0 0 2 R-GUANOSINE - with terminal diphosphate GDP.db94 GDP INT 1 CORRECT OMIT DU BEG 0.0 1 DUMM DU M 0 0 0 0.000 0.000 0.000 0.000 2 DUMM DU M 1 0 0 1.000 0.000 0.000 0.000 3 DUMM DU M 2 1 0 1.000 90.000 0.000 0.000 4 O1B O3 M 3 2 1 1.000 90.000 180.000 -0.9552 5 PB P M 4 3 2 1.434 90.000 180.000 1.3672 6 O2B O3 E 5 4 3 1.574 107.490 -79.441 -0.9552 7 O3B O3 E 5 4 3 1.518 118.007 165.990 -0.9552 8 O3A OS M 5 4 3 1.599 113.374 180.000 -0.6346 9 PA P M 6 5 4 1.646 130.619 36.624 1.4929 10 O1A O2 E 7 6 5 1.504 109.212 -90.234 -0.9474 11 O2A O2 E 7 6 5 1.526 108.570 40.323 -0.9474 12 O5* OS M 7 6 5 1.585 97.173 157.726 -0.6579 13 C5* CT M 8 7 6 1.445 122.292 -66.317 0.0558 14 H50 H1 E 9 8 7 1.059 109.484 27.531 0.0679 15 H51 H1 E 9 8 7 1.059 109.437 -92.456 0.0679 16 C4* CT M 9 8 7 1.52 110.00 180.00 0.1065 17 H40 H1 E 16 9 8 1.09 109.50 -200.00 0.1174 18 O4* OS S 16 13 9 1.46 108.86 -86.31 -0.3548 19 C1* CT B 18 16 13 1.42 110.04 105.60 0.0191 20 H10 H2 E 19 18 16 1.09 109.50 -240.00 0.2006 21 N9 N* S 19 18 16 1.49 108.06 -127.70 0.0492 22 C8 CK B 21 19 18 1.38 129.20 81.59 0.1374 23 H80 H5 E 22 21 19 1.08 120.00 0.00 0.1640 24 N7 NB S 22 21 19 1.31 114.00 -179.90 -0.5709 25 C5 CB S 24 22 21 1.39 103.90 0.00 0.1744 26 C6 C B 25 24 22 1.42 130.40 180.00 0.4770 27 O6 O E 26 25 24 1.23 128.80 0.00 -0.5597 28 N1 NA B 26 25 24 1.40 111.38 180.00 -0.4787 29 H1N H E 28 26 25 1.00 117.36 179.90 0.3424 30 C2 CA B 28 26 25 1.38 125.24 -0.10 0.7657 31 N2 N2 B 30 28 26 1.34 116.02 180.00 -0.9672 32 H21 H E 31 30 28 1.01 127.00 -0.82 0.4364 33 H22 H E 31 30 28 1.01 116.53 -179.44 0.4364 34 N3 NC S 30 28 26 1.33 123.30 0.00 -0.6323 35 C4 CB E 34 30 28 1.36 112.20 0.00 0.1222 36 C3* CT M 16 13 12 1.53 115.78 -329.11 0.2022 37 H30 H1 E 36 16 13 1.09 109.50 30.00 0.0615 38 C2* CT B 36 16 13 1.53 102.80 -86.30 0.0670 39 H20 H1 E 38 36 16 1.09 109.50 120.00 0.0972 40 O2* OH S 38 36 16 1.43 109.50 240.00 -0.6139 41 H2* HO E 40 38 36 0.96 107.00 180.00 0.4186 42 O3* OH M 36 16 13 1.42 116.52 -203.47 -0.6541 43 H3* HO M 42 36 16 0.96 114.97 180.00 0.4376 IMPROPER C8 C4 N9 C1* C5 N1 C6 O6 C6 C2 N1 H1N C2 H21 N2 H22 N7 N9 C8 H80 N1 N3 C2 N2 LOOP CLOSING EXPLICIT C1* C2* C4 C5 C4 N9 DONE STOP