# Name: 1fbf # Creating user name: metzjt # Creation time: Mon Jul 7 10:34:45 2003 # Modifying user name: metzjt # Modification time: Mon Jul 7 10:36:39 2003 @MOLECULE 1fbf 29 29 1 0 4 PROTEIN GAST_HUCK @DICT PROTEIN PROTEIN @ATOM 1 H1 38.6607 91.1700 24.2405 H 1 AHM336 0.0638 2 H2 38.9845 91.1543 26.0073 H 1 AHM336 0.0638 3 H3 37.1885 88.9820 25.1673 H 1 AHM336 0.0650 4 H4 36.3496 91.8738 24.5855 H 1 AHM336 0.0647 5 H5 35.3685 90.7525 22.8571 H 1 AHM336 0.2100 6 H6 34.4387 89.5967 25.2514 H 1 AHM336 0.0647 7 H7 33.1938 91.3324 26.0746 H 1 AHM336 0.2100 8 H8 35.3362 91.4131 27.4848 H 1 AHM336 0.0650 9 H9 35.7655 88.7231 28.1664 H 1 AHM336 0.0638 10 H10 34.3047 88.7182 27.1211 H 1 AHM336 0.0638 11 P1 40.5860 89.0320 26.0930 P.3 1 AHM336 0.2052 12 O11 41.6690 90.0450 26.1660 O.co2 1 AHM336 -0.5354 13 O12 40.9380 87.6060 25.8000 O.co2 1 AHM336 -0.5354 14 O13 39.7860 89.1270 27.4700 O.co2 1 AHM336 -0.5354 15 O1 39.5070 89.4280 24.9830 O.3 1 AHM336 -0.3198 16 C1 38.6450 90.5530 25.1510 C.3 1 AHM336 0.0944 17 C2 37.2350 90.0550 25.4050 C.3 1 AHM336 0.1148 18 C3 36.1370 90.7960 24.6410 C.3 1 AHM336 0.1121 19 O3 36.0510 90.2910 23.3300 O.3 1 AHM336 -0.3865 20 C4 34.9100 90.5510 25.5290 C.3 1 AHM336 0.1121 21 O4 33.9090 91.5720 25.4970 O.3 1 AHM336 -0.3865 22 C5 35.5250 90.4700 26.9510 C.3 1 AHM336 0.1148 23 O5 36.9310 90.2880 26.7720 O.3 1 AHM336 -0.3627 24 C6 34.9520 89.3400 27.7570 C.3 1 AHM336 0.0944 25 O6 34.1880 89.9030 28.8220 O.3 1 AHM336 -0.3198 26 P2 32.7530 89.2710 29.2480 P.3 1 AHM336 0.2052 27 O21 32.8960 87.7560 29.2300 O.co2 1 AHM336 -0.5354 28 O22 31.7080 89.7600 28.2540 O.co2 1 AHM336 -0.5354 29 O23 32.5460 89.8660 30.6270 O.co2 1 AHM336 -0.5354 @BOND 1 16 1 1 2 16 2 1 3 17 3 1 4 18 4 1 5 19 5 1 6 20 6 1 7 21 7 1 8 22 8 1 9 24 9 1 10 24 10 1 11 11 12 2 12 11 13 1 13 11 14 1 14 15 11 1 15 16 15 1 16 17 16 1 17 17 18 1 18 23 17 1 19 18 19 1 20 20 18 1 21 20 21 1 22 22 20 1 23 22 23 1 24 22 24 1 25 24 25 1 26 25 26 1 27 26 27 2 28 26 28 1 29 26 29 1 @SUBSTRUCTURE 1 AHM336 11 GROUP 0 A **** 0 ROOT @SET UNK_ATOMS STATIC ATOMS AMSOM **** Atom types guessed for these atoms 128 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 \ 0 ATOM$BLUE STATIC ATOMS COLORGROUP SYSTEM 0 ATOM$BY_TYPE STATIC ATOMS COLORGROUP SYSTEM 6 0 0 0 0 12 0 LAB$A_TYPE STATIC ATOMS LABELGROUP SYSTEM 29 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 \ 20 21 22 23 24 25 26 27 28 29