*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 RMSD = 1.13 A TRANSFORM 0.9019 -0.2856 -0.3242 -0.4283 -0.6896 -0.5840 0.0568 -0.6655 0.7443 -3.719 67.314 16.935 179 ASP A 68 ASP.? 227 GLU A 44 GLU.? 289 ASP A 15 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.14 A TRANSFORM -0.1211 -0.2392 -0.9634 0.9530 -0.2996 -0.0455 0.2777 0.9236 -0.2642 65.866 -119.898 -137.435 A 420 ALA A 48 ALA^? B 182 GLY A 34 GLY.? B 183 GLY A 50 GLY^? ULMNm 3 1ddj_c13 PLASMINOGEN user 1 3 RMSD = 1.23 A TRANSFORM -0.7625 -0.6435 -0.0668 0.6457 -0.7635 -0.0155 0.0410 0.0550 -0.9976 -12.962 39.227 2.817 B 603 HIS A 99 HIS^? B 646 ASP A 100 ASP.? B 739 GLY A 61 GLY^? ULMNm 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 1 3 RMSD = 1.23 A TRANSFORM 0.6375 0.6127 -0.4671 -0.7669 0.5628 -0.3084 -0.0739 -0.5548 -0.8287 9.023 46.564 16.500 65 THR A 27 THR~? 242 CYH A 40 CYH.? 270 PHE A 46 PHE^? ULMNm 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 RMSD = 1.27 A TRANSFORM 0.3233 -0.9387 0.1198 -0.8768 -0.2495 0.4111 0.3560 0.2379 0.9037 20.802 14.086 -1.587 30 GLY A 108 GLY~? 48 HIS A 99 HIS^? 99 ASP A 100 ASP.? ULMNm 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 2 3 RMSD = 1.27 A TRANSFORM 0.3583 0.5431 -0.7594 0.3964 0.6479 0.6505 -0.8453 0.5340 -0.0168 26.434 -9.140 31.579 A 267 GLU A 98 GLU^? A 369 ARG A 86 ARG^? A 372 TYR A 84 TYR^? ULMNm 3 1ddj_c14 PLASMINOGEN user 1 3 RMSD = 1.27 A TRANSFORM -0.0282 0.6248 0.7803 0.1256 0.7766 -0.6173 0.9917 -0.0806 0.1004 -10.269 65.551 48.426 C 603 HIS A 99 HIS^? C 646 ASP A 100 ASP.? C 739 GLY A 61 GLY^? ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 2 3 RMSD = 1.29 A TRANSFORM 0.7105 0.6658 -0.2278 0.6639 -0.7415 -0.0965 0.2331 0.0827 0.9689 15.457 4.295 -23.973 A 66 HIS A 99 HIS^? A 110 GLY A 79 GLY^? A 140 TYR A 74 TYR^? ULMNm 3 1ddj_c12 PLASMINOGEN user 1 3 RMSD = 1.30 A TRANSFORM -0.0418 0.6706 0.7407 0.1730 0.7350 -0.6557 0.9840 -0.1008 0.1467 -6.984 67.322 -15.701 A 603 HIS A 99 HIS^? A 646 ASP A 100 ASP.? A 739 GLY A 61 GLY^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.31 A TRANSFORM -0.4185 -0.8350 -0.3573 -0.2169 -0.2901 0.9321 0.8820 -0.4675 0.0597 76.829 12.547 3.334 199 ASP A 77 ASP.? 218 GLU A 7 GLU^? 329 ASP A 75 ASP^? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 1 3 RMSD = 1.32 A TRANSFORM 0.3668 0.8074 -0.4622 -0.2366 0.5615 0.7930 -0.8997 0.1815 -0.3970 19.708 69.100 24.961 A 459 ASN A 80 ASN^? A 460 GLY A 79 GLY^? A 461 ASN A 101 ASN~? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 1 3 RMSD = 1.32 A TRANSFORM 0.7353 -0.6708 0.0969 0.5646 0.6853 0.4599 0.3749 0.2835 -0.8827 19.471 70.352 35.372 A 228 ASP A 68 ASP.? A 261 ASP A 124 ASP~? A 329 ASP A 15 ASP~? ULMNm 3 1a0j_c13 TRYPSIN user 1 3 RMSD = 1.37 A TRANSFORM 0.5191 0.8180 0.2479 -0.3144 0.4524 -0.8346 0.7948 -0.3553 -0.4919 25.967 64.953 60.207 B 57 HIS A 99 HIS^? B 102 ASP A 100 ASP.? B 193 GLY A 108 GLY~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.37 A TRANSFORM -0.5742 -0.2364 -0.7838 -0.8175 0.1143 0.5644 0.0438 -0.9649 0.2589 -9.112 2.448 -39.120 H 51 ALA A 105 ALA~? H 148 HIS A 99 HIS^? H 163 ASP A 100 ASP.? ULMNm 3 1qho_c05 ALPHA-AMYLASE user 2 3 RMSD = 1.38 A TRANSFORM -0.2987 0.1020 -0.9489 0.7294 -0.6167 -0.2959 0.6154 0.7805 -0.1098 39.388 63.735 32.382 A 228 ASP A 68 ASP.? A 261 ASP A 124 ASP~? A 329 ASP A 89 ASP^? ULMNm 3 1a0j_c15 TRYPSIN user 1 3 RMSD = 1.38 A TRANSFORM -0.5584 0.1257 0.8200 -0.3584 0.8549 -0.3751 0.7482 0.5033 0.4323 -7.460 20.205 73.696 D 57 HIS A 99 HIS^? D 102 ASP A 100 ASP.? D 193 GLY A 108 GLY~? ULMNm 3 1a0j_c12 TRYPSIN user 1 3 RMSD = 1.39 A TRANSFORM 0.4024 -0.8954 -0.1903 -0.4156 -0.3640 0.8335 0.8157 0.2564 0.5186 34.086 28.121 39.028 A 57 HIS A 99 HIS^? A 102 ASP A 100 ASP.? A 193 GLY A 108 GLY~? ULMNm 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 RMSD = 1.39 A TRANSFORM 0.3665 -0.6582 0.6576 -0.8140 0.1155 0.5693 0.4507 0.7439 0.4935 -2.617 19.935 3.247 E 57 HIS A 99 HIS^? E 102 ASP A 100 ASP.? E 193 GLY A 108 GLY~? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.39 A TRANSFORM -0.5618 -0.2065 -0.8011 0.8255 -0.2021 -0.5269 0.0531 0.9573 -0.2840 -8.548 -4.556 -22.984 G 51 ALA A 105 ALA~? G 148 HIS A 99 HIS^? G 163 ASP A 100 ASP.? ULMNm 3 1a0j_c14 TRYPSIN user 1 3 RMSD = 1.39 A TRANSFORM -0.6371 -0.0573 -0.7686 0.4679 0.7637 -0.4448 -0.6125 0.6431 0.4597 59.635 40.959 62.379 C 57 HIS A 99 HIS^? C 102 ASP A 100 ASP.? C 193 GLY A 108 GLY~? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.40 A TRANSFORM -0.8375 0.0807 0.5405 -0.5384 -0.2916 -0.7907 -0.0938 0.9531 -0.2877 -11.876 6.320 48.405 D 51 ALA A 105 ALA~? D 148 HIS A 99 HIS^? D 163 ASP A 100 ASP.? ULMNm 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.40 A TRANSFORM -0.8387 0.5400 0.0702 0.3514 0.4383 0.8273 -0.4160 -0.7186 0.5573 16.781 1.996 16.225 A 57 HIS A 99 HIS^? A 102 ASP A 100 ASP.? A 193 GLY A 108 GLY~? ULMNm 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 RMSD = 1.41 A TRANSFORM -0.8470 0.5302 0.0373 0.3215 0.4551 0.8304 -0.4233 -0.7154 0.5559 17.702 2.029 16.266 A 57 HIS A 99 HIS^? A 102 ASP A 100 ASP.? A 193 GLY A 108 GLY~? ULMNm 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 RMSD = 1.42 A TRANSFORM -0.9695 0.2137 -0.1203 -0.0870 0.1586 0.9835 -0.2293 -0.9639 0.1352 5.837 3.189 50.103 B 57 HIS A 99 HIS^? B 102 ASP A 100 ASP.? B 193 GLY A 108 GLY~? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 RMSD = 1.43 A TRANSFORM -0.8805 0.2522 0.4015 -0.1265 0.6910 -0.7117 0.4569 0.6774 0.5765 10.619 81.461 30.200 179 ASP A 15 ASP~? 227 GLU A 44 GLU.? 289 ASP A 68 ASP.? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.43 A TRANSFORM -0.5506 0.1706 0.8171 0.7759 0.4656 0.4257 0.3079 -0.8684 0.3887 -13.822 -3.026 23.816 A 51 ALA A 105 ALA~? A 148 HIS A 99 HIS^? A 163 ASP A 100 ASP.? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 RMSD = 1.44 A TRANSFORM 0.7881 -0.4361 0.4344 -0.0545 -0.7524 -0.6565 -0.6131 -0.4937 0.6167 -2.719 11.862 -24.715 A 49 ASP A 89 ASP^? A 147 THR A 92 THR^? A 294 ASP A 15 ASP~? ULMNm 3 1sca_c00 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 RMSD = 1.44 A TRANSFORM 0.1919 0.0438 0.9804 -0.8711 -0.4526 0.1907 -0.4521 0.8907 0.0487 52.247 76.399 55.588 32 ASP A 100 ASP.? 64 HIS A 99 HIS^? 221 SER A 76 SER^? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.45 A TRANSFORM 0.7726 0.4583 0.4394 0.5048 -0.0236 -0.8629 0.3851 -0.8885 0.2495 -16.832 -1.348 -43.437 E 51 ALA A 105 ALA~? E 148 HIS A 99 HIS^? E 163 ASP A 100 ASP.? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.45 A TRANSFORM 0.7870 0.4522 0.4197 -0.4810 0.0237 0.8764 -0.3864 0.8916 -0.2361 -16.612 0.420 -19.077 F 51 ALA A 105 ALA~? F 148 HIS A 99 HIS^? F 163 ASP A 100 ASP.? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 2 3 RMSD = 1.45 A TRANSFORM 0.4629 -0.8359 0.2949 -0.5373 -0.5293 -0.6567 -0.7050 -0.1455 0.6941 13.749 123.625 -4.398 A 459 ASN A 101 ASN~? A 460 GLY A 79 GLY^? A 461 ASN A 80 ASN^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.45 A TRANSFORM -0.5770 0.4296 -0.6946 -0.5868 0.3735 0.7185 -0.5681 -0.8222 -0.0365 77.009 18.270 25.889 199 ASP A 75 ASP^? 218 GLU A 121 GLU~? 329 ASP A 100 ASP.? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.46 A TRANSFORM 0.8632 -0.0574 -0.5017 -0.4905 -0.3313 -0.8060 0.1199 -0.9418 0.3141 -22.069 6.832 27.261 C 51 ALA A 105 ALA~? C 148 HIS A 99 HIS^? C 163 ASP A 100 ASP.? ULMNm 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 RMSD = 1.46 A TRANSFORM 0.0699 -0.3462 0.9356 -0.6921 -0.6922 -0.2044 -0.7184 0.6332 0.2880 -2.625 66.385 36.754 179 ASP A 89 ASP^? 227 GLU A 5 GLU^? 289 ASP A 68 ASP.? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.47 A TRANSFORM -0.7907 -0.5432 -0.2824 0.5488 -0.8333 0.0665 0.2715 0.1024 -0.9570 -9.956 35.787 63.001 D 603 HIS A 99 HIS^? D 646 ASP A 100 ASP.? D 739 GLY A 61 GLY^? ULMNm 3 1kim_c00 THYMIDINE KINASE user 1 3 RMSD = 1.47 A TRANSFORM -0.5409 0.0141 -0.8410 0.7069 0.5495 -0.4454 -0.4559 0.8354 0.3072 66.353 87.199 50.608 A 83 GLU A 69 GLU^? A 163 ARG A 71 ARG^? A 222 ARG A 86 ARG^? ULMNm 3 1kim_c00 THYMIDINE KINASE user 2 3 RMSD = 1.48 A TRANSFORM 0.5470 0.0193 0.8369 -0.4726 -0.8181 0.3278 -0.6910 0.5748 0.4384 36.667 74.481 48.469 A 83 GLU A 69 GLU^? A 163 ARG A 86 ARG^? A 222 ARG A 71 ARG^? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 RMSD = 1.49 A TRANSFORM 0.5564 -0.1417 -0.8187 0.7382 0.5367 0.4087 -0.3815 0.8318 -0.4033 -18.997 -2.723 53.680 B 51 ALA A 105 ALA~? B 148 HIS A 99 HIS^? B 163 ASP A 100 ASP.? ULMNm 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 RMSD = 1.49 A TRANSFORM -0.3636 -0.4249 -0.8290 0.9306 -0.2053 -0.3030 0.0415 0.8817 -0.4700 25.463 13.317 39.345 54 ASP A 100 ASP.? 158 THR A 104 THR~? 317 ASP A 77 ASP.?