*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.84 A TRANSFORM -0.0823 -0.9916 -0.0998 0.9899 -0.0697 -0.1237 0.1157 -0.1090 0.9873 34.288 -98.969 -157.511 A 183 GLY A 115 GLY.? B 419 GLY A 61 GLY.? B 420 ALA A 91 ALA.? ULMNm 3 1rtu_c00 RIBONUCLEASE U2 user 2 3 RMSD = 0.90 A TRANSFORM 0.9559 0.0718 0.2847 0.2242 0.4477 -0.8656 -0.1896 0.8913 0.4119 -28.361 47.503 -7.349 41 HIS A 77 HIS.? 62 GLU A 76 GLU.? 101 HIS A 57 HIS^? ULMNm 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 1 3 RMSD = 0.96 A TRANSFORM -0.3879 0.2283 0.8930 -0.0778 -0.9735 0.2151 0.9184 0.0140 0.3953 55.089 34.764 58.411 B 237 HIS A 146 HIS~? B 238 GLY A 147 GLY.? B 287 CYH A 143 CYH~? ULMNm 3 1knp_c00 L-ASPARTATE OXIDASE user 2 3 RMSD = 1.03 A TRANSFORM -0.1597 0.1954 -0.9676 0.0553 0.9804 0.1889 0.9856 -0.0233 -0.1673 94.006 40.249 110.473 A 290 ARG A 94 ARG^? A 351 HIS A 58 HIS^? A 386 LEU A 120 LEU^? ULMNm 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 1 3 RMSD = 1.15 A TRANSFORM -0.1650 -0.9119 -0.3757 0.6548 0.1836 -0.7332 0.7376 -0.3670 0.5668 32.798 33.986 -21.916 B 40 HIS A 59 HIS.? B 58 GLU A 89 GLU^? B 92 HIS A 77 HIS.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.21 A TRANSFORM 0.3653 0.5337 -0.7627 0.6036 -0.7596 -0.2424 -0.7087 -0.3718 -0.5996 26.909 47.056 -0.005 D 465 GLY A 61 GLY.? D 501 ASP A 152 ASP.? E 367 TYR A 101 TYR.? ULMNm 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 1 3 RMSD = 1.23 A TRANSFORM -0.2199 0.4485 -0.8663 0.1696 -0.8570 -0.4867 -0.9607 -0.2540 0.1124 31.835 16.719 34.732 A 50 HIS A 59 HIS.? A 96 GLU A 89 GLU^? A 137 HIS A 77 HIS.? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 RMSD = 1.23 A TRANSFORM -0.2750 0.9075 -0.3175 -0.6500 0.0678 0.7569 0.7084 0.4146 0.5713 20.173 28.946 -65.458 A 465 GLY A 61 GLY.? A 501 ASP A 152 ASP.? B 367 TYR A 101 TYR.? ULMNm 3 1b2m_c00 5'-R(*GP*(CH2)U)-3' user 1 3 RMSD = 1.23 A TRANSFORM 0.5839 -0.1139 -0.8038 -0.6791 -0.6112 -0.4066 -0.4449 0.7833 -0.4342 16.688 66.045 23.727 A 40 HIS A 59 HIS.? A 58 GLU A 89 GLU^? A 92 HIS A 77 HIS.? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 1 3 RMSD = 1.31 A TRANSFORM 0.2354 -0.1045 -0.9663 -0.8849 -0.4342 -0.1686 -0.4019 0.8947 -0.1947 33.798 111.465 43.100 A 228 ASP A 36 ASP.? A 260 ASP A 137 ASP~? A 329 ASP A 152 ASP.? ULMNm 3 1b2m_c00 5'-R(*GP*(CH2)U)-3' user 2 3 RMSD = 1.34 A TRANSFORM -0.3146 -0.2048 0.9269 0.8100 0.4512 0.3746 -0.4949 0.8686 0.0239 -12.059 -18.532 5.887 A 40 HIS A 77 HIS.? A 58 GLU A 76 GLU.? A 92 HIS A 57 HIS^? ULMNm 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 RMSD = 1.35 A TRANSFORM 0.1220 0.0727 0.9899 0.9190 0.3685 -0.1404 -0.3750 0.9268 -0.0219 -42.507 -18.421 17.763 A 630 SER A 92 SER.? A 709 ASP A 124 ASP.? A 740 HIS A 58 HIS^? ULMNm 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 RMSD = 1.35 A TRANSFORM -0.6468 -0.2098 -0.7333 0.7191 0.1525 -0.6779 0.2541 -0.9658 0.0522 48.867 11.189 29.021 B 630 SER A 92 SER.? B 709 ASP A 124 ASP.? B 740 HIS A 58 HIS^? ULMNm 3 2hsa_c01 12-OXOPHYTODIENOATE REDUCTASE 3 user 1 3 RMSD = 1.36 A TRANSFORM -0.7020 0.4628 -0.5412 -0.6244 -0.0346 0.7803 0.3424 0.8858 0.3133 52.636 -7.533 6.370 A 185 HIS A 95 HIS^? A 188 HIS A 77 HIS.? A 190 TYR A 74 TYR^? ULMNm 3 2hsa_c00 12-OXOPHYTODIENOATE REDUCTASE 3 user 1 3 RMSD = 1.36 A TRANSFORM -0.7022 0.6371 0.3179 0.0801 0.5144 -0.8538 -0.7074 -0.5741 -0.4123 2.222 30.249 112.319 B 185 HIS A 95 HIS^? B 188 HIS A 77 HIS.? B 190 TYR A 74 TYR^? ULMNm 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 2 3 RMSD = 1.38 A TRANSFORM -0.4149 0.7021 0.5786 0.5722 -0.2931 0.7660 0.7074 0.6489 -0.2801 -15.834 -42.403 -15.021 A 50 HIS A 77 HIS.? A 96 GLU A 76 GLU.? A 137 HIS A 57 HIS^? ULMNm 3 1rtu_c00 RIBONUCLEASE U2 user 3 3 RMSD = 1.39 A TRANSFORM 0.8321 0.2014 0.5167 0.5062 0.1047 -0.8560 -0.2266 0.9739 -0.0148 -35.324 42.769 9.119 41 HIS A 77 HIS.? 62 GLU A 76 GLU.? 101 HIS A 59 HIS.? ULMNm 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 2 3 RMSD = 1.41 A TRANSFORM 0.8029 -0.1320 0.5813 -0.5957 -0.1384 0.7912 -0.0240 -0.9815 -0.1898 -36.692 25.176 36.708 B 40 HIS A 77 HIS.? B 58 GLU A 76 GLU.? B 92 HIS A 57 HIS^? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 1 3 RMSD = 1.42 A TRANSFORM -0.7648 0.3106 0.5644 0.5987 0.0193 0.8007 0.2378 0.9503 -0.2007 44.428 -31.465 42.430 412 GLU A 76 GLU.? 516 HIS A 57 HIS^? 559 HIS A 95 HIS^? ULMNm 3 1rtu_c00 RIBONUCLEASE U2 user 1 3 RMSD = 1.43 A TRANSFORM -0.4666 -0.8753 -0.1274 -0.7113 0.2856 0.6423 -0.5258 0.3903 -0.7558 39.225 28.960 50.558 41 HIS A 59 HIS.? 62 GLU A 89 GLU^? 101 HIS A 77 HIS.? ULMNm 3 1gal_c00 GLUCOSE OXIDASE (E.C.1.1.3.4) user 5 3 RMSD = 1.44 A TRANSFORM 0.7581 0.2175 -0.6148 -0.5589 -0.2692 -0.7843 -0.3361 0.9382 -0.0826 38.013 61.364 56.898 412 GLU A 89 GLU^? 516 HIS A 77 HIS.? 559 HIS A 95 HIS^? ULMNm 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 1 3 RMSD = 1.45 A TRANSFORM 0.2094 0.6198 -0.7563 -0.9243 0.3779 0.0538 0.3191 0.6878 0.6520 41.266 27.475 -29.855 B 46 HIS A 59 HIS.? B 163 ALA A 91 ALA.? B 182 SER A 92 SER.? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.46 A TRANSFORM 0.5049 0.8174 -0.2773 -0.0228 0.3338 0.9424 0.8629 -0.4695 0.1872 48.924 25.007 21.042 A 202 HIS A 77 HIS.? A 295 HIS A 59 HIS.? A 296 HIS A 57 HIS^? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.46 A TRANSFORM 0.7702 -0.5933 0.2340 0.1403 -0.2003 -0.9696 0.6221 0.7797 -0.0710 29.742 59.857 33.950 C 202 HIS A 77 HIS.? C 295 HIS A 59 HIS.? C 296 HIS A 57 HIS^? ULMNm 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.46 A TRANSFORM -0.6681 0.7435 0.0277 -0.4506 -0.3747 -0.8103 -0.5921 -0.5539 0.5854 68.734 75.164 64.442 C 202 HIS A 77 HIS.? C 295 HIS A 57 HIS^? C 296 HIS A 59 HIS.? ULMNm 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 RMSD = 1.46 A TRANSFORM -0.8637 0.5021 -0.0446 -0.4310 -0.6898 0.5817 0.2613 0.5216 0.8122 42.893 123.090 -28.598 193 ASP A 106 ASP.? 231 ASP A 15 ASP~? 294 ASP A 27 ASP.? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.47 A TRANSFORM -0.7716 0.5934 -0.2290 -0.0932 -0.4616 -0.8822 -0.6292 -0.6594 0.4115 46.300 66.917 71.667 B 202 HIS A 77 HIS.? B 295 HIS A 59 HIS.? B 296 HIS A 57 HIS^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.48 A TRANSFORM 0.7736 0.5753 -0.2658 -0.6276 0.7533 -0.1964 0.0872 0.3188 0.9438 1.098 -42.277 -151.455 A 183 GLY A 40 GLY.? B 419 GLY A 115 GLY.? B 420 ALA A 114 ALA^? ULMNm 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.48 A TRANSFORM 0.6641 -0.7473 -0.0214 -0.2071 -0.1564 -0.9658 0.7184 0.6458 -0.2586 7.388 70.199 37.673 B 202 HIS A 77 HIS.? B 295 HIS A 57 HIS^? B 296 HIS A 59 HIS.? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 2 3 RMSD = 1.48 A TRANSFORM -0.7513 -0.6270 0.2061 0.0228 -0.3367 -0.9413 0.6596 -0.7025 0.2673 86.457 153.957 27.009 D 202 HIS A 77 HIS.? D 295 HIS A 59 HIS.? D 296 HIS A 57 HIS^? ULMNm 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.48 A TRANSFORM -0.5585 -0.7149 0.4207 0.3342 0.2702 0.9029 -0.7592 0.6449 0.0881 75.265 15.598 64.597 A 202 HIS A 77 HIS.? A 295 HIS A 57 HIS^? A 296 HIS A 59 HIS.? ULMNm 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 1 3 RMSD = 1.49 A TRANSFORM 0.7677 0.4791 -0.4256 -0.3339 -0.2678 -0.9038 -0.5470 0.8359 -0.0456 47.765 163.365 60.101 D 202 HIS A 77 HIS.? D 295 HIS A 57 HIS^? D 296 HIS A 59 HIS.?