NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.4938 8.2127 109.7402 45.9501 0.0000 175.3685 2 I 3.5577 7.6422 121.2388 63.6126 37.9873 173.2961 3 V 3.6829 8.3935 120.7202 65.4749 31.6320 179.1464 4 E 4.3638 8.2347 118.6670 59.9404 29.2728 179.2857 5 Q 4.0432 7.4268 119.2067 58.9829 28.4666 180.2070 6 C 5.1922 8.1994 114.2899 56.3753 42.8221 174.7931 7 C 4.2938 8.0202 118.4438 61.9184 31.8433 174.6424 8 T 3.9692 8.0018 115.0554 66.1368 68.1840 174.4634 9 S 4.8106 7.3868 115.3001 55.7496 64.8932 173.5590 10 I 3.9141 8.0470 118.8509 61.2615 38.0307 173.4433 11 C 4.8033 8.2095 114.6806 54.7758 42.7773 172.4642 12 S 4.7939 8.2320 113.8799 56.1441 64.6037 174.5378 13 L 4.0860 8.0632 122.1180 57.6822 41.1240 179.2162 14 Y 4.3901 7.3849 117.7541 60.6362 37.8325 178.3552 15 Q 4.4871 7.8791 119.3443 57.7769 29.2815 177.3516 16 L 4.5998 7.9342 119.2173 56.7922 41.4850 178.4782 17 E 4.1334 8.1713 118.9844 58.9277 29.2144 178.5646 18 N 4.3018 7.8609 115.0781 55.2612 38.2020 175.7000 19 Y 4.6094 7.2410 115.7393 57.7152 38.4281 175.4894 20 C 4.4638 7.6372 118.4356 59.3270 29.0993 173.5535 21 N 4.5455 8.6249 119.1668 53.6639 38.2710 175.1941 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.21 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.64 3.56 0.70 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.81 0.65 0.00 0.00 3 V 8.39 3.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.93 0.00 0.00 4 E 8.23 4.36 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 5 Q 7.43 4.04 0.00 2.27 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 6 C 8.20 5.19 0.00 2.89 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.02 4.29 0.00 2.90 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.00 3.97 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.39 4.81 0.00 3.89 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.05 3.91 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.73 0.92 0.00 0.00 11 C 8.21 4.80 0.00 3.11 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.23 4.79 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.06 4.09 0.00 1.39 1.52 0.80 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.38 4.39 0.00 3.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.88 4.49 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 16 L 7.93 4.60 0.00 1.96 1.78 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.17 4.13 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 18 N 7.86 4.30 0.00 2.34 2.42 0.00 0.00 6.74 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.24 4.61 0.00 3.05 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.64 4.46 0.00 3.01 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.62 4.55 0.00 2.72 2.73 0.00 0.00 6.82 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00