*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.86 A TRANSFORM 0.5073 0.1947 0.8395 -0.5176 0.8477 0.1162 -0.6890 -0.4935 0.5308 -2.237 -112.218 -105.743 A 183 GLY A 47 GLY.? B 419 GLY A 60 GLY^? B 420 ALA A 14 ALA^? ULMNm 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.86 A TRANSFORM -0.5243 0.2827 0.8032 0.5086 -0.6525 0.5617 0.6829 0.7030 0.1983 -8.112 -50.365 -150.534 A 183 GLY B 47 GLY.? B 419 GLY B 60 GLY^? B 420 ALA B 14 ALA^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 RMSD = 0.92 A TRANSFORM -0.3787 0.8507 0.3644 0.6495 -0.0362 0.7595 0.6593 0.5243 -0.5388 -11.389 -117.471 -154.728 A 420 ALA A 14 ALA^? B 182 GLY A 46 GLY~? B 183 GLY A 47 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 RMSD = 0.93 A TRANSFORM 0.3400 -0.5050 0.7933 -0.6777 0.4532 0.5790 -0.6519 -0.7346 -0.1881 43.295 -139.352 -107.291 A 420 ALA B 14 ALA^? B 182 GLY B 46 GLY~? B 183 GLY B 47 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 RMSD = 0.98 A TRANSFORM -0.1969 0.8054 0.5590 0.9444 0.0028 0.3287 0.2632 0.5927 -0.7612 -13.389 -115.728 -152.371 A 420 ALA A 15 ALA^? B 182 GLY A 46 GLY~? B 183 GLY A 47 GLY.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 RMSD = 0.99 A TRANSFORM 0.5148 0.7280 -0.4528 0.6681 -0.6717 -0.3202 -0.5372 -0.1376 -0.8321 9.979 63.524 34.852 A 229 ALA A 14 ALA^? A 257 ALA A 15 ALA^? A 328 ASP A 110 ASP.? ULMNm 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 RMSD = 0.99 A TRANSFORM -0.5022 -0.8642 -0.0304 -0.6407 0.3954 -0.6582 0.5808 -0.3111 -0.7523 71.973 18.954 44.105 A 229 ALA B 14 ALA^? A 257 ALA B 15 ALA^? A 328 ASP B 110 ASP.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 8 3 RMSD = 0.99 A TRANSFORM 0.1843 -0.3831 0.9051 -0.9435 0.1892 0.2721 -0.2755 -0.9041 -0.3266 34.608 -127.337 -94.152 A 420 ALA B 15 ALA^? B 182 GLY B 46 GLY~? B 183 GLY B 47 GLY.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 RMSD = 1.01 A TRANSFORM -0.4934 0.4348 0.7533 0.6988 -0.3176 0.6410 0.5179 0.8427 -0.1471 35.800 26.750 -9.337 199 ASP A 81 ASP~? 218 GLU B 35 GLU^? 329 ASP A 96 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 8 3 RMSD = 1.02 A TRANSFORM -0.0467 -0.8169 0.5748 -0.1510 -0.5631 -0.8125 0.9874 -0.1247 -0.0970 20.353 40.135 5.772 141 ASP A 97 ASP^? 166 GLY B 7 GLY^? 169 GLU A 56 GLU^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 15 3 RMSD = 1.06 A TRANSFORM 0.0433 0.9976 0.0537 0.1824 0.0450 -0.9822 -0.9823 0.0523 -0.1800 -51.989 16.817 -5.651 141 ASP B 97 ASP^? 166 GLY A 7 GLY^? 169 GLU B 56 GLU^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 RMSD = 1.09 A TRANSFORM 0.3700 -0.9222 0.1127 -0.7304 -0.2138 0.6487 -0.5741 -0.3223 -0.7526 73.601 -88.382 -97.371 A 420 ALA A 25 ALA~? B 182 GLY A 32 GLY.? B 183 GLY A 28 GLY~? ULMNm 3 1qrz_c20 PLASMINOGEN user 3 3 RMSD = 1.11 A TRANSFORM 0.7072 -0.5021 -0.4978 0.5577 -0.0366 0.8292 -0.4346 -0.8640 0.2542 6.776 -12.669 63.553 A 603 HIS A 72 HIS.? A 646 ASP A 110 ASP.? A 739 GLY B 7 GLY^? ULMNm 3 1bol_c00 RIBONUCLEASE RH user 2 3 RMSD = 1.11 A TRANSFORM 0.2026 -0.9213 0.3318 -0.7651 -0.3604 -0.5336 0.6113 -0.1457 -0.7779 69.054 53.471 16.673 A 46 HIS A 72 HIS.? A 105 GLU A 117 GLU^? A 109 HIS B 10 HIS^? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 2 3 RMSD = 1.13 A TRANSFORM -0.8135 0.5761 -0.0799 0.3619 0.6089 0.7059 0.4553 0.5453 -0.7038 -24.787 34.022 22.877 A 104 ILE A 104 ILE^? A 106 HIS A 98 HIS.? A 142 ASP A 96 ASP^? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 RMSD = 1.13 A TRANSFORM -0.6827 -0.7152 -0.1498 -0.0800 0.2770 -0.9575 0.7263 -0.6417 -0.2463 44.141 34.214 123.882 C 14 ASP A 9 ASP^? C 16 HIS A 10 HIS^? C 67 GLY A 7 GLY^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 12 3 RMSD = 1.13 A TRANSFORM -0.3565 0.8422 -0.4044 0.7257 0.5223 0.4479 0.5885 -0.1338 -0.7974 1.920 -114.508 -102.190 A 420 ALA B 25 ALA~? B 182 GLY B 32 GLY.? B 183 GLY B 28 GLY~? ULMNm 3 2dbt_c00 CHITINASE C user 12 3 RMSD = 1.14 A TRANSFORM 0.6409 0.4009 0.6546 -0.4798 -0.4564 0.7493 0.5991 -0.7944 -0.1002 59.019 34.809 57.586 A 147 GLU B 120 GLU^? A 156 GLU B 82 GLU~? A 194 ASN A 3 ASN.? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 RMSD = 1.15 A TRANSFORM -0.5164 -0.8326 -0.2003 0.0878 -0.2841 0.9548 -0.8518 0.4754 0.2198 51.759 -2.610 49.763 A 14 ASP A 9 ASP^? A 16 HIS A 10 HIS^? A 67 GLY A 7 GLY^? ULMNm 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 RMSD = 1.15 A TRANSFORM 0.6909 0.5245 -0.4976 0.0494 -0.7209 -0.6913 -0.7213 0.4530 -0.5240 -2.303 74.707 76.667 C 14 ASP B 9 ASP^? C 16 HIS B 10 HIS^? C 67 GLY B 7 GLY^? ULMNm 3 1qrz_c20 PLASMINOGEN user 8 3 RMSD = 1.16 A TRANSFORM -0.7072 0.1926 -0.6803 -0.5408 0.4724 0.6959 0.4554 0.8601 -0.2299 -24.403 -35.435 -3.233 A 603 HIS B 72 HIS^? A 646 ASP B 110 ASP.? A 739 GLY A 7 GLY^? ULMNm 3 2dbt_c01 CHITINASE C user 11 3 RMSD = 1.16 A TRANSFORM -0.8269 -0.0810 -0.5565 -0.5241 -0.2475 0.8149 -0.2038 0.9655 0.1622 41.662 70.443 -37.061 B 147 GLU B 120 GLU^? B 156 GLU B 82 GLU~? B 194 ASN A 3 ASN.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 RMSD = 1.17 A TRANSFORM 0.5188 0.0582 0.8529 -0.6828 0.6285 0.3724 -0.5144 -0.7756 0.3658 53.004 -15.043 51.961 199 ASP B 81 ASP~? 218 GLU A 35 GLU^? 329 ASP B 96 ASP^? ULMNm 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 RMSD = 1.17 A TRANSFORM 0.5254 0.6056 -0.5977 -0.0573 0.7260 0.6853 0.8489 -0.3257 0.4162 -3.408 -43.631 85.810 A 14 ASP B 9 ASP^? A 16 HIS B 10 HIS^? A 67 GLY B 7 GLY^? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 5 3 RMSD = 1.17 A TRANSFORM 0.8026 -0.5294 0.2749 -0.3909 -0.1187 0.9127 -0.4506 -0.8400 -0.3022 22.763 60.673 76.172 A 104 ILE B 104 ILE^? A 106 HIS B 98 HIS.? A 142 ASP B 96 ASP^? ULMNm 3 2dbt_c01 CHITINASE C user 4 3 RMSD = 1.17 A TRANSFORM 0.8355 -0.2877 -0.4681 0.5291 0.6511 0.5442 0.1482 -0.7023 0.6963 52.421 36.985 31.036 B 147 GLU A 120 GLU^? B 156 GLU A 82 GLU~? B 194 ASN B 3 ASN.? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 RMSD = 1.18 A TRANSFORM -0.0517 -0.8939 0.4454 0.7489 0.2603 0.6094 -0.6607 0.3650 0.6559 25.441 -15.207 -7.837 141 ASP A 81 ASP~? 166 GLY A 32 GLY.? 169 GLU A 34 GLU^? ULMNm 3 2dbt_c02 CHITINASE C user 12 3 RMSD = 1.19 A TRANSFORM -0.3651 -0.6962 -0.6180 0.6667 0.2678 -0.6956 0.6498 -0.6660 0.3664 75.173 22.449 55.608 C 147 GLU B 120 GLU^? C 156 GLU B 82 GLU~? C 194 ASN A 3 ASN.? ULMNm 3 1bol_c00 RIBONUCLEASE RH user 4 3 RMSD = 1.20 A TRANSFORM -0.1830 0.9682 -0.1705 0.7387 0.0210 -0.6737 -0.6487 -0.2492 -0.7191 -7.750 41.975 17.294 A 46 HIS B 72 HIS^? A 105 GLU B 117 GLU^? A 109 HIS A 10 HIS^? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.21 A TRANSFORM -0.9273 -0.2158 -0.3059 0.3291 -0.0805 -0.9408 0.1785 -0.9731 0.1457 28.403 9.034 50.223 274 HIS A 58 HIS^? 320 HIS B 72 HIS^? 375 ASP A 9 ASP^? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 1 3 RMSD = 1.21 A TRANSFORM -0.5920 0.0849 0.8014 0.1454 -0.9668 0.2099 0.7927 0.2408 0.5600 19.394 83.506 49.379 A 223 HIS A 58 HIS^? A 262 HIS B 72 HIS^? A 312 ASP A 9 ASP^? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 1 3 RMSD = 1.24 A TRANSFORM 0.0195 -0.0625 0.9979 -0.2533 0.9652 0.0654 -0.9672 -0.2541 0.0030 17.631 -20.009 107.550 B 223 HIS A 58 HIS^? B 262 HIS B 72 HIS^? B 312 ASP A 9 ASP^? ULMNm 3 1al6_c00 CITRATE SYNTHASE user 3 3 RMSD = 1.24 A TRANSFORM 0.9125 0.0151 -0.4088 -0.3681 -0.4058 -0.8366 -0.1785 0.9138 -0.3648 23.805 20.487 -26.233 274 HIS B 58 HIS^? 320 HIS A 72 HIS.? 375 ASP B 9 ASP^? ULMNm 3 1aj8_c00 CITRATE SYNTHASE user 3 3 RMSD = 1.24 A TRANSFORM 0.6251 0.3268 0.7089 -0.1431 0.9407 -0.3075 -0.7673 0.0907 0.6348 12.606 6.379 51.391 A 223 HIS B 58 HIS^? A 262 HIS A 72 HIS.? A 312 ASP B 9 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 10 3 RMSD = 1.25 A TRANSFORM -0.4902 -0.1040 0.8654 -0.7359 -0.4826 -0.4749 0.4670 -0.8696 0.1601 17.383 -85.662 -96.028 A 420 ALA B 23 ALA~? B 182 GLY B 46 GLY~? B 183 GLY B 47 GLY.? ULMNm 3 1aj8_c01 CITRATE SYNTHASE user 3 3 RMSD = 1.26 A TRANSFORM 0.0210 0.5631 0.8261 0.2621 -0.8005 0.5390 0.9648 0.2052 -0.1645 -7.590 51.953 93.985 B 223 HIS B 58 HIS^? B 262 HIS A 72 HIS.? B 312 ASP B 9 ASP^? ULMNm 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 RMSD = 1.27 A TRANSFORM -0.9227 -0.3540 -0.1525 0.3221 -0.9255 0.1994 -0.2117 0.1349 0.9680 31.113 37.473 -5.980 A 105 HIS A 98 HIS.? C 62 LYS A 122 LYS.? F 35 ASP A 97 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 RMSD = 1.27 A TRANSFORM 0.4849 0.5711 0.6624 0.7397 0.1364 -0.6590 -0.4667 0.8095 -0.3563 -7.276 -106.601 -164.499 A 420 ALA A 23 ALA~? B 182 GLY A 46 GLY~? B 183 GLY A 47 GLY.? ULMNm 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 RMSD = 1.30 A TRANSFORM 0.2710 0.2198 0.9371 0.1082 0.9605 -0.2565 -0.9565 0.1710 0.2365 38.552 -18.716 -11.604 199 ASP B 81 ASP~? 218 GLU B 62 GLU.? 329 ASP B 96 ASP^? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 RMSD = 1.31 A TRANSFORM -0.7223 -0.5557 0.4117 0.2959 0.2898 0.9102 -0.6251 0.7793 -0.0449 69.205 -134.911 -165.486 A 420 ALA A 23 ALA~? B 182 GLY A 60 GLY^? B 183 GLY A 47 GLY.? ULMNm 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 11 3 RMSD = 1.33 A TRANSFORM 0.7174 0.6954 0.0429 -0.3079 0.2612 0.9149 0.6250 -0.6695 0.4014 22.916 -134.997 -105.322 A 420 ALA B 23 ALA~? B 182 GLY B 60 GLY^? B 183 GLY B 47 GLY.? ULMNm 3 1kim_c00 THYMIDINE KINASE user 3 3 RMSD = 1.34 A TRANSFORM 0.8058 0.1822 -0.5635 -0.5912 0.3035 -0.7472 0.0349 0.9353 0.3522 53.186 70.091 -5.048 A 83 GLU B 117 GLU^? A 163 ARG B 115 ARG^? A 222 ARG B 105 ARG^? ULMNm 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 4 3 RMSD = 1.35 A TRANSFORM 0.0501 -0.1952 -0.9795 0.9891 -0.1266 0.0758 -0.1388 -0.9726 0.1867 113.138 29.357 25.340 A 199 HIS B 10 HIS^? A 246 HIS A 72 HIS.? A 255 TYR A 107 TYR^? ULMNm 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 4 3 RMSD = 1.35 A TRANSFORM 0.4056 0.2126 0.8890 0.9004 0.0746 -0.4287 -0.1574 0.9743 -0.1612 37.247 37.205 -39.360 B 199 HIS B 10 HIS^? B 246 HIS A 72 HIS.? B 255 TYR A 107 TYR^? ULMNm 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 1 3 RMSD = 1.35 A TRANSFORM -0.3898 0.3050 0.8689 -0.8924 -0.3579 -0.2748 0.2271 -0.8825 0.4117 31.642 50.698 34.843 B 199 HIS A 10 HIS^? B 246 HIS B 72 HIS^? B 255 TYR B 107 TYR^? ULMNm 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 1 3 RMSD = 1.36 A TRANSFORM -0.0635 -0.3982 -0.9151 -0.9957 0.0871 0.0312 0.0673 0.9132 -0.4020 121.251 16.762 -48.779 A 199 HIS A 10 HIS^? A 246 HIS B 72 HIS^? A 255 TYR B 107 TYR^? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 5 3 RMSD = 1.36 A TRANSFORM 0.5674 -0.5111 -0.6456 -0.6976 -0.7150 -0.0471 -0.4375 0.4771 -0.7622 51.371 95.799 33.213 A 228 ASP A 96 ASP^? A 260 ASP A 102 ASP.? A 329 ASP A 81 ASP~? ULMNm 3 1qrz_c23 PLASMINOGEN user 6 3 RMSD = 1.36 A TRANSFORM -0.6177 0.7237 0.3079 -0.1203 -0.4738 0.8724 0.7772 0.5018 0.3797 -97.663 2.817 17.995 D 603 HIS B 72 HIS^? D 646 ASP B 97 ASP^? D 739 GLY B 113 GLY.? ULMNm 3 1pyl_c01 RIBONUCLEASE user 3 3 RMSD = 1.37 A TRANSFORM -0.6854 0.6971 0.2104 -0.5037 -0.2452 -0.8283 -0.5259 -0.6737 0.5192 -10.681 13.846 38.482 B 56 GLU B 117 GLU^? B 67 ARG B 100 ARG.? B 86 HIS A 58 HIS^? ULMNm 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 4 3 RMSD = 1.37 A TRANSFORM -0.0480 0.1239 0.9911 -0.9803 -0.1963 -0.0229 0.1917 -0.9727 0.1309 31.580 9.431 31.355 D 199 HIS B 10 HIS^? D 246 HIS A 72 HIS.? D 255 TYR A 107 TYR^? ULMNm 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 1 3 RMSD = 1.38 A TRANSFORM 0.0562 0.4614 0.8854 0.9639 0.2060 -0.1686 -0.2602 0.8629 -0.4332 18.143 -2.405 -42.168 D 199 HIS A 10 HIS^? D 246 HIS B 72 HIS^? D 255 TYR B 107 TYR^? ULMNm 3 1qrz_c20 PLASMINOGEN user 7 3 RMSD = 1.38 A TRANSFORM -0.9349 -0.2662 -0.2349 0.1117 0.4074 -0.9064 0.3370 -0.8736 -0.3512 -7.168 -4.793 86.689 A 603 HIS B 72 HIS^? A 646 ASP B 97 ASP^? A 739 GLY B 113 GLY.? ULMNm 3 1f80_c04 ACYL CARRIER PROTEIN user 2 3 RMSD = 1.38 A TRANSFORM 0.1183 0.9422 -0.3135 -0.8749 -0.0504 -0.4816 -0.4696 0.3313 0.8184 20.054 35.747 -4.925 B 62 LYS A 122 LYS.? C 105 HIS A 98 HIS.? D 35 ASP A 97 ASP^? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 RMSD = 1.38 A TRANSFORM -0.9023 0.1034 0.4185 -0.2606 0.6424 -0.7207 -0.3434 -0.7593 -0.5527 -28.037 38.457 66.496 A 104 ILE A 8 ILE^? A 106 HIS A 10 HIS^? A 142 ASP A 9 ASP^? ULMNm 3 1pyl_c01 RIBONUCLEASE user 1 3 RMSD = 1.39 A TRANSFORM 0.6949 -0.4846 0.5313 0.4762 -0.2435 -0.8450 0.5388 0.8402 0.0615 39.886 16.076 -19.177 B 56 GLU A 117 GLU^? B 67 ARG A 100 ARG.? B 86 HIS B 58 HIS^? ULMNm 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 1 3 RMSD = 1.39 A TRANSFORM 0.5264 -0.2130 0.8231 -0.5956 0.5985 0.5358 -0.6068 -0.7723 0.1882 34.479 -40.212 41.855 A 271 GLN A 12 GLN^? A 296 GLU A 62 GLU.? A 383 TYR B 107 TYR^? ULMNm 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 2 3 RMSD = 1.39 A TRANSFORM 0.2712 -0.1826 -0.9450 -0.9590 0.0320 -0.2814 0.0816 0.9827 -0.1665 111.335 25.132 -55.989 A 199 HIS A 58 HIS^? A 246 HIS B 72 HIS^? A 255 TYR B 107 TYR^? ULMNm 3 1vom_c00 MYOSIN user 3 3 RMSD = 1.40 A TRANSFORM -0.9028 -0.3886 -0.1839 -0.4287 0.7813 0.4536 -0.0326 0.4883 -0.8720 73.038 -7.717 -29.352 233 ASN B 114 ASN.? 457 GLY B 60 GLY^? 459 GLU B 62 GLU.? ULMNm 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 2 3 RMSD = 1.40 A TRANSFORM -0.6727 0.0789 0.7357 -0.7154 -0.3232 -0.6195 0.1889 -0.9430 0.2739 45.020 55.143 39.838 B 199 HIS A 58 HIS^? B 246 HIS B 72 HIS^? B 255 TYR B 107 TYR^? ULMNm 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 4 3 RMSD = 1.40 A TRANSFORM 0.9100 0.1196 0.3969 0.2469 -0.9255 -0.2872 0.3330 0.3594 -0.8718 -24.353 102.429 23.365 A 104 ILE B 8 ILE^? A 106 HIS B 10 HIS^? A 142 ASP B 9 ASP^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 12 3 RMSD = 1.40 A TRANSFORM -0.0399 0.9969 -0.0678 -0.7500 0.0149 0.6612 0.6602 0.0772 0.7471 -51.606 -8.774 6.499 141 ASP B 81 ASP~? 166 GLY B 32 GLY.? 169 GLU B 34 GLU^? ULMNm 3 2cpu_c01 ALPHA-AMYLASE user 2 3 RMSD = 1.40 A TRANSFORM 0.9715 0.2188 -0.0908 -0.2317 0.9577 -0.1710 0.0496 0.1872 0.9811 7.633 -14.673 32.604 A 197 ASP B 9 ASP^? A 233 GLU B 56 GLU^? A 300 ASN B 54 ASN.? ULMNm 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 2 3 RMSD = 1.40 A TRANSFORM -0.2764 0.2459 0.9291 0.9380 0.2796 0.2050 -0.2093 0.9281 -0.3079 27.867 -12.602 -47.162 D 199 HIS A 58 HIS^? D 246 HIS B 72 HIS^? D 255 TYR B 107 TYR^? ULMNm 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 1 3 RMSD = 1.41 A TRANSFORM 0.3434 -0.4166 -0.8417 0.9383 0.1146 0.3262 -0.0394 -0.9018 0.4303 115.987 -10.609 39.562 C 199 HIS A 10 HIS^? C 246 HIS B 72 HIS^? C 255 TYR B 107 TYR^? ULMNm 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 4 3 RMSD = 1.41 A TRANSFORM -0.3512 -0.1072 -0.9301 -0.9299 0.1558 0.3332 0.1092 0.9819 -0.1545 102.019 -16.027 -34.630 C 199 HIS B 10 HIS^? C 246 HIS A 72 HIS.? C 255 TYR A 107 TYR^? ULMNm 3 1qho_c07 ALPHA-AMYLASE user 7 3 RMSD = 1.43 A TRANSFORM 0.1411 -0.0877 0.9861 0.7771 -0.6074 -0.1652 0.6134 0.7896 -0.0176 34.462 119.774 -10.019 A 228 ASP B 81 ASP~? A 260 ASP B 102 ASP.? A 329 ASP B 96 ASP^? ULMNm 3 2cpu_c01 ALPHA-AMYLASE user 1 3 RMSD = 1.43 A TRANSFORM -0.9734 -0.2236 0.0507 0.2266 -0.9047 0.3608 -0.0348 0.3627 0.9313 20.535 60.829 25.362 A 197 ASP A 9 ASP^? A 233 GLU A 56 GLU^? A 300 ASN A 54 ASN.? ULMNm 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 RMSD = 1.44 A TRANSFORM -0.7819 -0.4923 0.3825 0.5660 -0.8177 0.1045 0.2613 0.2982 0.9180 17.680 58.699 -8.437 A 136 HIS A 98 HIS.? A 210 ASP A 97 ASP^? A 244 LYS A 84 LYS~? ULMNm 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 RMSD = 1.44 A TRANSFORM -0.5813 0.1544 0.7989 0.7921 -0.1172 0.5990 0.1861 0.9810 -0.0541 12.302 38.587 -14.584 B 46 ASP A 97 ASP^? B 100 ARG B 45 ARG~? B 116 GLN B 12 GLN^? ULMNm 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 5 3 RMSD = 1.45 A TRANSFORM -0.2914 -0.3808 -0.8776 0.9466 -0.2469 -0.2072 -0.1378 -0.8911 0.4324 117.558 39.930 17.418 A 199 HIS B 58 HIS^? A 246 HIS A 72 HIS.? A 255 TYR A 107 TYR^? ULMNm 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 6 3 RMSD = 1.45 A TRANSFORM 0.7793 0.6245 0.0520 -0.5566 0.7279 -0.4004 -0.2879 0.2831 0.9149 -23.240 -4.694 -10.207 A 136 HIS B 98 HIS.? A 210 ASP B 97 ASP^? A 244 LYS B 84 LYS~? ULMNm 3 1pyl_c00 RIBONUCLEASE user 1 3 RMSD = 1.46 A TRANSFORM -0.2948 0.1438 -0.9447 0.4575 -0.8467 -0.2717 -0.8389 -0.5123 0.1838 29.790 35.671 34.018 A 56 GLU A 117 GLU^? A 67 ARG A 100 ARG.? A 86 HIS B 58 HIS^? ULMNm 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 5 3 RMSD = 1.46 A TRANSFORM 0.6912 0.3201 0.6479 0.7108 -0.1390 -0.6895 -0.1306 0.9371 -0.3236 38.661 50.525 -34.869 B 199 HIS B 58 HIS^? B 246 HIS A 72 HIS.? B 255 TYR A 107 TYR^? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 14 3 RMSD = 1.46 A TRANSFORM 0.3371 0.7544 -0.5632 0.7123 0.1869 0.6766 0.6157 -0.6292 -0.4744 -28.233 -2.710 53.925 141 ASP B 96 ASP^? 166 GLY B 113 GLY.? 169 GLU B 22 GLU~? ULMNm 3 1pyl_c00 RIBONUCLEASE user 3 3 RMSD = 1.47 A TRANSFORM 0.2682 -0.6261 -0.7322 -0.4751 0.5752 -0.6659 0.8381 0.5265 -0.1431 61.975 -23.318 -3.252 A 56 GLU B 117 GLU^? A 67 ARG B 100 ARG.? A 86 HIS A 58 HIS^? ULMNm 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 5 3 RMSD = 1.47 A TRANSFORM 0.2929 0.3189 0.9014 -0.9441 -0.0528 0.3255 0.1514 -0.9463 0.2856 26.580 -3.275 27.417 D 199 HIS B 58 HIS^? D 246 HIS A 72 HIS.? D 255 TYR A 107 TYR^? ULMNm 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.47 A TRANSFORM -0.9506 0.3069 0.0475 0.1448 0.5732 -0.8065 -0.2747 -0.7597 -0.5893 56.393 84.023 171.510 D 141 GLY B 18 GLY.? D 144 GLU B 20 GLU~? D 164 GLU B 21 GLU~? ULMNm 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 RMSD = 1.47 A TRANSFORM -0.8599 -0.2471 0.4466 -0.4853 0.6670 -0.5653 -0.1582 -0.7028 -0.6935 34.508 -11.525 39.067 A 21 GLN B 6 GLN^? A 41 TYR B 4 TYR.? A 43 ASN B 3 ASN.? ULMNm 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 2 3 RMSD = 1.47 A TRANSFORM 0.6318 -0.1992 -0.7491 0.7721 0.0760 0.6310 -0.0687 -0.9770 0.2018 103.726 -14.250 46.898 C 199 HIS A 58 HIS^? C 246 HIS B 72 HIS^? C 255 TYR B 107 TYR^? ULMNm 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.48 A TRANSFORM 0.0593 -0.9934 -0.0977 0.4122 0.1135 -0.9040 0.9091 0.0133 0.4163 97.212 98.377 159.966 F 141 GLY B 18 GLY.? F 144 GLU B 20 GLU~? F 164 GLU B 21 GLU~? ULMNm 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 RMSD = 1.48 A TRANSFORM -0.8624 -0.1852 -0.4711 0.4411 -0.7316 -0.5199 -0.2484 -0.6561 0.7126 18.504 46.434 29.545 141 ASP A 9 ASP^? 166 GLY A 28 GLY~? 169 GLU A 21 GLU~? ULMNm 3 3s57_d00 OXIDOREDUCTASE/DNA user 4 3 RMSD = 1.48 A TRANSFORM 0.9134 -0.2588 0.3141 0.0939 0.8850 0.4561 -0.3961 -0.3871 0.8326 22.430 -43.935 23.368 A 101 VAL B 77 VAL^? A 102 PHE B 118 PHE^? A 169 CYH B 52 CYH^? ULMNm 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 RMSD = 1.48 A TRANSFORM -0.7283 -0.5067 0.4614 -0.6121 0.7837 -0.1055 -0.3081 -0.3593 -0.8809 14.967 37.043 69.522 B 136 HIS A 98 HIS.? B 210 ASP A 97 ASP^? B 244 LYS A 84 LYS~? ULMNm 3 1qrz_c23 PLASMINOGEN user 1 3 RMSD = 1.48 A TRANSFORM 0.5841 -0.4622 0.6672 0.1175 0.8615 0.4939 -0.8031 -0.2101 0.5575 -47.929 -50.023 43.657 D 603 HIS A 72 HIS.? D 646 ASP A 97 ASP^? D 739 GLY A 113 GLY.? ULMNm 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 RMSD = 1.48 A TRANSFORM 0.8817 -0.4423 -0.1643 -0.1231 -0.5517 0.8249 -0.4555 -0.7071 -0.5409 92.928 100.312 168.008 C 141 GLY B 18 GLY.? C 144 GLU B 20 GLU~? C 164 GLU B 21 GLU~? ULMNm 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 RMSD = 1.49 A TRANSFORM -0.4435 -0.1799 0.8780 0.1106 -0.9831 -0.1456 0.8894 0.0325 0.4559 33.449 86.438 86.932 D 107 ASP B 96 ASP^? D 246 ASP B 102 ASP.? D 275 HIS B 98 HIS.? ULMNm 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 5 3 RMSD = 1.49 A TRANSFORM 0.7239 0.6815 0.1073 0.6030 -0.7006 0.3815 0.3352 -0.2115 -0.9181 -29.099 98.229 66.241 B 136 HIS B 98 HIS.? B 210 ASP B 97 ASP^? B 244 LYS B 84 LYS~? ULMNm 3 1rgq_c01 NS4A PEPTIDE user 1 3 RMSD = 1.50 A TRANSFORM -0.8109 0.1899 -0.5535 -0.5605 -0.5235 0.6417 -0.1679 0.8306 0.5310 14.627 40.207 -66.319 B 60 HIS A 10 HIS^? B 84 ASP A 9 ASP^? B 140 GLY A 60 GLY^?