*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 0.65 A TRANSFORM 0.2134 0.6572 0.7229 0.4841 0.5716 -0.6625 0.8486 -0.4913 0.1961 -84.840 15.621 -46.334 B 603 HIS A 34 HIS~? B 646 ASP B 49 ASP~? B 739 GLY B 32 GLY~? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 0.66 A TRANSFORM -0.6585 -0.2138 -0.7216 -0.5698 -0.4847 0.6636 0.4916 -0.8482 -0.1973 31.048 66.018 -4.660 B 603 HIS B 34 HIS~? B 646 ASP A 49 ASP~? B 739 GLY A 32 GLY~? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 0.80 A TRANSFORM -0.9569 -0.2725 -0.1004 0.2713 -0.9622 0.0255 0.1036 0.0028 -0.9946 73.188 82.988 22.896 A 603 HIS A 34 HIS~? A 646 ASP B 49 ASP~? A 739 GLY B 32 GLY~? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 0.81 A TRANSFORM -0.9681 -0.2157 -0.1278 0.2089 -0.9758 0.0649 0.1387 -0.0362 -0.9897 69.795 84.156 85.888 C 603 HIS A 34 HIS~? C 646 ASP B 49 ASP~? C 739 GLY B 32 GLY~? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 0.81 A TRANSFORM 0.2719 0.9571 0.1000 0.9623 -0.2705 -0.0276 -0.0006 -0.1037 0.9946 -36.564 26.114 -26.365 A 603 HIS B 34 HIS~? A 646 ASP A 49 ASP~? A 739 GLY A 32 GLY~? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 0.82 A TRANSFORM 0.2152 0.9682 0.1275 0.9758 -0.2081 -0.0671 0.0384 -0.1388 0.9896 -37.707 23.166 36.591 C 603 HIS B 34 HIS~? C 646 ASP A 49 ASP~? C 739 GLY A 32 GLY~? ULMNm 3 2odj_o00 PORIN D user 8 3 RMSD = 1.02 A TRANSFORM -0.5970 0.0020 0.8023 0.3228 -0.9149 0.2425 -0.7344 -0.4038 -0.5455 -4.389 51.670 100.988 A 156 HIS B 110 HIS.? A 208 ASP B 67 ASP~? A 296 SER A 101 SER.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 1.02 A TRANSFORM -0.9504 -0.2560 -0.1763 -0.0076 0.5861 -0.8102 -0.3108 0.7687 0.5590 91.971 24.220 -22.020 A 229 ALA A 37 ALA~? A 257 ALA A 40 ALA~? A 328 ASP A 47 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 RMSD = 1.02 A TRANSFORM 0.2521 0.9511 0.1782 -0.5855 0.0033 0.8106 -0.7704 0.3087 -0.5578 -20.230 25.879 49.511 A 229 ALA B 37 ALA~? A 257 ALA B 40 ALA~? A 328 ASP B 47 ASP~? ULMNm 3 2odj_o00 PORIN D user 4 3 RMSD = 1.02 A TRANSFORM -0.0033 0.5983 -0.8013 0.9152 -0.3211 -0.2435 0.4030 0.7341 0.5465 -7.768 15.763 -27.065 A 156 HIS A 110 HIS.? A 208 ASP A 67 ASP~? A 296 SER B 101 SER.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.02 A TRANSFORM -0.6767 -0.0463 -0.7348 0.5815 0.5786 -0.5719 -0.4516 0.8143 0.3646 40.391 -8.814 -26.633 141 ASP A 87 ASP~? 166 GLY B 59 GLY.? 169 GLU B 62 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 RMSD = 1.04 A TRANSFORM 0.0467 0.6752 0.7362 -0.5748 -0.5845 0.5726 -0.8169 0.4499 -0.3608 -63.651 55.748 25.444 141 ASP B 87 ASP~? 166 GLY A 59 GLY.? 169 GLU A 62 GLU.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 8 3 RMSD = 1.16 A TRANSFORM -0.1734 0.5737 0.8005 0.5896 -0.5906 0.5510 -0.7889 -0.5675 0.2358 -13.222 23.464 66.660 A 229 ALA B 98 ALA~? A 257 ALA B 94 ALA~? A 328 ASP B 17 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 1.17 A TRANSFORM -0.5722 0.1740 -0.8015 0.5927 -0.5877 -0.5507 0.5669 0.7901 -0.2331 67.395 55.466 -34.269 A 229 ALA A 98 ALA~? A 257 ALA A 94 ALA~? A 328 ASP A 17 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.21 A TRANSFORM 0.3533 0.4760 0.8054 0.4195 0.6889 -0.5912 0.8362 -0.5467 -0.0436 -88.479 8.836 27.642 D 603 HIS A 34 HIS~? D 646 ASP B 49 ASP~? D 739 GLY B 32 GLY~? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.22 A TRANSFORM -0.4774 -0.3536 -0.8044 -0.6872 -0.4202 0.5926 0.5476 -0.8357 0.0424 28.753 67.860 49.541 D 603 HIS B 34 HIS~? D 646 ASP A 49 ASP~? D 739 GLY A 32 GLY~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.23 A TRANSFORM -0.1499 -0.6501 0.7449 0.9004 0.2215 0.3745 0.4085 -0.7269 -0.5521 78.461 -74.535 -6.843 B 37 ASP A 49 ASP~? B 56 ILE A 46 ILE.? B 82 TYR A 76 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 RMSD = 1.24 A TRANSFORM -0.1424 -0.6498 0.7466 0.9133 0.2046 0.3523 0.3817 -0.7320 -0.5643 75.225 -57.498 22.391 A 37 ASP A 49 ASP~? A 56 ILE A 46 ILE.? A 82 TYR A 76 TYR~? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 RMSD = 1.27 A TRANSFORM -0.0060 0.9935 -0.1136 0.6695 0.0884 0.7375 -0.7428 0.0717 0.6657 -29.047 -63.575 91.740 A 14 ASP A 49 ASP~? A 16 HIS B 34 HIS~? A 67 GLY A 59 GLY.? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 RMSD = 1.27 A TRANSFORM -0.9933 0.0043 0.1151 -0.0884 -0.6688 -0.7381 -0.0738 0.7434 -0.6648 47.790 43.593 73.982 A 14 ASP B 49 ASP~? A 16 HIS A 34 HIS~? A 67 GLY B 59 GLY.? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 RMSD = 1.29 A TRANSFORM -0.1590 0.9869 0.0267 -0.6684 -0.0877 -0.7386 0.7266 0.1353 -0.6736 -26.204 94.731 65.880 C 14 ASP A 49 ASP~? C 16 HIS B 34 HIS~? C 67 GLY A 59 GLY.? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 RMSD = 1.29 A TRANSFORM -0.9872 0.1575 -0.0252 0.0877 0.6677 0.7392 -0.1333 -0.7276 0.6730 45.356 -12.349 99.306 C 14 ASP B 49 ASP~? C 16 HIS A 34 HIS~? C 67 GLY B 59 GLY.? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.31 A TRANSFORM -0.6935 -0.0893 -0.7149 0.3088 -0.9334 -0.1830 0.6509 0.3477 -0.6749 32.513 22.468 25.300 B 49 ASP B 49 ASP~? B 86 HIS A 34 HIS~? B 250 ALA A 37 ALA~? ULMNm 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.31 A TRANSFORM 0.0878 0.6919 0.7166 0.9338 -0.3077 0.1826 -0.3468 -0.6531 0.6732 -75.372 -41.071 70.336 B 49 ASP A 49 ASP~? B 86 HIS B 34 HIS~? B 250 ALA B 37 ALA~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 RMSD = 1.32 A TRANSFORM 0.7098 0.1178 -0.6945 -0.2334 -0.8909 -0.3897 0.6646 -0.4387 0.6048 51.390 42.840 -64.152 B 37 ASP B 49 ASP~? B 56 ILE B 46 ILE.? B 82 TYR B 76 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 RMSD = 1.32 A TRANSFORM 0.7097 0.1096 -0.6959 -0.2191 -0.9045 -0.3659 0.6696 -0.4122 0.6179 48.922 58.318 -38.343 A 37 ASP B 49 ASP~? A 56 ILE B 46 ILE.? A 82 TYR B 76 TYR~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 1 3 RMSD = 1.36 A TRANSFORM -0.0602 0.9964 0.0604 -0.5072 0.0216 -0.8616 0.8597 0.0825 -0.5041 -66.463 69.281 3.665 A1132 ASP A 17 ASP~? A1134 ALA A 96 ALA~? A1137 ASN A 95 ASN~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 2 3 RMSD = 1.36 A TRANSFORM -0.9967 0.0550 -0.0600 -0.0243 0.5024 0.8643 -0.0777 -0.8629 0.4994 16.464 -21.852 53.946 A1132 ASP B 17 ASP~? A1134 ALA B 96 ALA~? A1137 ASN B 95 ASN~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM -0.7326 -0.6738 0.0968 -0.5262 0.6508 0.5474 0.4318 -0.3501 0.8313 18.349 -8.546 -74.226 H 51 ALA A 37 ALA~? H 148 HIS A 34 HIS~? H 163 ASP B 49 ASP~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.39 A TRANSFORM 0.6729 0.7337 -0.0948 -0.6513 0.5267 -0.5463 0.3509 -0.4294 -0.8322 -94.914 33.954 -18.816 H 51 ALA B 37 ALA~? H 148 HIS B 34 HIS~? H 163 ASP A 49 ASP~? ULMNm 3 2odj_o00 PORIN D user 7 3 RMSD = 1.39 A TRANSFORM 0.2255 0.8731 0.4323 -0.1187 -0.4158 0.9017 -0.9670 0.2547 -0.0099 -44.703 15.360 60.512 A 156 HIS B 34 HIS~? A 208 ASP B 47 ASP~? A 296 SER A 92 SER~? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 RMSD = 1.40 A TRANSFORM 0.4406 0.8937 0.0845 -0.6906 0.2773 0.6680 -0.5736 0.3526 -0.7393 -32.464 83.321 46.028 B 106 ASN B 11 ASN~? B 108 HIS B 110 HIS.? B 144 ASP B 67 ASP~? ULMNm 3 2odj_o00 PORIN D user 2 3 RMSD = 1.40 A TRANSFORM -0.8739 -0.2260 -0.4303 0.4132 0.1205 -0.9026 -0.2558 0.9667 0.0119 73.424 22.970 -0.264 A 156 HIS A 34 HIS~? A 208 ASP A 47 ASP~? A 296 SER B 92 SER~? ULMNm 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 RMSD = 1.40 A TRANSFORM -0.8939 -0.4404 -0.0836 -0.2791 0.6927 -0.6650 -0.3508 0.5711 0.7422 85.203 87.387 -15.844 B 106 ASN A 11 ASN~? B 108 HIS A 110 HIS.? B 144 ASP A 67 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 RMSD = 1.40 A TRANSFORM 0.4228 -0.6054 0.6744 0.8215 0.5702 -0.0032 0.3826 -0.5553 -0.7384 29.635 -27.546 30.215 A 229 ALA A 40 ALA~? A 257 ALA A 37 ALA~? A 328 ASP A 49 ASP~? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 RMSD = 1.41 A TRANSFORM 0.6075 -0.4210 -0.6736 -0.5681 -0.8230 0.0020 0.5552 -0.3814 0.7391 53.441 89.906 -27.639 A 229 ALA B 40 ALA~? A 257 ALA B 37 ALA~? A 328 ASP B 49 ASP~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.41 A TRANSFORM -0.0799 -0.6954 -0.7142 0.9146 -0.3361 0.2249 0.3964 0.6352 -0.6629 13.203 -6.875 -11.401 E 49 ASP A 49 ASP~? E 86 HIS B 34 HIS~? E 250 ALA B 37 ALA~? ULMNm 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.42 A TRANSFORM 0.6971 0.0816 0.7123 0.3374 -0.9139 -0.2255 -0.6326 -0.3975 0.6646 -94.174 55.099 36.908 E 49 ASP B 49 ASP~? E 86 HIS A 34 HIS~? E 250 ALA A 37 ALA~? ULMNm 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 RMSD = 1.42 A TRANSFORM -0.8460 0.5108 0.1528 0.4287 0.4815 0.7644 -0.3169 -0.7122 0.6264 10.143 -47.992 4.654 A 157 PHE A 4 PHE.? A 245 ASP A 60 ASP.? A 273 LYS B 20 LYS~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.43 A TRANSFORM 0.7069 -0.4700 0.5285 0.7052 0.4115 -0.5774 -0.0539 -0.7809 -0.6223 -40.682 19.574 128.282 B 34 SER B 53 SER~? B 37 ASN B 57 ASN~? B 45 THR A 91 THR~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.43 A TRANSFORM 0.3320 -0.9163 -0.2239 0.7445 0.1088 0.6587 0.5792 0.3854 -0.7183 82.697 -67.907 -7.008 C 49 ASP B 49 ASP~? C 86 HIS A 34 HIS~? C 250 ALA A 37 ALA~? ULMNm 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 RMSD = 1.43 A TRANSFORM 0.4705 -0.7045 -0.5313 -0.4085 -0.7077 0.5765 0.7821 0.0542 0.6208 10.181 80.216 21.327 B 34 SER A 53 SER~? B 37 ASN A 57 ASN~? B 45 THR B 91 THR~? ULMNm 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 6 3 RMSD = 1.43 A TRANSFORM -0.5122 0.8456 -0.1503 -0.4832 -0.4284 -0.7635 0.7100 0.3185 -0.6280 -9.264 73.657 -45.609 A 157 PHE B 4 PHE.? A 245 ASP B 60 ASP.? A 273 LYS A 20 LYS~? ULMNm 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.43 A TRANSFORM 0.9168 -0.3311 0.2234 -0.1074 -0.7431 -0.6605 -0.3847 -0.5816 0.7168 20.183 42.664 32.627 C 49 ASP A 49 ASP~? C 86 HIS B 34 HIS~? C 250 ALA B 37 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7323 -0.5970 0.3275 -0.3260 -0.7297 -0.6011 -0.5978 -0.3334 0.7290 0.070 36.032 37.093 A 49 ASP B 49 ASP~? A 86 HIS A 34 HIS~? A 250 ALA A 37 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7323 -0.5970 0.3275 -0.3260 -0.7297 -0.6011 -0.5978 -0.3334 0.7290 0.070 36.032 37.093 A 49 ASP B 49 ASP~? A 86 HIS A 34 HIS~? A 250 ALA A 37 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.44 A TRANSFORM 0.5982 -0.7307 -0.3291 0.7290 0.3256 0.6021 0.3328 0.6000 -0.7275 30.591 -88.321 0.906 A 49 ASP A 49 ASP~? A 86 HIS B 34 HIS~? A 250 ALA B 37 ALA~? ULMNm 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.44 A TRANSFORM 0.5982 -0.7307 -0.3291 0.7290 0.3256 0.6021 0.3328 0.6000 -0.7275 30.591 -88.321 0.906 A 49 ASP A 49 ASP~? A 86 HIS B 34 HIS~? A 250 ALA B 37 ALA~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 RMSD = 1.45 A TRANSFORM -0.2792 -0.7553 -0.5930 -0.7519 0.5560 -0.3542 -0.5972 -0.3470 0.7231 96.259 -32.182 3.948 D 49 ASP B 49 ASP~? D 86 HIS A 34 HIS~? D 250 ALA A 37 ALA~? ULMNm 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 RMSD = 1.45 A TRANSFORM 0.7546 0.2788 0.5940 -0.5573 0.7502 0.3559 0.3464 0.5995 -0.7215 -25.826 -69.379 -33.688 D 49 ASP A 49 ASP~? D 86 HIS B 34 HIS~? D 250 ALA B 37 ALA~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 RMSD = 1.47 A TRANSFORM 0.6923 -0.7198 -0.0510 -0.5322 -0.5571 0.6375 0.4873 0.4142 0.7688 27.015 60.566 -13.407 B 1 SER A 92 SER~? B 69 ALA A 96 ALA~? B 241 ASN A 95 ASN~? ULMNm 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 4 3 RMSD = 1.47 A TRANSFORM 0.7242 -0.6882 0.0431 0.5516 0.5407 -0.6351 -0.4138 -0.4837 -0.7712 21.547 5.452 107.589 B 1 SER B 92 SER~? B 69 ALA B 96 ALA~? B 241 ASN B 95 ASN~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 RMSD = 1.48 A TRANSFORM -0.3853 -0.9030 -0.1900 0.7009 -0.4203 0.5762 0.6002 -0.0888 -0.7949 47.618 -6.044 -1.405 A 14 GLU A 35 GLU~? A 61 GLU A 41 GLU~? A 162 HIS A 34 HIS~? ULMNm 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 RMSD = 1.48 A TRANSFORM 0.9022 0.3867 0.1911 0.4220 -0.6999 -0.5762 0.0891 -0.6005 0.7946 -72.429 51.258 -4.641 A 14 GLU B 35 GLU~? A 61 GLU B 41 GLU~? A 162 HIS B 34 HIS~?