*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.02 A TRANSFORM -0.7592 -0.6503 0.0270 -0.6361 0.7501 0.1810 0.1380 -0.1202 0.9831 54.041 -51.515 -158.161 A 183 GLY A 115 GLY.? B 419 GLY A 61 GLY.? B 420 ALA A 91 ALA.? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 5 3 RMSD = 1.17 A TRANSFORM 0.8025 0.1136 -0.5857 -0.4300 -0.5704 -0.6998 0.4136 -0.8135 0.4089 36.674 57.482 34.320 412 GLU A 89 GLU^? 516 HIS A 77 HIS.? 559 HIS A 95 HIS^? ULMNm 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 1 3 RMSD = 1.25 A TRANSFORM -0.5546 0.1066 0.8252 0.7478 -0.3711 0.5505 -0.3649 -0.9224 -0.1261 63.073 -4.754 119.843 B 237 HIS A 146 HIS~? B 238 GLY A 147 GLY.? B 287 CYH A 143 CYH~? ULMNm 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 1 3 RMSD = 1.27 A TRANSFORM -0.9967 -0.0403 -0.0703 -0.0311 0.9914 -0.1272 -0.0748 0.1246 0.9894 22.831 19.079 32.587 A 317 HIS A 146 HIS~? A 318 GLY A 147 GLY.? A 360 CYH A 143 CYH~? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 1 3 RMSD = 1.30 A TRANSFORM -0.8125 0.0755 0.5781 0.5623 -0.1606 0.8112 -0.1541 -0.9841 -0.0881 47.963 -28.759 71.514 412 GLU A 76 GLU.? 516 HIS A 57 HIS^? 559 HIS A 95 HIS^? ULMNm 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 1 3 RMSD = 1.30 A TRANSFORM -0.5181 -0.6939 -0.5001 0.2786 0.4159 -0.8657 -0.8087 0.5878 0.0221 46.607 48.702 38.566 B 40 HIS A 59 HIS.? B 58 GLU A 89 GLU^? B 92 HIS A 77 HIS.? ULMNm 3 1b2m_c00 5'-R(*GP*(CH2)U)-3' user 1 3 RMSD = 1.31 A TRANSFORM 0.0334 0.1841 -0.9823 0.0075 -0.9829 -0.1840 0.9994 0.0012 0.0342 38.124 39.313 -32.515 A 40 HIS A 59 HIS.? A 58 GLU A 89 GLU^? A 92 HIS A 77 HIS.? ULMNm 3 1rtu_c00 RIBONUCLEASE U2 user 2 3 RMSD = 1.35 A TRANSFORM 0.9335 -0.1693 0.3160 0.1190 -0.6853 -0.7185 -0.3382 -0.7084 0.6196 -25.986 58.665 8.412 41 HIS A 77 HIS.? 62 GLU A 76 GLU.? 101 HIS A 57 HIS^? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.36 A TRANSFORM 0.5569 -0.7634 0.3273 -0.3026 -0.5534 -0.7760 -0.7735 -0.3331 0.5391 35.177 71.137 69.497 C 202 HIS A 77 HIS.? C 295 HIS A 59 HIS.? C 296 HIS A 57 HIS^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.37 A TRANSFORM 0.9296 -0.3607 0.0753 -0.3606 -0.8485 0.3873 0.0758 0.3872 0.9189 -8.871 -59.339 -150.726 A 183 GLY A 40 GLY.? B 419 GLY A 115 GLY.? B 420 ALA A 114 ALA^? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.37 A TRANSFORM -0.8909 -0.3054 0.3362 0.1603 0.4811 0.8619 0.4250 -0.8217 0.3797 84.466 20.344 32.192 A 202 HIS A 77 HIS.? A 295 HIS A 59 HIS.? A 296 HIS A 57 HIS^? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.37 A TRANSFORM 0.4956 -0.7857 -0.3702 -0.8656 -0.4819 -0.1359 0.0716 -0.3878 0.9190 53.334 28.831 -12.065 A 37 ASP A 137 ASP~? A 56 ILE A 35 ILE.? A 82 TYR A 32 TYR.? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.38 A TRANSFORM 0.7113 0.5506 -0.4370 -0.1570 -0.4815 -0.8623 0.6852 -0.6819 0.2560 49.210 158.537 26.358 D 202 HIS A 77 HIS.? D 295 HIS A 59 HIS.? D 296 HIS A 57 HIS^? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.38 A TRANSFORM -0.5571 0.7650 -0.3230 -0.0104 -0.3954 -0.9185 0.8304 0.5083 -0.2283 40.839 64.810 34.507 B 202 HIS A 77 HIS.? B 295 HIS A 59 HIS.? B 296 HIS A 57 HIS^? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.38 A TRANSFORM 0.5021 -0.7803 -0.3729 -0.8635 -0.4763 -0.1661 0.0480 -0.4053 0.9129 55.988 12.615 -38.765 B 37 ASP A 137 ASP~? B 56 ILE A 35 ILE.? B 82 TYR A 32 TYR.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.40 A TRANSFORM 0.0622 0.5114 -0.8571 -0.2533 -0.8226 -0.5092 0.9654 -0.2487 -0.0784 40.418 85.242 -74.614 D 465 GLY A 61 GLY.? D 501 ASP A 152 ASP.? E 367 TYR A 101 TYR.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.42 A TRANSFORM 0.2823 0.9484 -0.1440 0.0929 0.1224 0.9881 -0.9548 0.2923 0.0535 -4.665 -4.162 8.664 A 465 GLY A 61 GLY.? A 501 ASP A 152 ASP.? B 367 TYR A 101 TYR.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 2 3 RMSD = 1.42 A TRANSFORM 0.0381 -0.7164 0.6966 -0.8662 -0.3713 -0.3344 -0.4982 0.5907 0.6347 28.561 112.013 40.402 A 228 ASP A 152 ASP.? A 260 ASP A 137 ASP~? A 329 ASP A 36 ASP.? ULMNm 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 2 3 RMSD = 1.44 A TRANSFORM -0.4504 -0.5088 0.7336 0.5937 0.4430 0.6718 0.6668 -0.7382 -0.1026 -6.106 -48.315 -3.878 A 50 HIS A 77 HIS.? A 96 GLU A 76 GLU.? A 137 HIS A 57 HIS^? ULMNm 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 1 3 RMSD = 1.44 A TRANSFORM 0.8351 -0.0676 -0.5459 -0.4928 -0.5329 -0.6879 0.2444 -0.8435 0.4784 -9.073 42.401 -11.991 A 50 HIS A 59 HIS.? A 96 GLU A 89 GLU^? A 137 HIS A 77 HIS.? ULMNm 3 2isd_c00 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 1 3 RMSD = 1.44 A TRANSFORM -0.6761 -0.3949 0.6221 0.4232 -0.8992 -0.1108 -0.6032 -0.1883 -0.7751 125.143 36.652 66.195 A 311 HIS A 95 HIS^? A 341 GLU A 76 GLU.? A 356 HIS A 58 HIS^? ULMNm 3 2isd_c01 PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPuser 2 3 RMSD = 1.45 A TRANSFORM 0.0833 -0.2035 0.9755 0.3939 -0.8925 -0.2198 -0.9154 -0.4026 -0.0058 43.833 42.381 7.243 B 311 HIS A 95 HIS^? B 341 GLU A 76 GLU.? B 356 HIS A 58 HIS^? ULMNm 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 2 3 RMSD = 1.47 A TRANSFORM 0.3099 0.3196 0.8954 0.9506 -0.1184 -0.2868 -0.0143 -0.9401 0.3405 -24.101 -21.414 15.725 B 46 HIS A 82 HIS.? B 163 ALA A 100 ALA.? B 182 SER A 71 SER.? ULMNm 3 2vmg_p00 FIBRONECTIN TYPE III DOMAIN PROTEIN user 2 3 RMSD = 1.48 A TRANSFORM -0.9178 0.3568 -0.1740 0.1874 0.0030 -0.9823 0.3500 0.9342 0.0697 31.378 12.468 -10.771 A 82 HIS A 59 HIS.? A 166 SER A 92 SER.? A 168 HIS A 58 HIS^? ULMNm 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 RMSD = 1.49 A TRANSFORM 0.4741 -0.8627 -0.1762 -0.4910 -0.0930 -0.8662 -0.7308 -0.4971 0.4677 7.881 92.498 152.487 B 109 ASP A 137 ASP~? B 182 GLU A 130 GLU^? B 286 ASN A 141 ASN~?