*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 2phk_c03 MC-PEPTIDE user 2 3 RMSD = 0.75 A TRANSFORM 0.5373 -0.7891 0.2976 -0.2550 -0.4884 -0.8345 0.8039 0.3725 -0.4637 21.120 44.331 49.259 A 149 ASP B 76 ASP~? A 151 LYS B 81 LYS.? A 154 ASN B 82 ASN.? ULMNm 3 2phk_c03 MC-PEPTIDE user 1 3 RMSD = 0.86 A TRANSFORM -0.4846 -0.8383 -0.2498 0.3594 -0.4512 0.8169 -0.7974 0.3061 0.5200 60.558 -12.104 61.152 A 149 ASP A 76 ASP~? A 151 LYS A 81 LYS.? A 154 ASN A 82 ASN^? ULMNm 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 2 3 RMSD = 1.10 A TRANSFORM -0.3150 0.7236 0.6141 0.3716 -0.5013 0.7814 0.8733 0.4744 -0.1110 -5.698 -14.778 15.374 E 166 ASP B 76 ASP~? E 168 LYS B 81 LYS.? E 171 ASN B 82 ASN.? ULMNm 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 1 3 RMSD = 1.16 A TRANSFORM 0.1969 0.7320 -0.6523 -0.3828 -0.5551 -0.7385 -0.9026 0.3951 0.1709 13.767 43.040 49.345 E 166 ASP A 76 ASP~? E 168 LYS A 81 LYS.? E 171 ASN A 82 ASN^? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.21 A TRANSFORM -0.3724 0.6791 -0.6326 -0.3677 0.5179 0.7724 0.8521 0.5203 0.0568 34.278 -3.581 7.424 E 57 HIS B 21 HIS~? E 102 ASP B 88 ASP.? E 193 GLY B 42 GLY^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 4 3 RMSD = 1.21 A TRANSFORM 0.7333 0.3199 0.6000 0.4819 -0.8670 -0.1267 0.4796 0.3820 -0.7899 2.356 28.004 10.696 I 303 TYR A 68 TYR^? I 306 VAL A 67 VAL.? I 308 VAL A 65 VAL.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 9 3 RMSD = 1.22 A TRANSFORM -0.7329 0.3150 -0.6029 -0.4750 -0.8715 0.1221 -0.4870 0.3759 0.7884 67.943 42.323 -5.818 I 303 TYR B 68 TYR^? I 306 VAL B 67 VAL.? I 308 VAL B 65 VAL.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.24 A TRANSFORM -0.3838 -0.6248 -0.6800 0.9026 -0.0984 -0.4191 0.1949 -0.7746 0.6017 32.244 4.846 -23.965 141 ASP B 76 ASP~? 166 GLY B 57 GLY.? 169 GLU B 60 GLU.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.24 A TRANSFORM 0.4403 -0.6539 0.6152 -0.8972 -0.2940 0.3296 -0.0346 -0.6971 -0.7161 -19.443 27.469 15.213 141 ASP A 76 ASP~? 166 GLY A 57 GLY.? 169 GLU A 60 GLU.? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 7 3 RMSD = 1.27 A TRANSFORM -0.5612 -0.5755 0.5949 0.8198 -0.4855 0.3037 0.1141 0.6581 0.7442 54.009 26.222 101.341 A 40 LYS A 13 LYS~? A 41 LYS A 12 LYS~? A 42 ILE A 14 ILE~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.29 A TRANSFORM -0.4701 0.8609 -0.1944 0.6122 0.4767 0.6308 0.6358 0.1775 -0.7512 26.102 -19.534 1.142 B 60 HIS B 21 HIS~? B 84 ASP B 88 ASP.? B 140 GLY B 42 GLY^? ULMNm 3 1zrz_c03 PROTEIN KINASE C, IOTA user 2 3 RMSD = 1.29 A TRANSFORM -0.9620 0.2073 0.1775 -0.2719 -0.6719 -0.6889 -0.0235 -0.7110 0.7028 4.796 52.137 -8.393 A 369 ASP B 76 ASP~? A 371 LYS B 81 LYS.? A 374 ASN B 82 ASN.? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 RMSD = 1.35 A TRANSFORM -0.4331 0.4217 -0.7966 -0.7883 0.2512 0.5616 0.4370 0.8712 0.2236 51.406 -0.416 2.077 30 GLY B 42 GLY^? 48 HIS B 21 HIS~? 99 ASP B 88 ASP.? ULMNm 3 1zrz_c03 PROTEIN KINASE C, IOTA user 1 3 RMSD = 1.42 A TRANSFORM 0.9345 0.2498 -0.2535 0.3559 -0.6467 0.6746 0.0046 -0.7207 -0.6932 -29.483 3.259 28.281 A 369 ASP A 76 ASP~? A 371 LYS A 81 LYS.? A 374 ASN A 82 ASN^? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 4 3 RMSD = 1.43 A TRANSFORM -0.2197 -0.7513 0.6223 -0.8108 0.4953 0.3118 -0.5425 -0.4361 -0.7180 76.142 85.530 123.675 A 451 GLU B 22 GLU.? A 504 TYR B 48 TYR.? A 540 GLU B 46 GLU^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.48 A TRANSFORM 0.8731 -0.3777 -0.3084 -0.4705 -0.8185 -0.3297 -0.1279 0.4329 -0.8923 84.155 109.820 160.014 D 141 GLY B 23 GLY.? D 144 GLU B 22 GLU.? D 164 GLU B 46 GLU^? ULMNm 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 RMSD = 1.48 A TRANSFORM 0.9663 -0.2096 -0.1494 -0.2557 -0.8482 -0.4638 -0.0295 0.4864 -0.8732 48.766 47.926 127.272 B 382 ARG A 36 ARG.? B 451 GLU A 80 GLU.? B 540 GLU A 31 GLU.? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 11 3 RMSD = 1.48 A TRANSFORM 0.8610 0.5064 -0.0479 -0.1646 0.1883 -0.9682 -0.4813 0.8415 0.2455 35.640 94.648 118.076 A 40 LYS B 10 LYS~? A 41 LYS B 12 LYS~? A 42 ILE B 14 ILE~? ULMNm 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 12 3 RMSD = 1.49 A TRANSFORM 0.8807 0.3649 -0.3020 -0.4729 0.6423 -0.6032 -0.0261 0.6741 0.7382 43.495 85.121 99.834 A 40 LYS B 10 LYS~? A 41 LYS B 13 LYS~? A 42 ILE B 14 ILE~? ULMNm 3 1qrz_c21 PLASMINOGEN user 2 3 RMSD = 1.49 A TRANSFORM 0.2734 0.3547 0.8941 -0.8702 0.4873 0.0728 -0.4099 -0.7980 0.4418 -93.845 8.124 -15.597 B 603 HIS B 85 HIS^? B 646 ASP B 88 ASP.? B 739 GLY B 61 GLY.? ULMNm 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 RMSD = 1.49 A TRANSFORM -0.3788 0.8863 -0.2663 -0.7365 -0.1144 0.6667 0.5605 0.4487 0.6961 91.979 39.965 76.562 B 451 GLU A 46 GLU^? B 504 TYR B 48 TYR.? B 540 GLU B 46 GLU^?