0 0 2 This is a remark line molecule.res RA INT 0 CORRECT OMIT DU BEG 0.0000 1 DUMM DU M 0 -1 -2 0.000 .0 .0 .00000 2 DUMM DU M 1 0 -1 1.449 .0 .0 .00000 3 DUMM DU M 2 1 0 1.522 111.1 .0 .00000 4 O1P o M 3 2 1 1.540 111.208 180.000 -0.74741 5 P p4 M 4 3 2 1.480 104.921 -24.988 1.66754 6 O2P o E 5 4 3 1.481 117.228 121.704 -0.70439 7 O5* os M 5 4 3 1.600 105.493 -112.501 -0.53619 8 C5* c3 M 7 5 4 1.440 119.000 75.027 0.15518 9 H5*1 h1 E 8 7 5 1.090 109.467 60.055 0.06860 10 H5*2 h1 E 8 7 5 1.090 109.498 -59.942 0.05357 11 C4* c3 M 8 7 5 1.526 108.985 -176.117 0.09783 12 H4* h1 E 11 8 7 1.090 108.166 121.866 0.08512 13 C3* c3 3 11 8 7 1.533 111.315 4.005 -0.00639 14 H3* h1 E 13 11 8 1.089 111.061 84.255 0.09127 15 C2* c3 B 13 11 8 1.520 99.961 -156.865 0.41632 16 H2*1 h1 E 15 13 11 1.090 111.837 159.567 -0.02989 17 O2* o E 15 13 11 1.410 111.407 -74.781 -0.78528 18 O34 os E 13 11 8 1.514 112.107 -39.521 -0.40012 19 O4* os M 11 8 7 1.418 114.532 -118.872 -0.41921 20 C1* c3 M 19 11 8 1.411 106.477 128.670 0.11202 21 H1* h2 E 20 19 11 1.090 114.078 151.508 0.10726 22 N9 na M 20 19 11 1.457 104.033 -85.205 -0.26970 23 C8 cc M 22 20 19 1.356 124.898 77.677 0.63371 24 N7 nd M 23 22 20 1.303 115.204 176.828 -0.60245 25 C5 ca M 24 23 22 1.398 102.490 0.369 -0.19641 26 C6 ca M 25 24 23 1.405 132.700 -179.456 0.69334 27 N6 nh B 26 25 24 1.340 123.545 0.634 -0.93251 28 H61 hn E 27 26 25 1.009 119.911 179.146 0.40061 29 H62 hn E 27 26 25 1.010 119.997 0.237 0.42213 30 N1 nb M 26 25 24 1.341 117.536 -179.968 -0.79637 31 C2 ca M 30 26 25 1.325 119.497 -0.298 0.64228 32 H2 h5 E 31 30 26 1.080 115.499 179.976 0.03179 33 N3 nb M 31 30 26 1.324 129.122 -0.199 -0.71280 34 C4 ca M 33 31 30 1.352 110.057 0.381 0.46058 LOOP C1* C2* C8 O34 C4 N9 C4 C5 IMPROPER C1* C4 N9 C8 N9 N7 C8 O34 C6 C4 C5 N7 C5 N1 C6 N6 C6 H61 N6 H62 H2 N1 C2 N3 C5 N9 C4 N3 DONE STOP