*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 RMSD = 0.88 A TRANSFORM -0.9245 -0.2588 -0.2798 -0.3227 0.1412 0.9359 0.2027 -0.9555 0.2141 172.379 -51.852 24.623 B 36 GLU A 180 GLU~? B 47 ASP A 168 ASP~? B 161 TYR A 198 TYR~? ULMNm 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 RMSD = 0.88 A TRANSFORM 0.2554 -0.2065 -0.9445 0.9387 0.2868 0.1911 -0.2314 0.9355 -0.2671 132.394 -91.126 111.587 A 36 GLU A 180 GLU~? A 47 ASP A 168 ASP~? A 161 TYR A 198 TYR~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 1 3 RMSD = 0.92 A TRANSFORM -0.9777 -0.1867 -0.0962 0.0630 -0.6976 0.7137 0.2004 -0.6917 -0.6938 118.601 15.964 76.740 A 459 ASN A 182 ASN~? A 460 GLY A 183 GLY~? A 461 ASN A 184 ASN.? ULMNm 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 RMSD = 0.96 A TRANSFORM -0.0378 0.4693 0.8822 -0.5260 0.7413 -0.4169 0.8497 0.4798 -0.2189 -57.268 82.717 -49.450 A 37 ASP A 168 ASP~? A 56 ILE A 173 ILE.? A 82 TYR A 202 TYR~? ULMNm 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 RMSD = 0.98 A TRANSFORM -0.0303 0.4688 0.8828 -0.5509 0.7291 -0.4061 0.8340 0.4986 -0.2362 -55.057 67.062 -73.872 B 37 ASP A 168 ASP~? B 56 ILE A 173 ILE.? B 82 TYR A 202 TYR~? ULMNm 3 1ir3_c02 INSULIN RECEPTOR user 1 3 RMSD = 0.99 A TRANSFORM 0.5396 0.8303 -0.1394 0.7456 -0.3943 0.5372 -0.3911 0.3938 0.8318 -75.414 -67.207 -52.417 A1132 ASP A 152 ASP~? A1134 ALA A 151 ALA~? A1137 ASN A 149 ASN~? ULMNm 3 2qv4_p00 PANCREATIC ALPHA-AMYLASE user 2 3 RMSD = 0.99 A TRANSFORM 0.4343 0.8603 0.2670 0.4601 0.0430 -0.8868 0.7744 -0.5080 0.3772 -61.392 154.544 -99.028 A 459 ASN A 184 ASN.? A 460 GLY A 183 GLY~? A 461 ASN A 182 ASN~? ULMNm 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 RMSD = 1.00 A TRANSFORM -0.8285 -0.3267 0.4548 -0.5600 0.4940 -0.6651 0.0074 0.8057 0.5922 -3.260 169.352 -29.478 A 53 SER A 228 SER^? A 54 PRO A 229 PRO^? A 96 ASP A 227 ASP^? ULMNm 3 1uk7_c00 3.07.01.0009 user 2 3 RMSD = 1.05 A TRANSFORM -0.5741 0.7956 -0.1935 0.7620 0.6056 0.2294 -0.2998 0.0158 0.9539 79.598 -51.115 -93.876 A 103 ALA A 205 ALA.? A 224 ASP A 196 ASP~? A 252 HIS A 195 HIS~? ULMNm 3 2r11_o03 CARBOXYLESTERASE NP user 4 3 RMSD = 1.05 A TRANSFORM 0.3558 0.8109 -0.4646 0.9123 -0.4093 -0.0156 0.2029 0.4183 0.8854 -23.549 -21.074 -74.518 D 130 SER A 185 SER.? D 166 PHE A 63 PHE~? D 182 PHE A 44 PHE~? ULMNm 3 2r11_o00 CARBOXYLESTERASE NP user 3 3 RMSD = 1.06 A TRANSFORM 0.7333 0.6314 0.2522 -0.5906 0.7753 -0.2237 0.3368 -0.0151 -0.9415 -148.657 106.484 155.204 A 130 SER A 185 SER.? A 166 PHE A 63 PHE~? A 182 PHE A 44 PHE~? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 5 3 RMSD = 1.06 A TRANSFORM 0.1467 -0.2199 -0.9644 -0.5820 -0.8076 0.0956 0.7999 -0.5472 0.2464 116.400 21.318 -110.116 14 ASP A 273 ASP^? 16 HIS A 271 HIS^? 67 GLY A 259 GLY.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 RMSD = 1.08 A TRANSFORM -0.1205 0.9921 -0.0338 0.9594 0.1252 0.2527 -0.2549 0.0020 0.9670 46.646 -117.995 -76.077 A 67 ASP A 91 ASP.? A 68 ALA A 178 ALA~? A 72 LEU A 88 LEU~? ULMNm 3 2r11_o02 CARBOXYLESTERASE NP user 3 3 RMSD = 1.09 A TRANSFORM -0.7776 -0.4703 0.4173 0.5916 -0.7721 0.2321 -0.2131 -0.4273 -0.8786 28.579 -6.041 172.633 C 130 SER A 185 SER.? C 166 PHE A 63 PHE~? C 182 PHE A 44 PHE~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.10 A TRANSFORM -0.8570 0.4418 0.2655 0.2819 -0.0295 0.9590 -0.4315 -0.8966 0.0993 21.594 -147.004 30.317 141 ASP A 19 ASP~? 166 GLY A 269 GLY.? 169 GLU A 236 GLU~? ULMNm 3 2r11_o01 CARBOXYLESTERASE NP user 3 3 RMSD = 1.11 A TRANSFORM -0.4061 -0.8880 -0.2158 -0.9106 0.4131 0.0134 -0.0773 -0.2020 0.9763 51.437 122.671 0.075 B 130 SER A 185 SER.? B 166 PHE A 63 PHE~? B 182 PHE A 44 PHE~? ULMNm 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.12 A TRANSFORM 0.3095 0.0992 -0.9457 0.7858 -0.5868 0.1956 0.5355 0.8036 0.2596 125.117 -51.024 -1.570 A 241 ASP A 267 ASP^? A 279 GLU A 276 GLU.? A 369 ASP A 246 ASP.? ULMNm 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.12 A TRANSFORM 0.2468 -0.7161 -0.6529 0.8996 -0.0811 0.4290 0.3602 0.6933 -0.6242 122.704 -124.659 37.722 B 1 ALA A 74 ALA.? B 74 ASN A 78 ASN~? B 75 GLY A 72 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.12 A TRANSFORM -0.3532 0.9144 0.1977 0.5458 0.0298 0.8374 -0.7598 -0.4037 0.5096 8.495 -212.884 -99.210 A 183 GLY A 50 GLY~? B 419 GLY A 47 GLY~? B 420 ALA A 46 ALA~? ULMNm 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.13 A TRANSFORM -0.1967 -0.0906 -0.9763 -0.0910 -0.9897 0.1102 0.9762 -0.1105 -0.1865 139.896 99.627 50.974 A 1 ALA A 74 ALA.? A 74 ASN A 78 ASN~? A 75 GLY A 72 GLY.? ULMNm 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 RMSD = 1.15 A TRANSFORM 0.0929 0.3768 0.9216 0.2306 -0.9086 0.3482 -0.9686 -0.1802 0.1713 -128.853 -4.049 54.086 A 81 ASP A 137 ASP~? A 99 GLY A 183 GLY~? A 125 ASN A 182 ASN~? ULMNm 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 RMSD = 1.18 A TRANSFORM 0.6783 0.6664 -0.3095 0.7168 -0.6928 0.0789 0.1619 0.2754 0.9476 -30.986 29.308 -97.029 A 123 HIS A 35 HIS~? A 200 ASP A 95 ASP.? A 229 LYS A 90 LYS~? ULMNm 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 RMSD = 1.18 A TRANSFORM 0.3431 -0.9078 -0.2412 0.5296 0.3990 -0.7486 -0.7758 -0.1291 -0.6176 35.797 135.344 229.339 B 123 HIS A 35 HIS~? B 200 ASP A 95 ASP.? B 229 LYS A 90 LYS~? ULMNm 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 RMSD = 1.18 A TRANSFORM 0.1943 0.0650 -0.9788 -0.7060 0.7021 -0.0935 -0.6811 -0.7091 -0.1823 131.488 114.746 178.069 C 123 HIS A 35 HIS~? C 200 ASP A 95 ASP.? C 229 LYS A 90 LYS~? ULMNm 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.19 A TRANSFORM 0.2851 0.9094 0.3029 -0.2055 0.3667 -0.9074 0.9362 -0.1964 -0.2914 -86.993 130.383 -14.883 C 1 ALA A 74 ALA.? C 74 ASN A 78 ASN~? C 75 GLY A 72 GLY.? ULMNm 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 RMSD = 1.19 A TRANSFORM 0.8542 -0.3149 0.4137 -0.5158 -0.4138 0.7502 0.0651 0.8542 0.5159 -121.310 6.765 -37.982 D 123 HIS A 35 HIS~? D 200 ASP A 95 ASP.? D 229 LYS A 90 LYS~? ULMNm 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 1.19 A TRANSFORM -0.5243 -0.5048 -0.6858 0.8377 -0.1612 -0.5218 -0.1528 0.8481 -0.5074 152.411 26.284 38.332 A 465 GLY A 96 GLY~? A 501 ASP A 19 ASP~? B 367 TYR A 135 TYR~? ULMNm 3 1ddj_c15 PLASMINOGEN user 1 3 RMSD = 1.19 A TRANSFORM -0.3942 -0.9182 0.0392 -0.3339 0.1033 -0.9369 -0.8562 0.3824 0.3474 32.910 181.575 71.796 D 603 HIS A 83 HIS~? D 646 ASP A 86 ASP~? D 739 GLY A 47 GLY~? ULMNm 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 RMSD = 1.20 A TRANSFORM 0.7155 0.3086 0.6268 -0.6036 0.7248 0.3321 0.3518 0.6160 -0.7048 -174.288 32.930 140.520 D 1 ALA A 74 ALA.? D 74 ASN A 78 ASN~? D 75 GLY A 72 GLY.? ULMNm 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 4 3 RMSD = 1.21 A TRANSFORM -0.9872 -0.1531 -0.0457 -0.1136 0.4721 0.8742 0.1123 -0.8681 0.4835 116.376 -56.862 -97.291 D 465 GLY A 96 GLY~? D 501 ASP A 19 ASP~? E 367 TYR A 135 TYR~? ULMNm 3 1euu_c00 SIALIDASE user 3 3 RMSD = 1.22 A TRANSFORM -0.8480 -0.5164 -0.1193 0.1308 0.0142 -0.9913 -0.5136 0.8563 -0.0555 95.859 95.960 62.483 92 ASP A 168 ASP~? 260 GLU A 180 GLU~? 370 TYR A 198 TYR~? ULMNm 3 1ddj_c13 PLASMINOGEN user 3 3 RMSD = 1.22 A TRANSFORM 0.6531 -0.7565 -0.0345 0.4285 0.4067 -0.8068 -0.6244 -0.5121 -0.5898 -75.350 114.242 105.332 B 603 HIS A 251 HIS^? B 646 ASP A 264 ASP^? B 739 GLY A 203 GLY~? ULMNm 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 RMSD = 1.23 A TRANSFORM -0.3006 -0.6953 0.6529 0.4705 -0.7035 -0.5326 -0.8296 -0.1471 -0.5386 -36.305 30.693 141.811 A 105 ALA A 205 ALA.? A 244 ASP A 196 ASP~? A 271 HIS A 195 HIS~? ULMNm 3 1sll_c00 SIALIDASE L user 3 3 RMSD = 1.23 A TRANSFORM -0.5961 0.1277 -0.7927 0.7922 0.2541 -0.5549 -0.1305 0.9587 0.2526 149.227 8.164 3.271 318 ASP A 168 ASP~? 595 GLU A 180 GLU~? 713 TYR A 198 TYR~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 1.23 A TRANSFORM -0.6327 -0.6696 0.3890 -0.4871 0.7346 0.4723 0.6020 -0.1094 0.7909 78.798 -131.017 -269.313 A 420 ALA A 123 ALA~? B 182 GLY A 47 GLY~? B 183 GLY A 50 GLY~? ULMNm 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 3 3 RMSD = 1.23 A TRANSFORM -0.9689 -0.2441 -0.0410 -0.1927 0.6397 0.7441 0.1554 -0.7288 0.6668 116.587 -28.417 -25.119 B 107 ASP A 264 ASP^? B 246 ASP A 227 ASP^? B 275 HIS A 251 HIS^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 RMSD = 1.23 A TRANSFORM 0.4564 -0.0276 -0.8893 -0.5890 -0.7586 -0.2787 0.6670 -0.6510 0.3625 79.971 119.364 -120.193 A 49 ASP A 95 ASP.? A 147 THR A 98 THR~? A 294 ASP A 91 ASP.? ULMNm 3 1lio_c01 ADENOSINE KINASE user 1 3 RMSD = 1.24 A TRANSFORM -0.8558 -0.5127 0.0691 -0.3402 0.4570 -0.8218 -0.3898 0.7268 0.5655 104.249 122.496 -9.785 A 316 ALA A 151 ALA~? A 317 GLY A 150 GLY~? A 318 ASP A 152 ASP~? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 1.24 A TRANSFORM 0.4193 -0.3490 0.8381 -0.8254 -0.5309 0.1919 -0.3780 0.7722 0.5107 -110.512 -58.395 -172.031 A 420 ALA A 235 ALA~? B 182 GLY A 269 GLY.? B 183 GLY A 239 GLY~? ULMNm 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 RMSD = 1.25 A TRANSFORM -0.7980 -0.0701 0.5985 -0.5516 -0.3149 -0.7724 -0.2426 0.9465 -0.2127 -26.743 156.923 62.652 A 630 SER A 274 SER^? A 709 ASP A 270 ASP^? A 740 HIS A 271 HIS^? ULMNm 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 3 3 RMSD = 1.25 A TRANSFORM 0.1551 -0.6328 0.7586 0.0713 -0.7587 -0.6475 -0.9853 -0.1545 0.0726 -81.505 100.939 149.315 D 107 ASP A 264 ASP^? D 246 ASP A 227 ASP^? D 275 HIS A 251 HIS^? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.26 A TRANSFORM -0.7641 -0.2801 -0.5811 0.0674 -0.9306 0.3599 0.6415 -0.2359 -0.7299 108.847 -65.279 56.295 C 51 ALA A 205 ALA.? C 148 HIS A 195 HIS~? C 163 ASP A 196 ASP~? ULMNm 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 RMSD = 1.26 A TRANSFORM 0.9646 0.2632 -0.0179 0.0757 -0.3411 -0.9370 0.2528 -0.9024 0.3489 -68.727 134.920 -38.281 B 630 SER A 274 SER^? B 709 ASP A 270 ASP^? B 740 HIS A 271 HIS^? ULMNm 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.27 A TRANSFORM 0.4121 -0.0555 -0.9095 0.8649 -0.2901 0.4096 0.2866 0.9554 0.0715 94.616 -91.077 43.154 C 107 ASP A 264 ASP^? C 246 ASP A 227 ASP^? C 275 HIS A 251 HIS^? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 RMSD = 1.27 A TRANSFORM -0.8132 0.5683 0.1253 0.3675 0.6685 -0.6465 0.4512 0.4797 0.7525 93.157 67.137 -129.851 A 261 GLY A 27 GLY~? B 17 GLN A 22 GLN~? B 140 GLU A 28 GLU.? ULMNm 3 1ddj_c14 PLASMINOGEN user 5 3 RMSD = 1.28 A TRANSFORM 0.8322 -0.1578 -0.5315 -0.1119 0.8911 -0.4398 -0.5430 -0.4255 -0.7239 22.007 129.653 197.411 C 603 HIS A 251 HIS^? C 646 ASP A 264 ASP^? C 739 GLY A 278 GLY.? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 RMSD = 1.29 A TRANSFORM 0.4620 0.5882 -0.6638 0.8814 -0.2212 0.4175 -0.0988 0.7779 0.6206 77.946 -197.238 -211.366 A 183 GLY A 239 GLY~? B 419 GLY A 269 GLY.? B 420 ALA A 243 ALA~? ULMNm 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 RMSD = 1.29 A TRANSFORM -0.5606 0.4818 -0.6735 0.4849 0.8503 0.2046 -0.6712 0.2119 0.7103 140.064 -4.467 65.608 A 270 ASN A 166 ASN.? A 384 ASN A 258 ASN.? A 385 GLU A 255 GLU^? ULMNm 3 1ddj_c12 PLASMINOGEN user 4 3 RMSD = 1.30 A TRANSFORM 0.8358 -0.0973 -0.5404 -0.1837 0.8780 -0.4421 -0.5175 -0.4687 -0.7159 25.744 136.306 130.979 A 603 HIS A 251 HIS^? A 646 ASP A 264 ASP^? A 739 GLY A 278 GLY.? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.30 A TRANSFORM 0.6743 0.6601 0.3311 -0.5224 0.7433 -0.4179 0.5220 -0.1088 -0.8460 -97.320 111.124 80.713 A 51 ALA A 205 ALA.? A 148 HIS A 195 HIS~? A 163 ASP A 196 ASP~? ULMNm 3 1ddj_c15 PLASMINOGEN user 2 3 RMSD = 1.31 A TRANSFORM -0.4069 -0.6504 -0.6414 0.2290 0.6071 -0.7609 -0.8843 0.4565 0.0981 112.282 88.514 103.682 D 603 HIS A 83 HIS~? D 646 ASP A 86 ASP~? D 739 GLY A 72 GLY.? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.31 A TRANSFORM -0.6972 -0.6404 -0.3222 -0.5434 0.7652 -0.3451 -0.4675 0.0655 0.8816 65.707 104.660 -13.381 B 51 ALA A 205 ALA.? B 148 HIS A 195 HIS~? B 163 ASP A 196 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 5 3 RMSD = 1.32 A TRANSFORM 0.6976 -0.5157 -0.4974 0.1926 0.8037 -0.5630 -0.6901 -0.2969 -0.6600 29.299 122.934 137.342 A 603 HIS A 251 HIS^? A 646 ASP A 264 ASP^? A 739 GLY A 280 GLY.? ULMNm 3 1ddj_c14 PLASMINOGEN user 2 3 RMSD = 1.32 A TRANSFORM 0.7178 -0.2552 0.6478 -0.6275 0.1661 0.7607 0.3017 0.9525 0.0409 -129.962 19.960 -5.862 C 603 HIS A 83 HIS~? C 646 ASP A 86 ASP~? C 739 GLY A 72 GLY.? ULMNm 3 1ddj_c13 PLASMINOGEN user 2 3 RMSD = 1.32 A TRANSFORM -0.1780 -0.6584 -0.7313 0.1619 0.7135 -0.6817 -0.9706 0.2397 0.0205 102.786 84.821 65.102 B 603 HIS A 83 HIS~? B 646 ASP A 86 ASP~? B 739 GLY A 72 GLY.? ULMNm 3 1ddj_c13 PLASMINOGEN user 5 3 RMSD = 1.33 A TRANSFORM 0.0584 -0.0143 0.9982 -0.9589 -0.2789 0.0521 -0.2777 0.9602 0.0300 -166.878 103.567 -1.032 B 603 HIS A 251 HIS^? B 646 ASP A 264 ASP^? B 739 GLY A 280 GLY.? ULMNm 3 1ddj_c12 PLASMINOGEN user 3 3 RMSD = 1.33 A TRANSFORM -0.1006 0.4775 0.8729 -0.9912 -0.1241 -0.0463 -0.0862 0.8698 -0.4858 -91.292 141.987 70.340 A 603 HIS A 251 HIS^? A 646 ASP A 264 ASP^? A 739 GLY A 203 GLY~? ULMNm 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 RMSD = 1.33 A TRANSFORM 0.0909 -0.8661 0.4916 0.7309 0.3934 0.5578 0.6764 -0.3086 -0.6687 -98.181 -120.696 -22.318 H 51 ALA A 205 ALA.? H 148 HIS A 195 HIS~? H 163 ASP A 196 ASP~? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.34 A TRANSFORM 0.7543 0.3446 0.5588 0.0931 -0.8987 0.4286 -0.6499 0.2713 0.7100 -138.127 -75.853 23.304 D 51 ALA A 205 ALA.? D 148 HIS A 195 HIS~? D 163 ASP A 196 ASP~? ULMNm 3 1cwy_c00 AMYLOMALTASE user 1 3 RMSD = 1.34 A TRANSFORM -0.9424 0.3333 -0.0271 0.0447 0.2059 0.9776 -0.3314 -0.9200 0.2089 29.696 -174.427 3.849 A 293 ASP A 267 ASP^? A 340 GLU A 248 GLU^? A 395 ASP A 246 ASP.? ULMNm 3 1ddj_c15 PLASMINOGEN user 6 3 RMSD = 1.34 A TRANSFORM 0.0033 0.1150 0.9934 -0.6627 -0.7436 0.0883 -0.7489 0.6586 -0.0738 -163.370 71.191 112.417 D 603 HIS A 251 HIS^? D 646 ASP A 264 ASP^? D 739 GLY A 278 GLY.? ULMNm 3 1qrz_c14 PLASMINOGEN user 1 3 RMSD = 1.35 A TRANSFORM -0.5184 -0.1292 0.8453 -0.3055 -0.8953 -0.3241 -0.7987 0.4263 -0.4247 -37.296 68.101 102.650 C 603 HIS A 147 HIS.? C 646 ASP A 152 ASP~? C 741 SER A 145 SER.? ULMNm 3 1euu_c00 SIALIDASE user 2 3 RMSD = 1.36 A TRANSFORM 0.3761 -0.6666 -0.6435 0.7981 -0.1197 0.5905 0.4707 0.7357 -0.4870 56.600 -151.358 31.790 92 ASP A 137 ASP~? 260 GLU A 180 GLU~? 370 TYR A 198 TYR~? ULMNm 3 1ddj_c14 PLASMINOGEN user 3 3 RMSD = 1.36 A TRANSFORM -0.0416 0.5051 0.8621 -0.9910 -0.1308 0.0289 -0.1274 0.8531 -0.5060 -96.941 130.964 139.428 C 603 HIS A 251 HIS^? C 646 ASP A 264 ASP^? C 739 GLY A 203 GLY~? ULMNm 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.37 A TRANSFORM 0.9796 0.0982 0.1754 -0.1592 0.9117 0.3786 0.1228 0.3988 -0.9088 -140.359 -17.413 166.536 B 51 ALA A 235 ALA~? B 148 HIS A 271 HIS^? B 163 ASP A 264 ASP^? ULMNm 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 RMSD = 1.38 A TRANSFORM -0.0655 0.8931 -0.4450 -0.6247 0.3111 0.7162 -0.7781 -0.3249 -0.5376 48.832 -30.700 121.502 A 49 ASP A 95 ASP.? A 147 THR A 98 THR~? A 294 ASP A 103 ASP~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 RMSD = 1.38 A TRANSFORM 0.5944 0.6455 -0.4796 0.2675 -0.7211 -0.6390 0.7584 -0.2515 0.6013 7.105 81.895 -141.160 141 ASP A 95 ASP.? 166 GLY A 239 GLY~? 169 GLU A 248 GLU^? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.38 A TRANSFORM 0.0538 -0.8626 0.5031 -0.6728 -0.4036 -0.6200 -0.7379 0.3051 0.6021 -95.714 120.893 -26.416 G 51 ALA A 205 ALA.? G 148 HIS A 195 HIS~? G 163 ASP A 196 ASP~? ULMNm 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.38 A TRANSFORM 0.8039 0.3848 0.4536 0.5849 -0.6501 -0.4850 -0.1083 -0.6552 0.7477 -155.446 -3.370 -70.803 C 51 ALA A 235 ALA~? C 148 HIS A 271 HIS^? C 163 ASP A 264 ASP^? ULMNm 3 1lij_c01 ADENOSINE KINASE user 1 3 RMSD = 1.38 A TRANSFORM 0.9416 -0.2708 -0.2001 -0.3303 -0.8584 -0.3925 0.0654 -0.4357 0.8977 98.811 112.736 -90.013 A 316 ALA A 151 ALA~? A 317 GLY A 150 GLY~? A 318 ASP A 152 ASP~? ULMNm 3 1ddj_c12 PLASMINOGEN user 2 3 RMSD = 1.39 A TRANSFORM 0.6735 -0.2658 0.6898 -0.6524 0.2252 0.7237 0.3477 0.9374 0.0218 -127.906 26.089 -70.769 A 603 HIS A 83 HIS~? A 646 ASP A 86 ASP~? A 739 GLY A 72 GLY.? ULMNm 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 2 3 RMSD = 1.39 A TRANSFORM 0.5271 0.6040 0.5978 0.8474 -0.3207 -0.4232 0.0639 -0.7296 0.6809 22.311 18.058 -107.905 A 16 TYR A 263 TYR^? A 38 GLU A 10 GLU^? A 46 TRP A 252 TRP^? ULMNm 3 1ddj_c13 PLASMINOGEN user 4 3 RMSD = 1.39 A TRANSFORM 0.0873 -0.1240 0.9884 -0.7477 -0.6638 -0.0173 -0.6583 0.7375 0.1507 -168.334 95.216 11.655 B 603 HIS A 251 HIS^? B 646 ASP A 264 ASP^? B 739 GLY A 278 GLY.? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.39 A TRANSFORM -0.5231 0.7373 -0.4275 0.7473 0.6380 0.1860 -0.4098 0.2221 0.8847 98.550 -71.874 -87.488 F 51 ALA A 205 ALA.? F 148 HIS A 195 HIS~? F 163 ASP A 196 ASP~? ULMNm 3 3hde_o01 LYSOZYME user 1 3 RMSD = 1.40 A TRANSFORM -0.7451 -0.5432 -0.3869 -0.6561 0.7010 0.2793 -0.1195 -0.4620 0.8788 111.901 -13.730 -94.338 B 35 GLU A 117 GLU.? B 44 ASP A 152 ASP~? B 50 THR A 155 THR~? ULMNm 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 3 3 RMSD = 1.40 A TRANSFORM -0.5552 0.3850 -0.7372 0.7817 -0.0613 -0.6207 0.2842 0.9209 0.2670 202.931 35.897 -37.468 A 261 GLY A 259 GLY.? B 17 GLN A 254 GLN^? B 140 GLU A 255 GLU^? ULMNm 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 5 3 RMSD = 1.40 A TRANSFORM 0.5679 -0.5989 -0.5647 0.8092 0.2806 0.5162 0.1507 0.7501 -0.6440 -5.287 -149.829 59.851 G 51 ALA A 235 ALA~? G 148 HIS A 271 HIS^? G 163 ASP A 264 ASP^? ULMNm 3 3hde_o02 LYSOZYME user 1 3 RMSD = 1.40 A TRANSFORM 0.1507 -0.8191 0.5535 -0.9838 -0.1795 0.0021 -0.0976 0.5448 0.8329 -22.474 86.412 -99.981 C 35 GLU A 117 GLU.? C 44 ASP A 152 ASP~? C 50 THR A 155 THR~? ULMNm 3 1qrz_c13 PLASMINOGEN user 1 3 RMSD = 1.41 A TRANSFORM 0.5882 -0.4462 0.6745 0.2749 0.8947 0.3521 0.7606 0.0216 -0.6489 -149.863 -74.679 -0.887 B 603 HIS A 147 HIS.? B 646 ASP A 152 ASP~? B 741 SER A 145 SER.? ULMNm 3 1ddj_c14 PLASMINOGEN user 4 3 RMSD = 1.42 A TRANSFORM 0.8255 0.5584 0.0826 -0.5644 0.8190 0.1035 0.0098 0.1320 -0.9912 -58.175 91.250 191.925 C 603 HIS A 251 HIS^? C 646 ASP A 264 ASP^? C 739 GLY A 259 GLY.? ULMNm 3 1ddj_c15 PLASMINOGEN user 5 3 RMSD = 1.42 A TRANSFORM -0.2709 -0.6827 0.6786 -0.0405 -0.6962 -0.7167 -0.9617 0.2216 -0.1610 -101.793 131.464 139.370 D 603 HIS A 251 HIS^? D 646 ASP A 264 ASP^? D 739 GLY A 259 GLY.? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 3 3 RMSD = 1.42 A TRANSFORM 0.1969 -0.9067 -0.3730 -0.9803 -0.1757 -0.0903 -0.0163 -0.3834 0.9234 139.712 150.252 -40.861 A 170 SER A 77 SER~? A 239 VAL A 75 VAL~? A 413 ASN A 78 ASN~? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 RMSD = 1.43 A TRANSFORM -0.5021 0.7591 -0.4142 -0.7573 -0.6173 -0.2132 0.4176 -0.2066 -0.8848 95.274 75.490 24.605 E 51 ALA A 205 ALA.? E 148 HIS A 195 HIS~? E 163 ASP A 196 ASP~? ULMNm 3 3nwu_o00 SERINE PROTEASE HTRA1 user 3 3 RMSD = 1.43 A TRANSFORM -0.0608 -0.0151 -0.9980 -0.9492 -0.3083 0.0625 0.3087 -0.9512 -0.0044 113.066 112.380 -36.804 A 220 HIS A 271 HIS^? A 250 ASP A 264 ASP^? A 328 SER A 242 SER~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.43 A TRANSFORM 0.6122 0.6530 -0.4459 0.7798 -0.5919 0.2038 0.1308 0.4725 0.8716 1.239 -78.370 -135.108 141 ASP A 95 ASP.? 166 GLY A 269 GLY.? 169 GLU A 248 GLU^? ULMNm 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 RMSD = 1.43 A TRANSFORM -0.8237 -0.2307 0.5179 -0.0260 -0.8972 -0.4409 -0.5664 0.3767 -0.7330 32.172 137.407 178.642 B 136 HIS A 83 HIS~? B 210 ASP A 86 ASP~? B 244 LYS A 56 LYS.? ULMNm 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 4 3 RMSD = 1.43 A TRANSFORM 0.4205 0.7060 -0.5699 -0.9051 0.2827 -0.3176 0.0631 -0.6493 -0.7579 76.398 178.046 111.708 B 194 SER A 228 SER^? B 292 ASP A 217 ASP^? B 322 HIS A 195 HIS~? ULMNm 3 3nwu_o01 SERINE PROTEASE HTRA1 user 3 3 RMSD = 1.43 A TRANSFORM -0.4252 0.9044 -0.0365 -0.0958 -0.0850 -0.9918 0.9000 0.4182 -0.1228 -17.888 211.307 -74.525 B 220 HIS A 271 HIS^? B 250 ASP A 264 ASP^? B 328 SER A 242 SER~? ULMNm 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 2 3 RMSD = 1.44 A TRANSFORM 0.5550 -0.5273 -0.6434 -0.7455 -0.6584 -0.1035 0.3690 -0.5371 0.7585 81.119 117.127 -11.993 B 237 HIS A 69 HIS.? B 238 GLY A 50 GLY~? B 287 CYH A 48 CYH~? ULMNm 3 1oqz_c01 GLUTARYL ACYLASE user 3 3 RMSD = 1.44 A TRANSFORM -0.1954 0.9143 0.3547 -0.9807 -0.1815 -0.0723 0.0017 0.3620 -0.9322 -32.570 114.054 99.211 B 170 SER A 77 SER~? B 239 VAL A 75 VAL~? B 413 ASN A 78 ASN~? ULMNm 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.44 A TRANSFORM -0.1679 0.8877 0.4286 -0.9857 -0.1574 -0.0602 -0.0140 0.4326 -0.9015 -37.826 106.902 108.779 F 51 ALA A 235 ALA~? F 148 HIS A 271 HIS^? F 163 ASP A 264 ASP^? ULMNm 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.44 A TRANSFORM -0.2050 0.8934 0.3998 0.9788 0.1858 0.0867 -0.0032 -0.4090 0.9125 -30.575 -110.315 -170.981 E 51 ALA A 235 ALA~? E 148 HIS A 271 HIS^? E 163 ASP A 264 ASP^? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 RMSD = 1.44 A TRANSFORM -0.4858 -0.7726 -0.4088 0.8088 -0.5746 0.1249 0.3314 0.2700 -0.9040 103.027 -95.574 176.781 A 14 ASP A 264 ASP^? A 16 HIS A 271 HIS^? A 67 GLY A 262 GLY^? ULMNm 3 3nwu_o02 SERINE PROTEASE HTRA1 user 3 3 RMSD = 1.45 A TRANSFORM -0.9347 -0.3554 -0.0077 -0.3524 0.9292 -0.1114 -0.0468 0.1014 0.9937 26.597 84.020 -175.382 C 220 HIS A 271 HIS^? C 250 ASP A 264 ASP^? C 328 SER A 242 SER~? ULMNm 3 1gdo_c02 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.45 A TRANSFORM -0.4872 -0.3014 0.8196 -0.8695 0.2550 -0.4230 0.0815 0.9187 0.3863 -56.760 106.743 -20.285 A 1 CYH A 167 CYH.? A 98 ASN A 166 ASN.? A 99 GLY A 27 GLY~? ULMNm 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.45 A TRANSFORM -0.8367 0.5043 -0.2136 0.0077 -0.3791 -0.9253 0.5476 0.7759 -0.3133 98.228 175.714 -10.343 B 757 ASP A 196 ASP~? B 759 HIS A 195 HIS~? B 810 SER A 192 SER.? ULMNm 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.45 A TRANSFORM -0.1549 0.1805 0.9713 -0.3656 -0.9238 0.1134 -0.9178 0.3376 -0.2091 -79.156 23.634 36.136 B 250 ALA A 151 ALA~? B 251 GLY A 150 GLY~? B 252 ASP A 152 ASP~? ULMNm 3 1oqz_c01 GLUTARYL ACYLASE user 2 3 RMSD = 1.45 A TRANSFORM -0.3265 0.9156 0.2346 0.8017 0.3997 -0.4444 0.5006 -0.0430 0.8646 -5.682 -40.478 -146.590 B 170 SER A 73 SER.? B 239 VAL A 75 VAL~? B 413 ASN A 78 ASN~? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 RMSD = 1.45 A TRANSFORM -0.4094 -0.7009 -0.5841 -0.8048 0.5790 -0.1306 -0.4297 -0.4166 0.8011 120.447 127.278 10.352 C 14 ASP A 264 ASP^? C 16 HIS A 271 HIS^? C 67 GLY A 262 GLY^? ULMNm 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.45 A TRANSFORM -0.8137 -0.3705 -0.4478 0.5710 -0.6538 -0.4965 0.1088 0.6598 -0.7436 122.960 -0.737 146.841 D 51 ALA A 235 ALA~? D 148 HIS A 271 HIS^? D 163 ASP A 264 ASP^? ULMNm 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 RMSD = 1.45 A TRANSFORM -0.9777 -0.0848 -0.1921 -0.1628 0.8840 0.4382 -0.1326 -0.4597 0.8781 110.050 -25.796 -85.527 A 51 ALA A 235 ALA~? A 148 HIS A 271 HIS^? A 163 ASP A 264 ASP^? ULMNm 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 RMSD = 1.45 A TRANSFORM 0.3306 -0.9183 -0.2179 0.8155 0.3941 -0.4239 -0.4751 0.0376 -0.8791 108.838 -9.695 201.029 A 170 SER A 73 SER.? A 239 VAL A 75 VAL~? A 413 ASN A 78 ASN~? ULMNm 3 1qrz_c12 PLASMINOGEN user 1 3 RMSD = 1.45 A TRANSFORM 0.5856 -0.4788 0.6541 0.3354 0.8777 0.3422 0.7379 -0.0190 -0.6746 -119.305 -78.055 42.682 A 603 HIS A 147 HIS.? A 646 ASP A 152 ASP~? A 741 SER A 145 SER.? ULMNm 3 1gdo_c00 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM 0.4513 0.3180 -0.8338 0.8879 -0.2536 0.3839 0.0893 0.9135 0.3968 131.393 -57.124 20.992 B 1 CYH A 167 CYH.? B 98 ASN A 166 ASN.? B 99 GLY A 27 GLY~? ULMNm 3 1ig8_c00 HEXOKINASE PII user 4 3 RMSD = 1.46 A TRANSFORM -0.4852 0.8110 0.3267 -0.5963 -0.5802 0.5548 -0.6395 -0.0744 -0.7651 23.694 41.607 157.926 A 158 SER A 274 SER^? A 173 ARG A 261 ARG^? A 211 ASP A 273 ASP^? ULMNm 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 RMSD = 1.46 A TRANSFORM 0.6061 0.7764 0.1729 0.2599 0.0121 -0.9655 0.7517 -0.6301 0.1945 -64.073 64.190 -64.443 A 250 ALA A 151 ALA~? A 251 GLY A 150 GLY~? A 252 ASP A 152 ASP~? ULMNm 3 1gdo_c03 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM 0.4947 0.2913 -0.8188 0.8640 -0.2664 0.4272 0.0937 0.9188 0.3835 91.461 -99.983 22.260 C 1 CYH A 167 CYH.? C 98 ASN A 166 ASN.? C 99 GLY A 27 GLY~? ULMNm 3 1gdo_c01 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 3 RMSD = 1.46 A TRANSFORM -0.4613 -0.3164 0.8289 -0.8828 0.2570 -0.3932 0.0886 0.9131 0.3979 -24.526 147.180 -22.120 D 1 CYH A 167 CYH.? D 98 ASN A 166 ASN.? D 99 GLY A 27 GLY~? ULMNm 3 1ddj_c15 PLASMINOGEN user 7 3 RMSD = 1.47 A TRANSFORM -0.9111 0.3712 -0.1791 0.3268 0.3859 -0.8627 0.2511 0.8445 0.4729 72.138 128.286 -41.168 D 603 HIS A 271 HIS^? D 646 ASP A 264 ASP^? D 739 GLY A 203 GLY~? ULMNm 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 RMSD = 1.47 A TRANSFORM -0.1582 -0.8158 0.5563 0.4113 0.4577 0.7882 0.8976 -0.3535 -0.2632 -17.967 -73.351 -20.771 A 757 ASP A 196 ASP~? A 759 HIS A 195 HIS~? A 810 SER A 192 SER.? ULMNm 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 RMSD = 1.47 A TRANSFORM 0.4412 0.8564 0.2682 -0.0663 0.3291 -0.9420 0.8950 -0.3978 -0.2019 -43.207 123.926 -35.274 A 67 ASP A 91 ASP.? A 68 ALA A 92 ALA.? A 72 LEU A 87 LEU~? ULMNm 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 RMSD = 1.48 A TRANSFORM 0.9381 0.1085 0.3288 -0.2405 -0.4790 0.8442 -0.2491 0.8711 0.4232 -110.401 -67.235 34.457 A 241 ASP A 267 ASP^? A 265 GLU A 236 GLU~? A 369 ASP A 246 ASP.? ULMNm 3 1be1_c02 GLUTAMATE MUTASE user 2 3 RMSD = 1.49 A TRANSFORM -0.3741 -0.1781 -0.9101 0.6307 0.6706 -0.3905 -0.6799 0.7201 0.1385 140.741 -29.974 10.653 14 ASP A 103 ASP~? 16 HIS A 35 HIS~? 67 GLY A 150 GLY~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 RMSD = 1.49 A TRANSFORM 0.0909 0.4105 0.9073 0.3464 -0.8672 0.3577 -0.9337 -0.2818 0.2210 -132.605 -70.246 42.597 141 ASP A 267 ASP^? 166 GLY A 262 GLY^? 169 GLU A 255 GLU^? ULMNm 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.49 A TRANSFORM 0.6830 0.5022 -0.5304 0.4347 0.3041 0.8477 -0.5870 0.8095 0.0106 56.682 -120.092 42.720 A 46 ASP A 225 ASP^? A 100 ARG A 223 ARG^? A 116 GLN A 215 GLN^? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.49 A TRANSFORM -0.6063 -0.5274 0.5952 -0.0970 -0.6938 -0.7136 -0.7893 0.4904 -0.3695 -5.650 148.477 113.194 B 46 ASP A 225 ASP^? B 100 ARG A 223 ARG^? B 116 GLN A 215 GLN^?