./dpa1.pdb OpenBabel11132113523D 39 39 0 0 1 0 0 0 0 0999 V2000 -2.7470 1.6040 0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 0.6910 -0.4500 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7240 0.8360 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.1970 0.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 0.9160 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 0.5550 -1.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 0.6240 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 1.9240 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 2.0750 -1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.5100 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.8900 -2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -2.1980 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -2.9470 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -3.5320 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -4.2820 -2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -4.5760 -2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 2.9660 -2.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 4.3690 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 5.0110 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 6.1610 -0.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 4.2520 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 1.5400 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 1.3960 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -0.3280 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 0.2450 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 0.7260 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 1.9390 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 0.3790 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -0.4410 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -1.4180 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.7360 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -3.7550 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -5.0810 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -5.5990 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 2.7760 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 4.9170 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 4.4670 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 4.6280 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 3.3100 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 24 1 1 0 0 0 3 4 2 0 0 0 0 3 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 13 15 2 0 0 0 0 13 31 1 0 0 0 0 14 16 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END > 4 COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006 888 888 WRITTEN BY MAESTRO (A PRODUCT OF SCHRODINGER, LLC) > dpa1_f > <MODEL> 1 $$$$