*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 0.94 A TRANSFORM -0.7313 -0.5816 -0.3563 -0.5209 0.8134 -0.2588 -0.4404 0.0037 0.8978 -20.058 38.249 -18.067 141 ASP B 70 ASP^? 166 GLY B 92 GLY~? 169 GLU B 98 GLU~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 2 3 RMSD = 0.97 A TRANSFORM 0.8445 0.3570 -0.3992 -0.2420 -0.4106 -0.8791 0.4778 -0.8390 0.2603 51.460 100.598 -9.547 A 459 ASN A 95 ASN~? A 460 GLY A 92 GLY~? A 461 ASN B 42 ASN~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.07 A TRANSFORM 0.7367 0.5790 -0.3492 0.5060 -0.8147 -0.2833 0.4486 -0.0320 0.8932 24.779 11.989 -8.588 141 ASP A 70 ASP^? 166 GLY A 92 GLY~? 169 GLU A 98 GLU~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.11 A TRANSFORM -0.2631 -0.8202 0.5079 0.1714 0.4783 0.8613 0.9494 -0.3136 -0.0147 -29.404 60.233 122.449 A 1 ALA A 46 ALA~? A 74 ASN A 42 ASN~? A 75 GLY B 92 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.12 A TRANSFORM 0.3539 -0.3799 0.8546 0.9279 0.2571 -0.2700 0.1171 -0.8886 -0.4435 19.439 30.968 16.264 B 1 ALA A 46 ALA~? B 74 ASN A 42 ASN~? B 75 GLY B 92 GLY~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.14 A TRANSFORM 0.0838 -0.1090 -0.9905 -0.3811 -0.9219 0.0692 0.9207 -0.3717 0.1188 30.380 -8.397 32.676 C 1 ALA A 46 ALA~? C 74 ASN A 42 ASN~? C 75 GLY B 92 GLY~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.16 A TRANSFORM 0.2847 0.7966 0.5333 -0.1602 -0.5089 0.8458 -0.9451 0.3262 0.0172 15.198 32.971 114.920 A 1 ALA B 46 ALA~? A 74 ASN B 42 ASN~? A 75 GLY A 92 GLY~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.16 A TRANSFORM 0.6773 0.3217 -0.6616 -0.7270 0.1547 -0.6690 0.1129 -0.9341 -0.3387 8.791 51.356 102.556 D 1 ALA A 46 ALA~? D 74 ASN A 42 ASN~? D 75 GLY B 92 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.17 A TRANSFORM -0.3311 0.3509 0.8759 -0.9366 -0.2350 -0.2599 -0.1147 0.9064 -0.4065 28.436 -2.863 55.806 B 1 ALA B 46 ALA~? B 74 ASN B 42 ASN~? B 75 GLY A 92 GLY~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 4 3 RMSD = 1.18 A TRANSFORM -0.9625 -0.2701 -0.0255 -0.0388 0.2300 -0.9724 -0.2685 0.9350 0.2318 7.823 121.562 23.712 A 459 ASN B 95 ASN~? A 460 GLY B 92 GLY~? A 461 ASN A 42 ASN~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 3 3 RMSD = 1.18 A TRANSFORM -0.7630 0.5233 0.3795 0.1570 -0.4195 0.8941 -0.6270 -0.7418 -0.2379 7.465 67.569 -16.690 A 459 ASN B 42 ASN~? A 460 GLY A 92 GLY~? A 461 ASN A 95 ASN~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 3 3 RMSD = 1.19 A TRANSFORM -0.1028 0.1481 -0.9836 0.3949 0.9136 0.0963 -0.9129 0.3786 0.1525 34.262 44.107 28.462 C 1 ALA B 46 ALA~? C 74 ASN B 42 ASN~? C 75 GLY A 92 GLY~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.21 A TRANSFORM -0.6948 -0.2873 -0.6593 0.7112 -0.1378 -0.6894 -0.1073 0.9479 -0.3001 -21.891 61.657 144.281 D 1 ALA B 46 ALA~? D 74 ASN B 42 ASN~? D 75 GLY A 92 GLY~? ULMNm 3 1t7d_c01 SIGNAL PEPTIDASE I user 2 3 RMSD = 1.21 A TRANSFORM -0.1026 -0.0524 -0.9933 -0.9689 0.2312 0.0879 -0.2251 -0.9715 0.0745 70.953 -1.735 4.547 B 88 SER A 72 SER.? B 90 SER A 15 SER^? B 145 LYS A 68 LYS^? ULMNm 3 1t7d_c00 SIGNAL PEPTIDASE I user 2 3 RMSD = 1.23 A TRANSFORM -0.1862 0.0343 0.9819 0.9411 -0.2808 0.1883 -0.2822 -0.9591 -0.0200 -16.773 48.942 7.526 A 88 SER A 72 SER.? A 90 SER A 15 SER^? A 145 LYS A 68 LYS^? ULMNm 3 1t7d_c01 SIGNAL PEPTIDASE I user 4 3 RMSD = 1.23 A TRANSFORM 0.0887 0.0691 -0.9937 0.9666 -0.2469 0.0691 0.2406 0.9666 0.0887 75.637 9.624 55.907 B 88 SER B 72 SER.? B 90 SER B 15 SER^? B 145 LYS B 68 LYS^? ULMNm 3 1t7d_c00 SIGNAL PEPTIDASE I user 4 3 RMSD = 1.24 A TRANSFORM 0.2004 -0.0551 0.9782 -0.9336 0.2919 0.2077 0.2970 0.9549 -0.0071 -13.944 40.667 59.601 A 88 SER B 72 SER.? A 90 SER B 15 SER^? A 145 LYS B 68 LYS^? ULMNm 3 1amo_c00 NADPH-CYTOCHROME P450 REDUCTASE user 1 3 RMSD = 1.25 A TRANSFORM -0.7120 -0.6816 -0.1691 0.0975 0.1425 -0.9850 -0.6954 0.7177 0.0350 -20.843 46.330 40.547 A 457 SER B 24 SER.? A 630 CYH B 33 CYH~? A 675 ASP B 30 ASP~? ULMNm 3 1amo_c01 NADPH-CYTOCHROME P450 REDUCTASE user 1 3 RMSD = 1.25 A TRANSFORM 0.6608 0.7301 0.1741 -0.0214 -0.2136 0.9767 -0.7502 0.6491 0.1256 73.311 -21.875 33.638 B 457 SER B 24 SER.? B 630 CYH B 33 CYH~? B 675 ASP B 30 ASP~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 4 3 RMSD = 1.29 A TRANSFORM 0.6923 0.0521 0.7197 0.7086 -0.2374 -0.6645 -0.1363 -0.9700 0.2012 34.737 25.847 -1.334 B 1 ALA B 88 ALA~? B 74 ASN A 42 ASN~? B 75 GLY B 92 GLY~? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.31 A TRANSFORM -0.6811 -0.0607 0.7297 -0.7140 0.2762 -0.6434 0.1625 0.9592 0.2314 15.681 21.109 47.787 B 1 ALA A 88 ALA~? B 74 ASN B 42 ASN~? B 75 GLY A 92 GLY~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 4 3 RMSD = 1.32 A TRANSFORM -0.0345 -0.2827 0.9586 0.5715 0.7813 0.2510 0.8199 -0.5565 -0.1346 -24.697 83.211 117.978 A 1 ALA B 88 ALA~? A 74 ASN A 42 ASN~? A 75 GLY B 92 GLY~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.32 A TRANSFORM 0.1384 -0.0639 0.9883 -0.0126 -0.9979 -0.0628 -0.9903 0.0038 0.1389 40.272 -23.592 -3.362 A 67 ASP B 52 ASP.? A 68 ALA B 51 ALA~? A 72 LEU B 47 LEU~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 4 3 RMSD = 1.33 A TRANSFORM -0.3913 -0.6434 -0.6580 -0.3467 -0.5592 0.7530 0.8524 -0.5228 0.0042 7.280 -14.125 30.689 C 1 ALA B 88 ALA~? C 74 ASN A 42 ASN~? C 75 GLY B 92 GLY~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.33 A TRANSFORM 0.0577 0.2487 0.9669 -0.5861 -0.7756 0.2345 -0.8082 0.5802 -0.1010 -11.116 32.633 125.476 A 1 ALA A 88 ALA~? A 74 ASN B 42 ASN~? A 75 GLY A 92 GLY~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 RMSD = 1.34 A TRANSFORM 0.3954 0.6562 -0.6426 0.3732 0.5245 0.7653 -0.8393 0.5424 0.0374 47.396 19.992 35.724 C 1 ALA A 88 ALA~? C 74 ASN B 42 ASN~? C 75 GLY A 92 GLY~? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.37 A TRANSFORM -0.1621 0.0316 0.9863 0.0195 0.9994 -0.0288 0.9866 -0.0145 0.1626 39.290 23.844 19.253 A 67 ASP A 52 ASP.? A 68 ALA A 51 ALA~? A 72 LEU A 47 LEU~? ULMNm 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.39 A TRANSFORM -0.1932 -0.9523 0.2363 0.1899 -0.2726 -0.9432 -0.9626 0.1374 -0.2335 14.383 70.409 -18.675 L 142 LYS A 68 LYS^? L 217 SER A 15 SER^? L 241 SER A 72 SER.? ULMNm 3 1qrz_c21 PLASMINOGEN user 1 3 RMSD = 1.41 A TRANSFORM -0.7669 0.4079 0.4954 -0.6381 -0.4025 -0.6564 0.0683 0.8195 -0.5690 -57.699 -0.240 43.631 B 603 HIS B 21 HIS.? B 646 ASP B 60 ASP^? B 739 GLY B 25 GLY.? ULMNm 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 4 3 RMSD = 1.41 A TRANSFORM 0.2019 0.9468 0.2506 -0.2044 0.2910 -0.9346 0.9578 -0.1374 -0.2523 64.109 78.699 -2.609 L 142 LYS B 68 LYS^? L 217 SER B 15 SER^? L 241 SER B 72 SER.? ULMNm 3 1qrz_c22 PLASMINOGEN user 1 3 RMSD = 1.41 A TRANSFORM -0.3237 -0.6626 0.6754 0.6579 0.3554 0.6640 0.6800 -0.6593 -0.3209 -46.702 -7.756 2.427 C 603 HIS B 21 HIS.? C 646 ASP B 60 ASP^? C 739 GLY B 25 GLY.? ULMNm 3 1mt5_c07 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.41 A TRANSFORM 0.2028 0.9328 -0.2980 -0.3425 0.3527 0.8708 -0.9174 0.0745 -0.3910 57.584 -9.315 -12.850 H 142 LYS A 68 LYS^? H 217 SER A 15 SER^? H 241 SER A 72 SER.? ULMNm 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.42 A TRANSFORM 0.6937 -0.4597 -0.5545 -0.5978 -0.7969 -0.0873 0.4017 -0.3921 0.8276 102.750 3.955 46.942 F 142 LYS A 68 LYS^? F 217 SER A 15 SER^? F 241 SER A 72 SER.? ULMNm 3 1mt5_c07 FATTY-ACID AMIDE HYDROLASE user 4 3 RMSD = 1.42 A TRANSFORM -0.2127 -0.9259 -0.3122 0.3552 -0.3709 0.8581 0.9103 -0.0717 -0.4078 8.557 -17.851 5.094 H 142 LYS B 68 LYS^? H 217 SER B 15 SER^? H 241 SER B 72 SER.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.42 A TRANSFORM -0.3306 -0.9295 -0.1634 -0.7640 0.3652 -0.5318 -0.5540 0.0510 0.8309 -25.568 3.964 -14.398 141 ASP B 52 ASP.? 166 GLY A 11 GLY.? 169 GLU A 14 GLU^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.43 A TRANSFORM 0.3362 0.9332 -0.1268 0.7490 -0.3466 -0.5647 0.5710 -0.0949 0.8155 25.978 5.106 -4.674 141 ASP A 52 ASP.? 166 GLY B 11 GLY.? 169 GLU B 14 GLU^? ULMNm 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 4 3 RMSD = 1.43 A TRANSFORM -0.7009 0.4730 -0.5338 0.6000 0.7957 -0.0830 -0.3855 0.3785 0.8415 108.127 55.770 56.243 F 142 LYS B 68 LYS^? F 217 SER B 15 SER^? F 241 SER B 72 SER.? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 1 3 RMSD = 1.44 A TRANSFORM 0.7920 -0.5764 0.2012 0.1952 0.5513 0.8111 0.5785 0.6031 -0.5492 3.128 91.384 36.453 A 459 ASN A 42 ASN~? A 460 GLY B 92 GLY~? A 461 ASN B 95 ASN~? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.44 A TRANSFORM -0.3022 -0.6354 0.7106 0.6516 0.4064 0.6405 0.6958 -0.6566 -0.2912 -100.599 -4.967 40.024 D 603 HIS B 21 HIS.? D 646 ASP B 60 ASP^? D 739 GLY B 25 GLY.? ULMNm 3 1cns_c01 CHITINASE user 1 3 RMSD = 1.44 A TRANSFORM 0.7774 0.6285 -0.0232 0.2571 -0.3512 -0.9003 0.5740 -0.6940 0.4347 35.621 -8.186 38.623 B 67 GLU A 87 GLU~? B 89 GLU A 14 GLU^? B 120 SER A 78 SER.? ULMNm 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.45 A TRANSFORM -0.4667 -0.4928 -0.7343 0.6915 -0.7210 0.0444 0.5514 0.4871 -0.6773 4.120 92.397 51.794 I 142 LYS A 68 LYS^? I 217 SER A 15 SER^? I 241 SER A 72 SER.? ULMNm 3 1cns_c00 CHITINASE user 6 3 RMSD = 1.45 A TRANSFORM 0.4259 0.8961 -0.1248 0.8788 -0.3768 0.2928 -0.2154 0.2344 0.9480 5.461 -12.411 40.512 A 67 GLU B 102 GLU.? A 89 GLU B 26 GLU~? A 120 SER B 0 SER.? ULMNm 3 1mt5_c14 FATTY-ACID AMIDE HYDROLASE user 1 3 RMSD = 1.45 A TRANSFORM 0.2388 -0.9710 0.0077 0.0505 0.0204 0.9985 0.9697 0.2381 -0.0539 77.574 47.259 71.534 O 142 LYS A 68 LYS^? O 217 SER A 15 SER^? O 241 SER A 72 SER.? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.45 A TRANSFORM -0.0306 0.9967 0.0749 -0.9990 -0.0280 -0.0356 0.0334 0.0759 -0.9966 9.139 11.478 59.165 A 51 ALA A 22 ALA.? A 148 HIS A 21 HIS.? A 163 ASP A 60 ASP^? ULMNm 3 1qrz_c20 PLASMINOGEN user 1 3 RMSD = 1.46 A TRANSFORM -0.7327 0.4385 0.5205 -0.6710 -0.3374 -0.6602 0.1139 0.8330 -0.5414 -29.271 1.899 82.126 A 603 HIS B 21 HIS.? A 646 ASP B 60 ASP^? A 739 GLY B 25 GLY.? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 RMSD = 1.46 A TRANSFORM 0.3726 -0.0122 0.9279 0.4716 -0.8587 -0.2007 -0.7992 -0.5124 0.3142 -49.821 24.916 47.804 B 34 SER B 100 SER~? B 37 ASN B 99 ASN~? B 45 THR B 38 THR~? ULMNm 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 4 3 RMSD = 1.46 A TRANSFORM 0.4565 0.5040 -0.7332 -0.6870 0.7233 0.0695 -0.5653 -0.4720 -0.6765 38.311 110.341 15.612 I 142 LYS B 68 LYS^? I 217 SER B 15 SER^? I 241 SER B 72 SER.? ULMNm 3 1mt5_c14 FATTY-ACID AMIDE HYDROLASE user 4 3 RMSD = 1.46 A TRANSFORM -0.2347 0.9716 0.0294 -0.0333 -0.0383 0.9987 -0.9715 -0.2334 -0.0414 117.986 45.310 37.409 O 142 LYS B 68 LYS^? O 217 SER B 15 SER^? O 241 SER B 72 SER.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 RMSD = 1.46 A TRANSFORM 0.2469 0.9517 0.1824 -0.9282 0.1782 0.3265 -0.2783 0.2500 -0.9274 78.775 -10.191 26.550 A 67 ASP B 52 ASP.? A 68 ALA B 51 ALA~? A 72 LEU B 50 LEU~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.47 A TRANSFORM 0.5339 -0.4268 -0.7299 0.1296 0.8944 -0.4282 -0.8355 -0.1340 -0.5329 83.153 54.288 24.780 199 ASP A 63 ASP.? 218 GLU B 102 GLU.? 329 ASP A 60 ASP^? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.47 A TRANSFORM 0.0264 -0.9990 -0.0373 -0.9995 -0.0269 0.0137 0.0147 -0.0370 0.9992 -42.901 10.273 17.618 B 51 ALA A 22 ALA.? B 148 HIS A 21 HIS.? B 163 ASP A 60 ASP^? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.47 A TRANSFORM 0.2842 -0.4068 0.8682 -0.6384 0.5953 0.4879 0.7154 0.6929 0.0905 -9.445 71.181 67.362 A 228 ASP B 60 ASP^? A 261 ASP B 30 ASP~? A 329 ASP B 63 ASP~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.48 A TRANSFORM -0.9977 -0.0336 -0.0589 -0.0276 0.9946 -0.0999 -0.0620 0.0980 0.9933 -1.591 29.398 -49.768 F 51 ALA A 22 ALA.? F 148 HIS A 21 HIS.? F 163 ASP A 60 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.49 A TRANSFORM 0.7281 -0.4247 0.5380 0.6813 0.3623 -0.6361 -0.0753 -0.8297 -0.5531 -17.387 49.003 -2.781 141 ASP B 30 ASP~? 166 GLY A 92 GLY~? 169 GLU A 98 GLU~? ULMNm 3 1ig8_c00 HEXOKINASE PII user 2 3 RMSD = 1.49 A TRANSFORM -0.9571 -0.1878 -0.2204 -0.2703 0.3064 0.9127 0.1039 -0.9332 0.3441 7.743 80.571 -33.274 A 158 SER B 78 SER.? A 173 ARG B 9 ARG^? A 211 ASP B 79 ASP~? ULMNm 3 1cns_c01 CHITINASE user 2 3 RMSD = 1.49 A TRANSFORM -0.7660 -0.6425 -0.0204 -0.3144 0.4021 -0.8599 -0.5607 0.6523 0.5100 -13.003 2.869 56.237 B 67 GLU B 87 GLU~? B 89 GLU B 14 GLU^? B 120 SER B 78 SER.? ULMNm 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 RMSD = 1.49 A TRANSFORM 0.6873 -0.3981 0.6075 0.2651 0.9162 0.3005 0.6763 0.0455 -0.7353 6.735 20.269 37.867 159 ARG A 9 ARG^? 229 SER A 15 SER^? 325 GLU A 14 GLU^? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.49 A TRANSFORM -0.3534 0.0106 0.9354 -0.4705 0.8623 -0.1875 0.8086 0.5064 0.2997 -57.998 54.775 91.316 B 34 SER A 100 SER~? B 37 ASN A 99 ASN~? B 45 THR A 38 THR~?