*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 3 3 RMSD = 1.00 A TRANSFORM 0.8939 0.3198 0.3140 -0.2517 -0.2217 0.9421 0.3709 -0.9212 -0.1177 -28.447 41.334 22.830 B 66 HIS A 173 HIS^? B 110 GLY A 175 GLY^? B 140 TYR A 38 TYR^? ULMNm 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.02 A TRANSFORM -0.6056 0.4874 0.6291 -0.5384 -0.8331 0.1271 0.5860 -0.2617 0.7669 47.802 77.517 -1.454 199 ASP A 156 ASP^? 242 GLU A 197 GLU^? 329 ASP A 162 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.06 A TRANSFORM -0.0005 -0.9990 0.0437 -0.2603 0.0423 0.9646 -0.9655 -0.0109 -0.2601 52.295 -110.525 -105.630 A 420 ALA A 20 ALA~? B 182 GLY A 27 GLY.? B 183 GLY A 28 GLY.? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 1 3 RMSD = 1.08 A TRANSFORM 0.9033 0.3797 -0.1998 0.2361 -0.8287 -0.5074 -0.3582 0.4112 -0.8382 -6.158 45.373 18.148 I 303 TYR A 32 TYR^? I 306 VAL A 31 VAL^? I 308 VAL A 29 VAL.? ULMNm 3 1ef8_c01 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.08 A TRANSFORM 0.8268 -0.2500 0.5040 -0.4321 0.2915 0.8534 -0.3602 -0.9233 0.1330 -13.718 35.140 43.715 B 66 HIS A 173 HIS^? B 110 GLY A 174 GLY^? B 140 TYR A 38 TYR^? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 3 3 RMSD = 1.08 A TRANSFORM 0.4484 -0.5443 -0.7090 0.5689 0.7856 -0.2433 0.6895 -0.2942 0.6619 0.679 -26.022 2.056 C 66 HIS A 173 HIS^? C 110 GLY A 175 GLY^? C 140 TYR A 38 TYR^? ULMNm 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 2 3 RMSD = 1.09 A TRANSFORM -0.9379 0.2433 -0.2472 -0.2946 -0.1829 0.9380 0.1830 0.9526 0.2432 50.187 100.904 -20.651 313 ASP A 162 ASP^? 315 GLU A 159 GLU^? 390 TYR A 176 TYR^? ULMNm 3 1itx_c00 GLYCOSYL HYDROLASE user 2 3 RMSD = 1.12 A TRANSFORM -0.0774 -0.9238 -0.3749 0.2069 -0.3827 0.9004 -0.9753 -0.0079 0.2208 43.929 2.465 51.834 A 202 ASP A 162 ASP^? A 204 GLU A 159 GLU^? A 279 TYR A 176 TYR^? ULMNm 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.14 A TRANSFORM 0.2297 -0.9695 0.0853 0.0814 0.1064 0.9910 -0.9699 -0.2207 0.1034 19.669 35.798 43.274 A 99 ARG A 116 ARG^? A 101 ASP A 186 ASP^? A 132 ASP A 189 ASP^? ULMNm 3 1ef8_c02 METHYLMALONYL COA DECARBOXYLASE user 1 3 RMSD = 1.15 A TRANSFORM 0.0061 -0.8880 -0.4599 0.9772 0.1029 -0.1858 0.2123 -0.4482 0.8683 20.925 -22.399 19.252 C 66 HIS A 173 HIS^? C 110 GLY A 174 GLY^? C 140 TYR A 38 TYR^? ULMNm 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 RMSD = 1.15 A TRANSFORM -0.2550 0.9644 -0.0694 -0.2084 -0.1249 -0.9700 -0.9442 -0.2329 0.2328 4.457 -6.148 46.094 B 99 ARG A 116 ARG^? B 101 ASP A 186 ASP^? B 132 ASP A 189 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 RMSD = 1.16 A TRANSFORM 0.7010 -0.3471 -0.6230 0.6882 0.5582 0.4634 0.1869 -0.7537 0.6301 -22.361 -28.947 15.995 141 ASP A 201 ASP^? 166 GLY A 178 GLY^? 169 GLU A 154 GLU^? ULMNm 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 RMSD = 1.16 A TRANSFORM 0.0939 0.9289 0.3581 0.7818 -0.2915 0.5512 0.6164 0.2282 -0.7536 -5.861 58.377 -18.168 A 62 SER A 144 SER^? A 154 ASP A 35 ASP.? A 261 ARG A 122 ARG^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.17 A TRANSFORM -0.3628 0.8164 -0.4492 0.6577 -0.1172 -0.7441 -0.6602 -0.5654 -0.4945 -7.497 -8.478 17.387 141 ASP A 61 ASP.? 166 GLY A 103 GLY^? 169 GLU A 106 GLU^? ULMNm 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 5 3 RMSD = 1.19 A TRANSFORM 0.7092 -0.5528 0.4376 0.0236 0.6389 0.7690 -0.7046 -0.5350 0.4661 33.554 -19.740 95.103 A 198 GLY A 198 GLY^? A 228 SER A 36 SER.? A 549 ASP A 35 ASP.? ULMNm 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 RMSD = 1.20 A TRANSFORM -0.6752 0.7175 0.1710 0.0717 0.2946 -0.9529 -0.7341 -0.6312 -0.2503 -22.973 16.432 21.175 B 114 HIS A 8 HIS.? B 197 ASP A 10 ASP.? B 223 ALA A 131 ALA^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.20 A TRANSFORM -0.5175 0.8552 -0.0285 -0.7963 -0.4935 -0.3498 -0.3132 -0.1583 0.9364 70.102 98.469 155.808 F 141 GLY A 137 GLY^? F 144 GLU A 138 GLU^? F 164 GLU A 74 GLU^? ULMNm 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 RMSD = 1.21 A TRANSFORM 0.6645 -0.7265 -0.1750 0.0477 -0.1924 0.9802 -0.7457 -0.6597 -0.0932 -70.234 -26.206 18.056 A 114 HIS A 8 HIS.? A 197 ASP A 10 ASP.? A 223 ALA A 131 ALA^? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.22 A TRANSFORM -0.8580 0.0915 0.5054 0.3761 0.7820 0.4970 -0.3498 0.6165 -0.7054 76.173 86.816 150.983 C 141 GLY A 137 GLY^? C 144 GLU A 138 GLU^? C 164 GLU A 74 GLU^? ULMNm 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.22 A TRANSFORM 0.4828 -0.8572 0.1791 0.7838 0.5142 0.3481 -0.3905 -0.0277 0.9202 75.475 86.919 155.136 B 141 GLY A 137 GLY^? B 144 GLU A 138 GLU^? B 164 GLU A 74 GLU^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.22 A TRANSFORM 0.7700 0.0157 -0.6379 -0.3717 -0.8015 -0.4685 -0.5186 0.5978 -0.6113 69.813 98.061 152.034 D 141 GLY A 137 GLY^? D 144 GLU A 138 GLU^? D 164 GLU A 74 GLU^? ULMNm 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 RMSD = 1.22 A TRANSFORM 0.3004 -0.1894 0.9348 -0.5556 -0.8314 0.0101 0.7753 -0.5224 -0.3550 73.103 99.382 152.747 E 141 GLY A 137 GLY^? E 144 GLU A 138 GLU^? E 164 GLU A 74 GLU^? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.23 A TRANSFORM -0.9766 0.1020 0.1892 -0.1444 0.3407 -0.9290 -0.1592 -0.9346 -0.3180 55.350 50.191 -17.151 D 465 GLY A 198 GLY^? D 501 ASP A 61 ASP.? E 367 TYR A 6 TYR^? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 RMSD = 1.24 A TRANSFORM -0.5068 -0.2459 0.8262 0.8537 -0.2761 0.4415 0.1195 0.9291 0.3499 34.717 5.154 -47.158 A 465 GLY A 198 GLY^? A 501 ASP A 61 ASP.? B 367 TYR A 6 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.25 A TRANSFORM 0.4724 -0.8753 -0.1029 0.7294 0.4539 -0.5118 0.4947 0.1667 0.8529 -3.913 -21.294 -19.415 141 ASP A 71 ASP^? 166 GLY A 37 GLY^? 169 GLU A 154 GLU^? ULMNm 3 1vzx_c03 2.04.01.0087 user 1 3 RMSD = 1.26 A TRANSFORM 0.8186 0.4971 -0.2878 0.4839 -0.8667 -0.1209 -0.3095 -0.0402 -0.9500 -22.913 18.538 8.368 B1314 TYR A 38 TYR^? B1317 GLU A 154 GLU^? B1365 ARG A 122 ARG^? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 RMSD = 1.26 A TRANSFORM 0.3318 -0.3176 -0.8883 0.9398 0.0292 0.3406 -0.0823 -0.9478 0.3082 22.387 58.106 48.187 A 225 HIS A 173 HIS^? A 259 TYR A 176 TYR^? A 552 ASP A 82 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.26 A TRANSFORM 0.6972 -0.3803 -0.6077 0.5231 -0.3097 0.7940 -0.4901 -0.8715 -0.0170 -20.940 -0.420 40.156 141 ASP A 201 ASP^? 166 GLY A 37 GLY^? 169 GLU A 154 GLU^? ULMNm 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 RMSD = 1.28 A TRANSFORM -0.2747 -0.9606 -0.0413 -0.9535 0.2777 -0.1168 0.1237 0.0073 -0.9923 91.077 104.853 91.951 A 451 GLU A 45 GLU.? A 504 TYR A 78 TYR^? A 540 GLU A 138 GLU^? ULMNm 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 5 3 RMSD = 1.29 A TRANSFORM 0.4108 0.0623 0.9096 -0.6292 0.7413 0.2335 -0.6598 -0.6682 0.3437 116.008 80.103 167.279 B1198 GLY A 198 GLY^? B1228 SER A 36 SER.? B1549 ASP A 35 ASP.? ULMNm 3 1vzx_c02 2.04.01.0087 user 1 3 RMSD = 1.29 A TRANSFORM -0.8246 -0.4866 0.2885 0.4347 -0.8714 -0.2274 0.3620 -0.0622 0.9301 37.941 17.415 40.610 A 314 TYR A 38 TYR^? A 317 GLU A 154 GLU^? A 365 ARG A 122 ARG^? ULMNm 3 1oyg_c00 LEVANSUCRASE user 2 3 RMSD = 1.30 A TRANSFORM -0.1579 0.9874 -0.0058 -0.6954 -0.1070 0.7106 0.7011 0.1163 0.7035 13.882 47.473 -19.553 A 86 ASP A 162 ASP^? A 247 ASP A 156 ASP^? A 342 GLU A 158 GLU^? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 RMSD = 1.33 A TRANSFORM 0.4552 0.8008 -0.3892 -0.7439 0.5823 0.3279 0.4892 0.1403 0.8608 -37.230 63.735 20.853 A 53 SER A 125 SER^? A 54 PRO A 124 PRO^? A 96 ASP A 35 ASP.? ULMNm 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 RMSD = 1.33 A TRANSFORM -0.4627 -0.8850 -0.0522 0.8774 -0.4655 0.1162 -0.1271 0.0079 0.9919 99.596 19.532 108.273 B 451 GLU A 45 GLU.? B 504 TYR A 78 TYR^? B 540 GLU A 138 GLU^? ULMNm 3 1emh_d00 HYDROLASE/DNA user 1 3 RMSD = 1.34 A TRANSFORM 0.6420 0.4068 -0.6499 0.6968 -0.6632 0.2731 -0.3199 -0.6282 -0.7093 -9.959 2.230 32.739 A 271 PRO A 60 PRO.? A 272 LEU A 59 LEU.? A 276 ARG A 55 ARG~? ULMNm 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 RMSD = 1.35 A TRANSFORM -0.1397 0.6304 -0.7636 -0.7425 0.4436 0.5020 0.6552 0.6371 0.4061 37.054 86.135 -1.389 229 ASP A 156 ASP^? 257 GLU A 159 GLU^? 328 ASP A 162 ASP^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 5 3 RMSD = 1.35 A TRANSFORM 0.0110 -0.1983 0.9801 0.9996 0.0281 -0.0056 -0.0264 0.9797 0.1985 35.295 -3.297 -5.076 I 303 TYR A 97 TYR^? I 306 VAL A 184 VAL^? I 308 VAL A 194 VAL^? ULMNm 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 RMSD = 1.36 A TRANSFORM -0.8912 0.4175 0.1772 -0.2024 -0.7156 0.6686 0.4059 0.5600 0.7222 37.577 148.103 -4.482 A 461 GLU A 45 GLU.? A 503 TYR A 78 TYR^? A 537 GLU A 138 GLU^? ULMNm 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 2 3 RMSD = 1.37 A TRANSFORM -0.7143 0.4608 0.5267 -0.4700 -0.8735 0.1269 0.5185 -0.1569 0.8406 52.744 76.944 -4.076 199 ASP A 156 ASP^? 255 GLU A 159 GLU^? 329 ASP A 162 ASP^? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.38 A TRANSFORM -0.5157 -0.4406 -0.7348 0.7886 -0.5794 -0.2060 -0.3350 -0.6857 0.6463 15.971 22.936 10.419 A 81 ASP A 35 ASP.? A 99 GLY A 95 GLY^? A 125 ASN A 96 ASN^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 RMSD = 1.39 A TRANSFORM 0.9243 -0.2869 -0.2516 0.1425 0.8711 -0.4699 0.3540 0.3985 0.8461 40.778 8.394 -18.096 199 ASP A 162 ASP^? 218 GLU A 134 GLU^? 329 ASP A 156 ASP^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 RMSD = 1.40 A TRANSFORM 0.7475 -0.5838 -0.3170 0.4993 0.8085 -0.3116 0.4382 0.0746 0.8958 56.441 -1.075 -10.132 199 ASP A 162 ASP^? 218 GLU A 138 GLU^? 329 ASP A 156 ASP^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 RMSD = 1.42 A TRANSFORM -0.7981 0.5420 -0.2632 0.3767 0.1080 -0.9200 -0.4702 -0.8334 -0.2904 70.405 7.985 27.650 199 ASP A 82 ASP^? 218 GLU A 51 GLU~? 329 ASP A 189 ASP^? ULMNm 3 1qho_c04 ALPHA-AMYLASE user 2 3 RMSD = 1.43 A TRANSFORM -0.5347 0.4348 0.7246 -0.0532 0.8385 -0.5424 -0.8434 -0.3286 -0.4252 25.399 49.885 68.317 A 228 ASP A 156 ASP^? A 256 GLU A 159 GLU^? A 329 ASP A 162 ASP^? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 RMSD = 1.44 A TRANSFORM -0.4326 0.5385 0.7231 -0.3051 0.6672 -0.6795 -0.8484 -0.5146 -0.1244 74.925 27.957 43.127 199 ASP A 190 ASP^? 218 GLU A 134 GLU^? 329 ASP A 186 ASP^? ULMNm 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 RMSD = 1.44 A TRANSFORM 0.1434 -0.9719 0.1864 0.6729 0.2339 0.7018 -0.7257 0.0248 0.6876 16.805 -9.742 103.389 A 159 LYS A 203 LYS^? A 193 GLU A 197 GLU^? A 217 VAL A 202 VAL^? ULMNm 3 1emh_d00 HYDROLASE/DNA user 2 3 RMSD = 1.44 A TRANSFORM -0.2051 -0.8045 0.5574 -0.9433 0.0105 -0.3319 0.2611 -0.5938 -0.7610 23.848 24.889 15.511 A 271 PRO A 139 PRO^? A 272 LEU A 67 LEU^? A 276 ARG A 122 ARG^? ULMNm 3 1cqt_d00 GENE REGULATION/DNA user 4 3 RMSD = 1.44 A TRANSFORM 0.1982 0.2484 0.9482 0.9801 -0.0441 -0.1933 -0.0062 0.9677 -0.2522 21.961 -2.783 -9.619 I 303 TYR A 97 TYR^? I 306 VAL A 184 VAL^? I 308 VAL A 193 VAL^? ULMNm 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 3 3 RMSD = 1.44 A TRANSFORM 0.3715 -0.2482 -0.8947 0.9115 -0.0859 0.4023 -0.1767 -0.9649 0.1943 18.749 61.717 53.380 A 225 HIS A 173 HIS^? A 259 TYR A 176 TYR^? A 552 ASP A 190 ASP^? ULMNm 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 RMSD = 1.47 A TRANSFORM 0.6608 0.4084 0.6297 0.2237 -0.9081 0.3541 0.7164 -0.0931 -0.6914 0.217 44.619 -34.807 A 396 ARG A 196 ARG^? A 581 ARG A 122 ARG^? A 713 ARG A 57 ARG~? ULMNm 3 1ef8_c00 METHYLMALONYL COA DECARBOXYLASE user 3 3 RMSD = 1.47 A TRANSFORM 0.1210 -0.7205 0.6828 -0.3536 -0.6740 -0.6486 0.9275 -0.1630 -0.3363 29.088 40.044 -19.878 A 66 HIS A 173 HIS^? A 110 GLY A 175 GLY^? A 140 TYR A 38 TYR^? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 RMSD = 1.49 A TRANSFORM 0.8565 -0.3033 -0.4177 0.4537 0.0562 0.8894 -0.2462 -0.9512 0.1858 6.278 15.696 98.674 A 241 ASP A 169 ASP^? A 279 GLU A 158 GLU^? A 369 ASP A 46 ASP~?