*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 RMSD = 1.07 A TRANSFORM 0.3470 0.5471 0.7617 0.1064 0.7840 -0.6116 0.9318 -0.2933 -0.2138 -6.434 21.652 84.362 A 241 ASP B 57 ASP~? A 265 GLU B 43 GLU~? A 369 ASP B 5 ASP.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 11 3 RMSD = 1.09 A TRANSFORM 0.0101 -0.9743 0.2249 -0.0232 -0.2251 -0.9741 -0.9997 -0.0046 0.0249 79.653 9.669 -1.431 A 37 ASP B 57 ASP~? A 56 ILE B 44 ILE~? A 82 TYR B 30 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 RMSD = 1.11 A TRANSFORM -0.7614 0.3585 -0.5401 -0.3783 0.4308 0.8193 -0.5264 -0.8282 0.1924 58.869 -46.896 26.914 B 37 ASP A 5 ASP~? B 56 ILE A 59 ILE~? B 82 TYR A 35 TYR~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 RMSD = 1.12 A TRANSFORM -0.7595 0.3658 -0.5379 -0.3904 0.4051 0.8268 -0.5203 -0.8379 0.1649 55.491 -28.767 55.311 A 37 ASP A 5 ASP~? A 56 ILE A 59 ILE~? A 82 TYR A 35 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 11 3 RMSD = 1.12 A TRANSFORM 0.0090 -0.9729 0.2309 0.0068 -0.2308 -0.9730 -0.9999 -0.0103 -0.0046 82.452 -6.687 -28.708 B 37 ASP B 57 ASP~? B 56 ILE B 44 ILE~? B 82 TYR B 30 TYR~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 4 3 RMSD = 1.16 A TRANSFORM -0.4970 -0.8153 -0.2972 -0.8526 0.3951 0.3420 0.1614 -0.4234 0.8915 58.772 68.788 29.139 A 228 ASP B 64 ASP~? A 261 ASP B 38 ASP.? A 329 ASP B 5 ASP.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 RMSD = 1.18 A TRANSFORM 0.2200 0.9646 0.1456 -0.9658 0.2364 -0.1068 0.1374 0.1171 -0.9836 1.269 -2.727 -13.107 A 37 ASP A 57 ASP~? A 56 ILE A 44 ILE~? A 82 TYR A 30 TYR~? ULMNm 3 1vzx_c03 2.04.01.0087 user 1 3 RMSD = 1.19 A TRANSFORM -0.1007 0.5109 0.8537 0.8244 -0.4376 0.3590 -0.5570 -0.7400 0.3771 -27.636 3.105 34.076 B1314 TYR A 76 TYR~? B1317 GLU A 70 GLU~? B1365 ARG A 82 ARG~? ULMNm 3 1vzx_c02 2.04.01.0087 user 1 3 RMSD = 1.20 A TRANSFORM 0.0912 -0.5057 -0.8579 0.7551 -0.5265 0.3907 0.6493 0.6834 -0.3338 42.833 5.115 13.252 A 314 TYR A 76 TYR~? A 317 GLU A 70 GLU~? A 365 ARG A 82 ARG~? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 14 3 RMSD = 1.21 A TRANSFORM 0.2677 -0.7957 0.5432 -0.9102 -0.3938 -0.1283 -0.3160 0.4601 0.8297 39.016 102.934 46.514 A 50 GLN B 105 GLN~? A 91 LEU B 106 LEU~? A 133 GLU B 88 GLU~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 RMSD = 1.22 A TRANSFORM 0.2265 0.9628 0.1472 -0.9680 0.2393 -0.0760 0.1084 0.1252 -0.9862 4.149 -19.241 -40.785 B 37 ASP A 57 ASP~? B 56 ILE A 44 ILE~? B 82 TYR A 30 TYR~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 3 3 RMSD = 1.22 A TRANSFORM 0.3927 -0.9196 -0.0103 -0.8187 -0.3547 0.4516 0.4190 0.1689 0.8922 49.325 79.846 16.935 A 228 ASP B 57 ASP~? A 261 ASP B 38 ASP.? A 329 ASP B 5 ASP.? ULMNm 3 1vzx_c03 2.04.01.0087 user 6 3 RMSD = 1.25 A TRANSFORM 0.7364 -0.6488 -0.1919 0.3828 0.1655 0.9089 0.5579 0.7427 -0.3702 17.503 -20.890 -34.895 B1314 TYR B 76 TYR~? B1317 GLU B 70 GLU~? B1365 ARG B 82 ARG~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 15 3 RMSD = 1.25 A TRANSFORM -0.3382 0.0000 -0.9411 0.0953 0.9949 -0.0343 -0.9362 0.1012 0.3364 103.093 2.068 68.023 C1050 GLN B 105 GLN~? C1091 LEU B 106 LEU~? C1133 GLU B 88 GLU~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 16 3 RMSD = 1.26 A TRANSFORM -0.2726 -0.7593 -0.5909 -0.3001 0.6507 -0.6976 -0.9141 0.0128 0.4052 90.332 52.063 91.854 A 50 GLN B 105 GLN~? A 91 LEU B 106 LEU~? A 133 GLU B 88 GLU~? ULMNm 3 1vzx_c02 2.04.01.0087 user 6 3 RMSD = 1.26 A TRANSFORM -0.7413 0.6459 0.1826 0.4370 0.2580 0.8616 -0.5094 -0.7185 0.4735 -2.003 -27.261 78.909 A 314 TYR B 76 TYR~? A 317 GLU B 70 GLU~? A 365 ARG B 82 ARG~? ULMNm 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 RMSD = 1.26 A TRANSFORM 0.2831 0.2462 -0.9269 -0.1514 -0.9429 -0.2967 0.9471 -0.2244 0.2297 81.649 46.521 7.268 B 48 ARG B 83 ARG~? D 101 TYR B 14 TYR~? D 173 ASP B 17 ASP~? ULMNm 3 1c54_c00 RIBONUCLEASE SA user 2 3 RMSD = 1.27 A TRANSFORM 0.2669 0.8878 0.3750 0.9618 -0.2698 -0.0459 -0.0604 -0.3730 0.9259 -59.756 -30.879 -33.510 A 54 GLU B 97 GLU~? A 65 ARG B 101 ARG~? A 85 HIS B 92 HIS.? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 16 3 RMSD = 1.27 A TRANSFORM 0.0895 -0.7320 0.6754 0.4068 0.6459 0.6460 0.9091 -0.2170 -0.3556 90.683 -5.450 37.105 B 550 GLN B 105 GLN~? B 591 LEU B 106 LEU~? B 633 GLU B 88 GLU~? ULMNm 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 11 3 RMSD = 1.30 A TRANSFORM -0.2639 -0.3729 0.8896 0.4462 -0.8649 -0.2301 -0.8551 -0.3362 -0.3946 23.649 23.760 91.178 A 48 ARG B 83 ARG~? C 101 TYR B 14 TYR~? C 173 ASP B 17 ASP~? ULMNm 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 RMSD = 1.30 A TRANSFORM -0.0513 -0.2565 0.9652 -0.4671 0.8604 0.2038 0.8827 0.4404 0.1639 10.351 -21.965 -6.129 A 101 TYR B 14 TYR~? A 173 ASP B 17 ASP~? C 48 ARG B 83 ARG~? ULMNm 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 RMSD = 1.31 A TRANSFORM -0.0025 0.3218 -0.9468 0.1810 0.9313 0.3161 -0.9835 0.1706 0.0605 88.155 -47.897 57.858 B 101 TYR B 14 TYR~? B 173 ASP B 17 ASP~? D 48 ARG B 83 ARG~? ULMNm 3 1bsj_c00 PEPTIDE DEFORMYLASE user 5 3 RMSD = 1.31 A TRANSFORM 0.7067 0.6489 0.2818 -0.3063 0.6397 -0.7049 0.6377 -0.4119 -0.6509 -19.755 61.508 91.172 A 50 GLN A 105 GLN~? A 91 LEU A 106 LEU~? A 133 GLU A 88 GLU~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 4 3 RMSD = 1.32 A TRANSFORM -0.9864 0.1610 -0.0322 -0.1548 -0.9771 -0.1461 0.0550 0.1391 -0.9887 90.590 85.635 72.702 C1050 GLN A 105 GLN~? C1091 LEU A 106 LEU~? C1133 GLU A 88 GLU~? ULMNm 3 2tpl_c05 TYROSINE PHENOL-LYASE user 4 3 RMSD = 1.33 A TRANSFORM 0.6129 0.7370 -0.2849 0.5819 -0.6650 -0.4682 0.5345 -0.1212 0.8365 -51.557 41.177 -8.165 B 122 TYR B 35 TYR~? B 214 ASP B 17 ASP~? B 256 LYS A 72 LYS~? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 10 3 RMSD = 1.33 A TRANSFORM -0.8558 0.0903 -0.5094 0.4225 -0.4464 -0.7888 0.2987 0.8903 -0.3438 69.240 9.338 -19.725 A 37 ASP B 5 ASP.? A 56 ILE B 59 ILE~? A 82 TYR B 35 TYR~? ULMNm 3 1bs4_c00 PEPTIDE DEFORMYLASE user 5 3 RMSD = 1.33 A TRANSFORM -0.5232 0.8451 0.1096 -0.8406 -0.4907 -0.2295 0.1402 0.2122 -0.9671 18.575 96.833 90.038 A 50 GLN A 105 GLN~? A 91 LEU A 106 LEU~? A 133 GLU A 88 GLU~? ULMNm 3 1bs4_c01 PEPTIDE DEFORMYLASE user 5 3 RMSD = 1.33 A TRANSFORM 0.7759 0.6278 0.0615 0.6276 -0.7781 0.0247 -0.0634 -0.0194 0.9978 37.259 58.525 22.343 B 550 GLN A 105 GLN~? B 591 LEU A 106 LEU~? B 633 GLU A 88 GLU~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 10 3 RMSD = 1.34 A TRANSFORM -0.8586 0.0939 -0.5040 0.4073 -0.4719 -0.7819 0.3113 0.8766 -0.3669 72.014 -6.527 -46.989 B 37 ASP B 5 ASP.? B 56 ILE B 59 ILE~? B 82 TYR B 35 TYR~? ULMNm 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 RMSD = 1.37 A TRANSFORM 0.5074 0.3737 -0.7765 0.2111 -0.9275 -0.3085 0.8355 0.0074 0.5495 59.774 17.427 -93.547 E 110 ARG B 83 ARG~? G 163 TYR B 76 TYR~? G 236 ASP B 17 ASP~? ULMNm 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 RMSD = 1.37 A TRANSFORM -0.2188 0.9054 0.3639 0.4877 0.4245 -0.7629 0.8452 -0.0106 0.5344 10.913 27.957 -15.135 A 110 ARG B 83 ARG~? C 163 TYR B 76 TYR~? C 236 ASP B 17 ASP~? ULMNm 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 RMSD = 1.38 A TRANSFORM 0.5322 -0.2502 -0.8088 0.1656 0.9676 -0.1904 -0.8303 0.0326 -0.5564 68.186 -0.383 68.916 A 163 TYR B 76 TYR~? A 236 ASP B 17 ASP~? C 110 ARG B 83 ARG~? ULMNm 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 RMSD = 1.39 A TRANSFORM -0.5802 -0.3922 0.7138 -0.3064 0.9172 0.2548 0.7546 0.0709 0.6523 23.324 -25.967 -97.394 F 163 TYR B 76 TYR~? F 236 ASP B 17 ASP~? H 110 ARG B 83 ARG~? ULMNm 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 RMSD = 1.39 A TRANSFORM -0.6368 0.2701 0.7222 -0.0934 -0.9568 0.2755 -0.7653 -0.1080 -0.6345 12.011 11.861 73.869 B 110 ARG B 83 ARG~? D 163 TYR B 76 TYR~? D 236 ASP B 17 ASP~? ULMNm 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 RMSD = 1.39 A TRANSFORM -0.0632 -0.9774 0.2015 0.6405 -0.1946 -0.7429 -0.7653 -0.0821 -0.6384 45.698 18.329 -4.400 F 110 ARG B 83 ARG~? H 163 TYR B 76 TYR~? H 236 ASP B 17 ASP~? ULMNm 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 RMSD = 1.40 A TRANSFORM 0.3444 -0.8964 -0.2791 -0.5660 -0.4354 0.7001 0.7491 0.0832 0.6573 56.916 -6.676 -20.261 B 163 TYR B 76 TYR~? B 236 ASP B 17 ASP~? D 110 ARG B 83 ARG~? ULMNm 3 2tpl_c04 TYROSINE PHENOL-LYASE user 3 3 RMSD = 1.41 A TRANSFORM 0.5000 0.8476 -0.1777 -0.7038 0.5172 0.4870 -0.5047 0.1185 -0.8551 -59.000 -29.476 23.598 A 122 TYR B 35 TYR~? A 214 ASP B 17 ASP~? A 256 LYS A 72 LYS~? ULMNm 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 RMSD = 1.41 A TRANSFORM 0.1152 0.9811 -0.1552 -0.5531 0.1931 0.8104 -0.8251 0.0075 -0.5650 29.447 -36.454 -7.819 E 163 TYR B 76 TYR~? E 236 ASP B 17 ASP~? G 110 ARG B 83 ARG~? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.42 A TRANSFORM 0.6079 0.7927 0.0450 -0.6370 0.5208 -0.5683 0.4739 -0.3168 -0.8216 29.969 36.475 22.264 199 ASP B 5 ASP.? 218 GLU B 84 GLU~? 329 ASP B 64 ASP~? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 10 3 RMSD = 1.47 A TRANSFORM 0.6969 0.2516 -0.6716 -0.7107 0.3676 -0.5998 -0.0960 -0.8953 -0.4350 20.476 104.325 47.606 313 ASP B 64 ASP~? 315 GLU B 67 GLU~? 390 TYR B 35 TYR~? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 2 3 RMSD = 1.48 A TRANSFORM 0.8607 0.4299 -0.2727 -0.5077 0.6856 -0.5217 0.0373 -0.5874 -0.8084 47.544 68.773 131.354 A 451 GLU A 67 GLU~? A 504 TYR A 19 TYR~? A 540 GLU A 70 GLU~? ULMNm 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 RMSD = 1.49 A TRANSFORM 0.1816 -0.1039 0.9779 -0.8107 -0.5787 0.0890 -0.5567 0.8089 0.1893 60.561 80.614 21.778 C1050 GLN A 20 GLN~? C1091 LEU A 23 LEU~? C1133 GLU A 32 GLU~? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 10 3 RMSD = 1.50 A TRANSFORM -0.3197 -0.4985 0.8058 -0.6295 -0.5239 -0.5738 -0.7082 0.6907 0.1463 90.685 119.236 80.908 A 451 GLU B 67 GLU~? A 504 TYR B 19 TYR~? A 540 GLU B 70 GLU~?