 RMSD = 0.92 A TRANSFORM -0.6182 -0.6789 -0.3962 0.6510 -0.7246 0.2261 -0.4405 -0.1182 0.8899 181.708 -61.703 8.490 A 250 ALA C 60 ALA~? A 251 GLY C 59 GLY~? A 252 ASP C 62 ASP~? ULMNm 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 2 3 RMSD = 0.95 A TRANSFORM -0.7878 -0.5182 -0.3328 -0.0232 0.5649 -0.8248 0.6155 -0.6421 -0.4571 237.539 25.060 11.683 B 311 HIS A 100 HIS~? B 341 GLU A 97 GLU~? B 356 HIS A 48 HIS~? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 RMSD = 0.96 A TRANSFORM 0.2887 -0.5708 0.7687 -0.1122 -0.8175 -0.5649 0.9508 0.0768 -0.3001 18.181 75.071 -67.241 A 250 ALA B 60 ALA~? A 251 GLY B 59 GLY~? A 252 ASP B 62 ASP~? ULMNm 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 2 3 RMSD = 0.97 A TRANSFORM -0.0131 -0.8549 -0.5186 -0.1252 0.5160 -0.8474 0.9920 0.0538 -0.1138 251.064 41.293 -82.238 A 311 HIS A 100 HIS~? A 341 GLU A 97 GLU~? A 356 HIS A 48 HIS~? ULMNm 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 4 3 RMSD = 0.99 A TRANSFORM 0.7627 0.5598 -0.3240 0.0643 -0.5640 -0.8233 -0.6436 0.6071 -0.4661 -7.038 124.671 12.156 B 311 HIS B 100 HIS~? B 341 GLU B 97 GLU~? B 356 HIS B 48 HIS~? ULMNm 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 4 3 RMSD = 1.00 A TRANSFORM -0.0267 0.8536 -0.5203 0.1638 -0.5097 -0.8446 -0.9861 -0.1078 -0.1263 92.866 112.530 116.860 A 311 HIS B 100 HIS~? A 341 GLU B 97 GLU~? A 356 HIS B 48 HIS~? ULMNm 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 8 3 RMSD = 1.05 A TRANSFORM 0.3016 -0.2850 0.9098 -0.7579 0.5073 0.4101 -0.5785 -0.8132 -0.0630 39.085 14.057 120.546 B 311 HIS D 100 HIS~? B 341 GLU D 97 GLU~? B 356 HIS D 48 HIS~? ULMNm 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 8 3 RMSD = 1.06 A TRANSFORM -0.2196 -0.8388 0.4981 -0.7066 0.4888 0.5117 -0.6727 -0.2396 -0.7000 212.102 5.601 138.156 A 311 HIS D 100 HIS~? A 341 GLU D 97 GLU~? A 356 HIS D 48 HIS~? ULMNm 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 6 3 RMSD = 1.07 A TRANSFORM -0.3605 0.3751 0.8540 0.7487 -0.4296 0.5048 0.5563 0.8214 -0.1260 44.935 -41.599 -133.499 B 311 HIS C 100 HIS~? B 341 GLU C 97 GLU~? B 356 HIS C 48 HIS~? ULMNm 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 6 3 RMSD = 1.09 A TRANSFORM 0.1660 0.8973 0.4089 0.6913 -0.4016 0.6007 0.7033 0.1830 -0.6869 21.215 -43.672 -31.562 A 311 HIS C 100 HIS~? A 341 GLU C 97 GLU~? A 356 HIS C 48 HIS~? ULMNm 3 1qrz_c20 PLASMINOGEN user 2 3 RMSD = 1.19 A TRANSFORM -0.9526 0.2396 -0.1877 -0.2033 -0.0422 0.9782 0.2265 0.9699 0.0889 45.108 -24.335 -62.120 A 603 HIS B 55 HIS~? A 646 ASP B 49 ASP~? A 739 GLY B 59 GLY~? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.19 A TRANSFORM 0.6368 0.5086 -0.5794 -0.6230 -0.1032 -0.7753 -0.4542 0.8548 0.2512 -99.257 132.307 11.396 A 603 HIS C 55 HIS~? A 646 ASP C 49 ASP~? A 739 GLY C 59 GLY~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.21 A TRANSFORM 0.8946 0.2121 0.3932 -0.3105 -0.3378 0.8885 0.3213 -0.9170 -0.2363 16.307 12.826 186.666 L 98 SER D 93 SER~? L 123 HIS D 48 HIS~? L 172 ASP D 49 ASP~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.22 A TRANSFORM 0.8794 0.1165 0.4615 0.3580 0.4771 -0.8026 -0.3138 0.8711 0.3779 22.526 -19.463 28.092 L 98 SER B 93 SER~? L 123 HIS B 48 HIS~? L 172 ASP B 49 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.22 A TRANSFORM 0.2637 0.0096 0.9646 -0.8411 -0.4873 0.2348 0.4723 -0.8732 -0.1204 30.417 122.498 160.223 K 98 SER D 93 SER~? K 123 HIS D 48 HIS~? K 172 ASP D 49 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.23 A TRANSFORM 0.8668 0.3078 -0.3923 -0.4825 0.3193 -0.8156 -0.1258 0.8963 0.4253 33.461 78.061 4.503 K 98 SER B 93 SER~? K 123 HIS B 48 HIS~? K 172 ASP B 49 ASP~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.23 A TRANSFORM -0.9077 -0.1914 0.3734 0.2532 0.4597 0.8512 -0.3346 0.8672 -0.3688 223.179 -108.283 87.254 L 98 SER C 93 SER~? L 123 HIS C 48 HIS~? L 172 ASP C 49 ASP~? ULMNm 3 3qwd_o11 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.23 A TRANSFORM -0.8887 -0.0786 0.4518 -0.3738 -0.4464 -0.8130 0.2656 -0.8914 0.3673 206.040 133.761 141.500 L 98 SER A 93 SER~? L 123 HIS A 48 HIS~? L 172 ASP A 49 ASP~? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM 0.9413 -0.2835 -0.1833 0.1913 0.0004 0.9815 -0.2782 -0.9590 0.0546 -81.678 -62.379 167.886 A 603 HIS A 55 HIS~? A 646 ASP A 49 ASP~? A 739 GLY A 59 GLY~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.23 A TRANSFORM 0.7514 0.2301 -0.6184 0.6494 -0.0921 0.7548 0.1168 -0.9688 -0.2186 27.451 -40.040 153.963 B 98 SER D 93 SER~? B 123 HIS D 48 HIS~? B 172 ASP D 49 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.23 A TRANSFORM 0.8554 0.2059 -0.4754 0.5060 -0.1355 0.8518 0.1110 -0.9691 -0.2201 96.833 -61.496 204.933 M 98 SER D 93 SER~? M 123 HIS D 48 HIS~? M 172 ASP D 49 ASP~? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM 0.6633 -0.6454 -0.3788 0.6122 0.1769 0.7707 -0.4304 -0.7431 0.5124 -62.395 -142.011 121.540 D 603 HIS C 55 HIS~? D 646 ASP C 49 ASP~? D 739 GLY C 59 GLY~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.23 A TRANSFORM -0.5758 -0.1818 0.7972 -0.6904 -0.4142 -0.5931 0.4380 -0.8919 0.1129 122.996 177.809 144.393 J 98 SER D 93 SER~? J 123 HIS D 48 HIS~? J 172 ASP D 49 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.23 A TRANSFORM 0.2144 -0.1166 0.9698 0.8715 0.4711 -0.1360 -0.4410 0.8743 0.2026 93.689 -91.159 45.722 M 98 SER B 93 SER~? M 123 HIS B 48 HIS~? M 172 ASP B 49 ASP~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.24 A TRANSFORM 0.0566 -0.2010 0.9779 0.8979 0.4385 0.0381 -0.4365 0.8760 0.2053 30.221 -69.041 -5.349 B 98 SER B 93 SER~? B 123 HIS B 48 HIS~? B 172 ASP B 49 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.24 A TRANSFORM -0.8777 -0.2574 -0.4042 0.4731 -0.3311 -0.8164 0.0763 -0.9078 0.4123 247.735 48.935 156.975 K 98 SER A 93 SER~? K 123 HIS A 48 HIS~? K 172 ASP A 49 ASP~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.24 A TRANSFORM 0.1925 0.2449 -0.9502 -0.9811 0.0678 -0.1813 0.0200 0.9672 0.2533 123.673 130.251 -10.436 J 98 SER B 93 SER~? J 123 HIS B 48 HIS~? J 172 ASP B 49 ASP~? ULMNm 3 3qwd_o10 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.24 A TRANSFORM -0.3138 0.1050 0.9437 0.8131 0.5430 0.2100 -0.4903 0.8332 -0.2557 79.701 -124.303 97.029 K 98 SER C 93 SER~? K 123 HIS C 48 HIS~? K 172 ASP C 49 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.24 A TRANSFORM -0.6388 -0.1644 -0.7516 0.7646 -0.0267 -0.6440 0.0858 -0.9860 0.1428 263.330 41.640 175.589 H 98 SER D 93 SER~? H 123 HIS D 48 HIS~? H 172 ASP D 49 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.24 A TRANSFORM -0.4241 -0.1288 0.8964 -0.7815 -0.4480 -0.4341 0.4575 -0.8847 0.0894 11.479 201.364 94.025 F 98 SER D 93 SER~? F 123 HIS D 48 HIS~? F 172 ASP D 49 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.25 A TRANSFORM -0.8229 -0.2957 -0.4852 -0.5538 0.2258 0.8015 -0.1274 0.9282 -0.3496 297.541 8.759 56.263 M 98 SER C 93 SER~? M 123 HIS C 48 HIS~? M 172 ASP C 49 ASP~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.25 A TRANSFORM -0.0552 0.1888 0.9805 -0.9194 -0.3927 0.0238 0.3895 -0.9001 0.1952 6.034 178.067 86.101 B 98 SER A 93 SER~? B 123 HIS A 48 HIS~? B 172 ASP A 49 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.25 A TRANSFORM -0.9800 -0.1953 -0.0373 -0.0450 0.0353 0.9984 -0.1936 0.9801 -0.0434 251.541 3.145 18.701 H 98 SER B 93 SER~? H 123 HIS B 48 HIS~? H 172 ASP B 49 ASP~? ULMNm 3 3qwd_o12 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.25 A TRANSFORM -0.2176 0.1128 0.9695 -0.8929 -0.4242 -0.1510 0.3942 -0.8985 0.1930 114.328 156.728 135.973 M 98 SER A 93 SER~? M 123 HIS A 48 HIS~? M 172 ASP A 49 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.25 A TRANSFORM 0.3724 0.2570 -0.8918 -0.9279 0.1201 -0.3528 0.0164 0.9589 0.2832 16.234 153.487 -60.618 F 98 SER B 93 SER~? F 123 HIS B 48 HIS~? F 172 ASP B 49 ASP~? ULMNm 3 3qwd_o01 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.25 A TRANSFORM -0.7108 -0.3341 -0.6190 -0.6907 0.1651 0.7040 -0.1330 0.9280 -0.3481 212.984 65.524 6.408 B 98 SER C 93 SER~? B 123 HIS C 48 HIS~? B 172 ASP C 49 ASP~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.25 A TRANSFORM -0.1971 -0.2198 -0.9554 0.9778 -0.1151 -0.1753 -0.0714 -0.9687 0.2376 201.518 -34.555 181.338 J 98 SER A 93 SER~? J 123 HIS A 48 HIS~? J 172 ASP A 49 ASP~? ULMNm 3 3qwd_o09 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.25 A TRANSFORM 0.5276 0.3033 0.7935 0.7083 0.3587 -0.6080 -0.4690 0.8828 -0.0255 -21.063 -25.032 70.743 J 98 SER C 93 SER~? J 123 HIS C 48 HIS~? J 172 ASP C 49 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.25 A TRANSFORM -0.9598 -0.2784 0.0372 0.0287 -0.2291 -0.9730 0.2794 -0.9328 0.2278 227.212 142.780 149.387 I 98 SER D 93 SER~? I 123 HIS D 48 HIS~? I 172 ASP D 49 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.26 A TRANSFORM 0.0008 0.0358 -0.9994 1.0000 0.0074 0.0011 0.0074 -0.9993 -0.0358 133.282 -7.638 148.552 C 98 SER D 93 SER~? C 123 HIS D 48 HIS~? C 172 ASP D 49 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM -0.6229 0.0438 -0.7811 -0.7823 -0.0360 0.6218 -0.0009 0.9984 0.0567 217.684 94.709 -4.981 I 98 SER B 93 SER~? I 123 HIS B 48 HIS~? I 172 ASP B 49 ASP~? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.26 A TRANSFORM 0.1863 0.0394 -0.9817 0.9823 0.0129 0.1869 0.0200 -0.9991 -0.0363 205.375 -50.496 198.052 N 98 SER D 93 SER~? N 123 HIS D 48 HIS~? N 172 ASP D 49 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.26 A TRANSFORM 0.6725 0.0892 -0.7347 -0.7300 -0.0833 -0.6784 -0.1217 0.9925 0.0091 114.664 184.564 18.083 H 98 SER C 93 SER~? H 123 HIS C 48 HIS~? H 172 ASP C 49 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM -0.7239 -0.2974 0.6225 0.5788 0.2291 0.7826 -0.3753 0.9269 0.0063 127.628 -41.828 -9.676 C 98 SER B 93 SER~? C 123 HIS B 48 HIS~? C 172 ASP B 49 ASP~? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.26 A TRANSFORM -0.6045 -0.2513 0.7559 0.7065 0.2691 0.6545 -0.3679 0.9297 0.0149 194.020 -81.091 39.437 N 98 SER B 93 SER~? N 123 HIS B 48 HIS~? N 172 ASP B 49 ASP~? ULMNm 3 3qwd_o07 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.26 A TRANSFORM 0.9890 0.1456 -0.0264 0.0344 -0.0529 0.9980 0.1439 -0.9879 -0.0573 36.650 6.368 173.031 H 98 SER A 93 SER~? H 123 HIS A 48 HIS~? H 172 ASP A 49 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.26 A TRANSFORM -0.3772 -0.2239 -0.8987 0.9237 -0.1619 -0.3473 -0.0677 -0.9611 0.2679 129.112 7.549 129.029 F 98 SER A 93 SER~? F 123 HIS A 48 HIS~? F 172 ASP A 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.26 A TRANSFORM 0.9479 0.2424 0.2068 -0.1373 -0.2747 0.9517 0.2875 -0.9305 -0.2271 -61.151 16.214 139.977 A 98 SER D 93 SER~? A 123 HIS D 48 HIS~? A 172 ASP D 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.26 A TRANSFORM 0.9479 0.2424 0.2068 -0.1373 -0.2747 0.9517 0.2875 -0.9305 -0.2271 -61.151 16.214 139.977 A 98 SER D 93 SER~? A 123 HIS D 48 HIS~? A 172 ASP D 49 ASP~? ULMNm 3 3qwd_o05 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.26 A TRANSFORM 0.3727 0.2583 0.8913 0.7897 0.4160 -0.4508 -0.4873 0.8719 -0.0489 -94.648 -25.232 25.461 F 98 SER C 93 SER~? F 123 HIS C 48 HIS~? F 172 ASP C 49 ASP~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.27 A TRANSFORM 0.4175 0.0924 0.9039 -0.7722 -0.4882 0.4066 0.4789 -0.8678 -0.1325 -70.081 130.345 110.263 G 98 SER D 93 SER~? G 123 HIS D 48 HIS~? G 172 ASP D 49 ASP~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.27 A TRANSFORM -0.9528 -0.2394 0.1869 -0.1207 -0.2661 -0.9564 0.2786 -0.9338 0.2246 121.735 182.727 99.819 E 98 SER D 93 SER~? E 123 HIS D 48 HIS~? E 172 ASP D 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM 0.7834 0.0513 0.6193 0.5260 0.4759 -0.7048 -0.3309 0.8780 0.3458 -54.118 -11.530 -19.448 A 98 SER B 93 SER~? A 123 HIS B 48 HIS~? A 172 ASP B 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM 0.7834 0.0513 0.6193 0.5260 0.4759 -0.7048 -0.3309 0.8780 0.3458 -54.118 -11.530 -19.448 A 98 SER B 93 SER~? A 123 HIS B 48 HIS~? A 172 ASP B 49 ASP~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM 0.9396 0.2509 -0.2327 -0.3170 0.3821 -0.8680 -0.1289 0.8894 0.4386 -60.085 85.261 -44.992 G 98 SER B 93 SER~? G 123 HIS B 48 HIS~? G 172 ASP B 49 ASP~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM -0.4956 0.0489 -0.8672 -0.8686 -0.0327 0.4945 -0.0042 0.9983 0.0587 119.806 134.237 -54.730 E 98 SER B 93 SER~? E 123 HIS B 48 HIS~? E 172 ASP B 49 ASP~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 4 3 RMSD = 1.27 A TRANSFORM -0.7659 -0.1706 -0.6199 0.6350 -0.0499 -0.7709 0.1006 -0.9841 0.1466 174.505 91.431 123.777 D 98 SER D 93 SER~? D 123 HIS D 48 HIS~? D 172 ASP D 49 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.27 A TRANSFORM 0.9480 0.3149 0.0468 0.0156 0.1008 -0.9948 -0.3180 0.9438 0.0906 -4.906 110.757 37.965 I 98 SER C 93 SER~? I 123 HIS C 48 HIS~? I 172 ASP C 49 ASP~? ULMNm 3 3qwd_o08 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.27 A TRANSFORM 0.6257 -0.0633 -0.7775 0.7784 -0.0141 0.6276 -0.0507 -0.9979 0.0404 110.249 -50.660 188.198 I 98 SER A 93 SER~? I 123 HIS A 48 HIS~? I 172 ASP A 49 ASP~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 2 3 RMSD = 1.27 A TRANSFORM -0.9581 -0.1847 -0.2188 -0.2214 -0.0070 0.9752 -0.1816 0.9828 -0.0342 167.716 52.438 -33.273 D 98 SER B 93 SER~? D 123 HIS B 48 HIS~? D 172 ASP B 49 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.27 A TRANSFORM 0.0525 -0.1641 -0.9850 -0.9980 -0.0428 -0.0461 -0.0346 0.9855 -0.1660 142.596 184.378 -25.691 C 98 SER C 93 SER~? C 123 HIS C 48 HIS~? C 172 ASP C 49 ASP~? ULMNm 3 3qwd_o02 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.27 A TRANSFORM 0.7321 0.2508 0.6333 -0.5971 -0.2111 0.7739 0.3278 -0.9447 -0.0048 -57.777 110.596 101.715 C 98 SER A 93 SER~? C 123 HIS A 48 HIS~? C 172 ASP A 49 ASP~? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.27 A TRANSFORM 0.6094 0.2089 0.7648 -0.7253 -0.2427 0.6442 0.3202 -0.9474 0.0036 39.694 101.533 152.766 N 98 SER A 93 SER~? N 123 HIS A 48 HIS~? N 172 ASP A 49 ASP~? ULMNm 3 3qwd_o13 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.27 A TRANSFORM -0.1316 -0.1700 -0.9766 -0.9902 -0.0232 0.1375 -0.0460 0.9852 -0.1653 250.322 138.691 25.985 N 98 SER C 93 SER~? N 123 HIS C 48 HIS~? N 172 ASP C 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.28 A TRANSFORM -0.7905 -0.0209 0.6121 -0.5433 -0.4376 -0.7165 0.2828 -0.8989 0.3346 100.099 172.267 92.105 A 98 SER A 93 SER~? A 123 HIS A 48 HIS~? A 172 ASP A 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.28 A TRANSFORM -0.7905 -0.0209 0.6121 -0.5433 -0.4376 -0.7165 0.2828 -0.8989 0.3346 100.099 172.267 92.105 A 98 SER A 93 SER~? A 123 HIS A 48 HIS~? A 172 ASP A 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.28 A TRANSFORM -0.9501 -0.2474 0.1899 0.0787 0.3990 0.9135 -0.3018 0.8829 -0.3597 161.745 -60.931 31.727 A 98 SER C 93 SER~? A 123 HIS C 48 HIS~? A 172 ASP C 49 ASP~? ULMNm 3 3qwd_o00 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.28 A TRANSFORM -0.9501 -0.2474 0.1899 0.0787 0.3990 0.9135 -0.3018 0.8829 -0.3597 161.745 -60.931 31.727 A 98 SER C 93 SER~? A 123 HIS C 48 HIS~? A 172 ASP C 49 ASP~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.28 A TRANSFORM -0.9489 -0.1993 -0.2447 0.3054 -0.3846 -0.8711 0.0795 -0.9013 0.4259 157.077 97.887 105.654 G 98 SER A 93 SER~? G 123 HIS A 48 HIS~? G 172 ASP A 49 ASP~? ULMNm 3 3qwd_o06 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.28 A TRANSFORM -0.4615 0.0098 0.8871 0.7353 0.5637 0.3762 -0.4964 0.8259 -0.2674 23.228 -103.966 49.359 G 98 SER C 93 SER~? G 123 HIS C 48 HIS~? G 172 ASP C 49 ASP~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.28 A TRANSFORM 0.9343 0.2956 0.1992 0.1624 0.1445 -0.9761 -0.3173 0.9443 0.0870 -102.612 115.732 -11.864 E 98 SER C 93 SER~? E 123 HIS C 48 HIS~? E 172 ASP C 49 ASP~? ULMNm 3 3qwd_o04 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.28 A TRANSFORM 0.4998 -0.0607 -0.8640 0.8649 -0.0194 0.5016 -0.0472 -0.9980 0.0428 35.867 -26.667 137.801 E 98 SER A 93 SER~? E 123 HIS A 48 HIS~? E 172 ASP A 49 ASP~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 3 3 RMSD = 1.29 A TRANSFORM 0.7922 0.1167 -0.5990 -0.5948 -0.0721 -0.8007 -0.1367 0.9905 0.0123 0.149 205.940 -30.556 D 98 SER C 93 SER~? D 123 HIS C 48 HIS~? D 172 ASP C 49 ASP~? ULMNm 3 3qwd_o03 ATP-DEPENDENT CLP PROTEASE PROTEOLYTuser 1 3 RMSD = 1.29 A TRANSFORM 0.9683 0.1391 -0.2076 0.2121 -0.0187 0.9771 0.1320 -0.9901 -0.0476 -42.064 15.537 123.711 D 98 SER A 93 SER~? D 123 HIS A 48 HIS~? D 172 ASP A 49 ASP~? ULMNm 3 1bhg_c04 BETA-GLUCURONIDASE user 6 3 RMSD = 1.29 A TRANSFORM 0.9576 0.2217 0.1841 0.2824 -0.5942 -0.7531 -0.0575 0.7732 -0.6316 -19.217 154.700 19.723 A 382 ARG D 115 ARG~? A 451 GLU D 30 GLU~? A 540 GLU D 36 GLU~? ULMNm 3 1bhg_c04 BETA-GLUCURONIDASE user 5 3 RMSD = 1.30 A TRANSFORM -0.9480 -0.2506 0.1965 -0.2974 0.4764 -0.8274 0.1137 -0.8428 -0.5261 201.092 110.699 146.716 A 382 ARG C 115 ARG~? A 451 GLU C 30 GLU~? A 540 GLU C 36 GLU~? ULMNm 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 RMSD = 1.31 A TRANSFORM -0.7570 -0.0305 0.6527 0.5938 -0.4489 0.6678 0.2726 0.8931 0.3579 134.336 14.744 -76.974 A 382 ARG A 115 ARG~? A 451 GLU A 30 GLU.? A 540 GLU A 36 GLU~? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 4 3 RMSD = 1.31 A TRANSFORM -0.6387 -0.0399 -0.7684 0.1942 0.9580 -0.2112 0.7445 -0.2841 -0.6041 136.505 -21.113 97.289 A 50 GLN B 27 GLN~? A 91 LEU B 26 LEU~? A 133 GLU B 24 GLU~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 4 3 RMSD = 1.32 A TRANSFORM -0.5779 0.8007 0.1579 0.5039 0.1978 0.8408 0.6420 0.5655 -0.5178 -4.045 -66.011 24.291 A 50 GLN B 27 GLN~? A 91 LEU B 26 LEU~? A 133 GLU B 24 GLU~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 13 3 RMSD = 1.33 A TRANSFORM -0.1246 -0.6957 -0.7075 -0.6661 0.5871 -0.4600 0.7354 0.4139 -0.5366 200.913 68.214 62.914 A 50 ASP D 139 ASP~? A 327 GLU A 92 GLU~? A 339 ARG A 89 ARG~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 4 3 RMSD = 1.36 A TRANSFORM -0.0384 0.6290 0.7765 0.7067 -0.5323 0.4661 0.7065 0.5666 -0.4241 -42.773 3.989 -10.293 C1050 GLN B 27 GLN~? C1091 LEU B 26 LEU~? C1133 GLU B 24 GLU~? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 5 3 RMSD = 1.37 A TRANSFORM -0.4500 0.0165 -0.8929 0.4239 -0.8761 -0.2298 -0.7860 -0.4819 0.3873 180.892 112.361 110.635 B 550 GLN B 27 GLN~? B 591 LEU B 26 LEU~? B 633 GLU B 24 GLU~? ULMNm 3 1qrz_c20 PLASMINOGEN user 4 3 RMSD = 1.38 A TRANSFORM -0.6217 -0.4931 -0.6086 0.7081 -0.0217 -0.7058 0.3348 -0.8697 0.3626 112.585 1.616 90.671 A 603 HIS D 55 HIS~? A 646 ASP D 49 ASP~? A 739 GLY D 59 GLY~? ULMNm 3 1hrk_c01 FERROCHELATASE user 1 3 RMSD = 1.41 A TRANSFORM -0.1281 -0.9886 -0.0788 -0.7568 0.0461 0.6520 -0.6410 0.1431 -0.7541 140.448 30.747 85.475 B 263 HIS A 48 HIS~? B 341 HIS A 55 HIS~? B 343 GLU A 92 GLU~? ULMNm 3 1hrk_c01 FERROCHELATASE user 3 3 RMSD = 1.41 A TRANSFORM 0.0809 0.9957 -0.0440 0.7479 -0.0315 0.6630 0.6588 -0.0866 -0.7473 -66.990 -103.644 -11.539 B 263 HIS B 48 HIS~? B 341 HIS B 55 HIS~? B 343 GLU B 92 GLU~? ULMNm 3 1hrk_c00 FERROCHELATASE user 1 3 RMSD = 1.42 A TRANSFORM 0.1396 0.9882 0.0628 0.7639 -0.0672 -0.6418 -0.6300 0.1376 -0.7643 -139.325 -29.688 85.532 A 263 HIS A 48 HIS~? A 341 HIS A 55 HIS~? A 343 GLU A 92 GLU~? ULMNm 3 1hrk_c00 FERROCHELATASE user 3 3 RMSD = 1.42 A TRANSFORM -0.0924 -0.9953 0.0279 -0.7563 0.0519 -0.6521 0.6477 -0.0813 -0.7576 70.212 102.180 -10.419 A 263 HIS B 48 HIS~? A 341 HIS B 55 HIS~? A 343 GLU B 92 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 14 3 RMSD = 1.42 A TRANSFORM 0.3731 -0.9009 -0.2216 -0.9232 -0.3843 0.0080 -0.0924 0.2016 -0.9751 113.504 163.404 74.864 A 228 ASP D 82 ASP~? A 260 ASP D 71 ASP~? A 329 ASP D 139 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 2 3 RMSD = 1.42 A TRANSFORM 0.1247 0.6094 0.7830 -0.6236 -0.5657 0.5396 0.7717 -0.5555 0.3095 -105.319 181.000 -13.557 A 228 ASP A 42 ASP~? A 260 ASP A 114 ASP~? A 329 ASP A 35 ASP~? ULMNm 3 1hrk_c01 FERROCHELATASE user 5 3 RMSD = 1.43 A TRANSFORM -0.2403 0.9481 0.2083 -0.9523 -0.2718 0.1385 0.1879 -0.1651 0.9682 -39.218 110.559 -70.873 B 263 HIS C 48 HIS~? B 341 HIS C 55 HIS~? B 343 GLU C 92 GLU~? ULMNm 3 1hrk_c00 FERROCHELATASE user 5 3 RMSD = 1.43 A TRANSFORM 0.2588 -0.9438 -0.2058 0.9450 0.2915 -0.1486 0.2002 -0.1560 0.9672 38.109 -110.537 -72.809 A 263 HIS C 48 HIS~? A 341 HIS C 55 HIS~? A 343 GLU C 92 GLU~? ULMNm 3 1hrk_c01 FERROCHELATASE user 7 3 RMSD = 1.44 A TRANSFORM 0.2399 -0.9227 0.3019 0.9374 0.3010 0.1751 -0.2525 0.2410 0.9371 85.598 -121.596 -69.021 B 263 HIS D 48 HIS~? B 341 HIS D 55 HIS~? B 343 GLU D 92 GLU~? ULMNm 3 1hrk_c00 FERROCHELATASE user 7 3 RMSD = 1.44 A TRANSFORM -0.2581 0.9184 -0.3000 -0.9293 -0.3209 -0.1829 -0.2643 0.2316 0.9362 -82.443 123.772 -66.976 A 263 HIS D 48 HIS~? A 341 HIS D 55 HIS~? A 343 GLU D 92 GLU~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 9 3 RMSD = 1.44 A TRANSFORM -0.3605 -0.6697 -0.6493 -0.9275 0.3312 0.1733 0.0990 0.6647 -0.7406 142.648 153.079 6.151 A 228 ASP C 42 ASP~? A 260 ASP C 114 ASP~? A 329 ASP C 35 ASP~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 5 3 RMSD = 1.45 A TRANSFORM -0.0980 -0.6169 0.7809 0.5875 0.5975 0.5457 -0.8033 0.5123 0.3038 29.132 -41.747 31.344 A 228 ASP B 42 ASP~? A 260 ASP B 114 ASP~? A 329 ASP B 35 ASP~? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 33 3 RMSD = 1.45 A TRANSFORM 0.3020 0.8113 0.5005 0.4305 -0.5845 0.6877 0.8506 0.0077 -0.5258 -175.573 42.798 39.014 A 130 SER D 116 SER~? A 166 PHE D 108 PHE~? A 182 PHE D 155 PHE~? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 13 3 RMSD = 1.46 A TRANSFORM 0.4131 0.5845 -0.6984 0.9075 -0.3285 0.2619 -0.0763 -0.7420 -0.6661 -40.876 39.042 151.828 A 228 ASP D 42 ASP~? A 260 ASP D 114 ASP~? A 329 ASP D 35 ASP~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.46 A TRANSFORM 0.9043 -0.3291 -0.2720 -0.3170 -0.9443 0.0888 -0.2861 0.0059 -0.9582 -18.647 175.111 176.142 A 50 GLN A 27 GLN~? A 91 LEU A 26 LEU~? A 133 GLU A 28 GLU~? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 RMSD = 1.46 A TRANSFORM 0.3753 0.8775 -0.2986 -0.8138 0.4661 0.3471 0.4438 0.1127 0.8890 -28.018 75.025 -79.622 B 550 GLN A 27 GLN~? B 591 LEU A 26 LEU~? B 633 GLU A 28 GLU~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.46 A TRANSFORM 0.3696 -0.9285 -0.0364 -0.8670 -0.3587 0.3460 -0.3343 -0.0963 -0.9375 118.880 157.070 167.691 C1050 GLN A 27 GLN~? C1091 LEU A 26 LEU~? C1133 GLU A 28 GLU~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 33 3 RMSD = 1.46 A TRANSFORM -0.7793 -0.6252 -0.0410 -0.4370 0.5893 -0.6795 0.4490 -0.5116 -0.7326 124.362 58.330 101.847 C 130 SER D 116 SER~? C 166 PHE D 108 PHE~? C 182 PHE D 155 PHE~? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 14 3 RMSD = 1.46 A TRANSFORM 0.8163 -0.3557 -0.4551 0.2316 0.9233 -0.3064 0.5292 0.1447 0.8361 -26.615 -14.184 -54.634 D 130 SER B 116 SER~? D 166 PHE B 155 PHE~? D 182 PHE B 108 PHE~? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 5 3 RMSD = 1.47 A TRANSFORM -0.7827 0.6222 -0.0169 -0.6151 -0.7773 -0.1321 -0.0953 -0.0930 0.9911 -17.319 203.619 39.257 A 130 SER A 116 SER~? A 166 PHE A 108 PHE~? A 182 PHE A 155 PHE~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 14 3 RMSD = 1.47 A TRANSFORM 0.1216 0.8387 0.5308 -0.9394 -0.0754 0.3344 0.3204 -0.5393 0.7787 -29.965 136.482 114.967 A 50 ASP D 180 ASP~? A 327 GLU C 92 GLU~? A 339 ARG C 89 ARG~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 RMSD = 1.47 A TRANSFORM 0.9911 0.1328 0.0111 -0.1019 0.7008 0.7060 0.0860 -0.7009 0.7081 -1.789 -56.538 167.689 B 382 ARG D 115 ARG~? B 451 GLU D 30 GLU~? B 540 GLU D 36 GLU~? ULMNm 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 RMSD = 1.47 A TRANSFORM 0.5100 0.5017 -0.6987 0.7238 -0.6892 0.0334 -0.4648 -0.5227 -0.7146 33.394 58.402 271.277 A 50 ASP A 159 ASP~? A 327 GLU B 137 GLU~? A 339 ARG B 136 ARG~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 RMSD = 1.48 A TRANSFORM -0.6188 -0.0784 0.7816 -0.6915 0.5264 -0.4946 -0.3727 -0.8466 -0.3800 117.922 98.575 285.817 B 382 ARG A 115 ARG~? B 451 GLU A 30 GLU.? B 540 GLU A 36 GLU~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 5 3 RMSD = 1.48 A TRANSFORM 0.6577 -0.4161 -0.6279 0.6112 0.7820 0.1220 0.4403 -0.4640 0.7687 3.718 -101.512 -2.098 C 130 SER A 116 SER~? C 166 PHE A 108 PHE~? C 182 PHE A 155 PHE~? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 RMSD = 1.48 A TRANSFORM -0.9814 -0.1918 0.0122 0.1269 -0.5989 0.7907 -0.1444 0.7775 0.6121 210.936 40.500 58.761 B 382 ARG C 115 ARG~? B 451 GLU C 30 GLU~? B 540 GLU C 36 GLU~? ULMNm 3 1cns_c01 CHITINASE user 8 3 RMSD = 1.48 A TRANSFORM 0.0147 -0.6979 -0.7161 0.6551 0.5478 -0.5204 0.7554 -0.4614 0.4652 121.558 -56.160 -7.664 B 67 GLU B 172 GLU~? B 89 GLU B 30 GLU~? B 120 SER B 111 SER~? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 14 3 RMSD = 1.49 A TRANSFORM 0.8061 -0.5909 -0.0328 0.5891 0.8065 -0.0509 0.0566 0.0217 0.9982 -49.362 -61.206 10.266 A 130 SER B 116 SER~? A 166 PHE B 108 PHE~? A 182 PHE B 155 PHE~? ULMNm 3 2odj_o00 PORIN D user 1 3 RMSD = 1.49 A TRANSFORM -0.1109 0.6083 -0.7859 -0.3630 -0.7609 -0.5378 -0.9252 0.2257 0.3052 25.969 136.663 67.281 A 156 HIS B 100 HIS~? A 208 ASP B 49 ASP~? A 296 SER B 111 SER~? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 23 3 RMSD = 1.49 A TRANSFORM 0.5648 0.7143 0.4134 0.1471 -0.5800 0.8012 0.8120 -0.3917 -0.4326 -75.261 42.018 123.860 A 40 LYS B 39 LYS~? A 41 LYS B 38 LYS~? A 42 ILE B 40 ILE~? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 35 3 RMSD = 1.49 A TRANSFORM -0.8448 0.4708 0.2543 -0.5336 -0.7061 -0.4655 -0.0396 -0.5289 0.8477 95.458 191.077 129.505 A 40 LYS C 39 LYS~? A 41 LYS C 38 LYS~? A 42 ILE C 40 ILE~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 14 3 RMSD = 1.49 A TRANSFORM -0.6505 0.4385 -0.6201 -0.5846 -0.8103 0.0403 -0.4848 0.3887 0.7835 46.408 163.414 -0.390 C 130 SER B 116 SER~? C 166 PHE B 108 PHE~? C 182 PHE B 155 PHE~? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 47 3 RMSD = 1.49 A TRANSFORM 0.8134 -0.4614 0.3541 0.5814 0.6280 -0.5172 0.0163 0.6266 0.7792 22.344 -31.755 17.482 A 40 LYS D 39 LYS~? A 41 LYS D 38 LYS~? A 42 ILE D 40 ILE~? ULMNm 3 1bol_c00 RIBONUCLEASE RH user 1 3 RMSD = 1.50 A TRANSFORM -0.9269 -0.0758 0.3675 -0.3549 -0.1407 -0.9242 0.1218 -0.9871 0.1035 131.130 130.974 90.668 A 46 HIS A 48 HIS~? A 105 GLU A 92 GLU~? A 109 HIS A 55 HIS~?