NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6047 8.2227 120.3146 53.4741 40.9216 175.2865 2 V 3.3803 8.3978 115.9851 66.1527 31.5599 177.7633 3 L 3.9346 8.3115 119.9940 57.8879 42.0233 178.6964 4 A 3.8279 9.2307 121.1835 54.9781 18.3917 179.8893 5 G 3.5280 8.0731 104.2511 47.9965 0.0000 175.7704 6 L 4.0870 7.9758 123.2932 57.6156 42.0326 178.6108 7 S 4.0240 8.8807 114.3249 61.6678 62.1300 176.3997 8 S 4.0179 8.2772 117.8267 61.8257 62.5336 177.0046 9 S 3.7965 7.5302 116.6034 61.5830 62.5735 176.0369 10 C 4.4165 8.8666 121.1101 59.4776 39.6764 175.7365 11 C 4.0211 8.1178 119.6722 61.9389 31.3320 175.2762 12 K 3.8808 7.9861 120.3874 58.7365 31.8244 176.6378 13 W 4.6972 9.5332 115.3648 59.0988 31.0958 176.2058 14 G 4.9796 7.1297 102.5187 43.4855 0.0000 172.2930 15 C 5.0531 7.9431 116.2564 54.6477 45.4319 174.9537 16 S 4.7351 9.3844 119.3844 56.9746 65.4164 175.4902 17 K 3.8493 8.5756 123.7640 59.8016 31.7856 178.7928 18 S 4.1321 8.0265 113.8617 61.7131 62.6925 176.2919 19 E 3.9891 8.0504 121.0258 58.7290 29.5701 179.0963 20 I 3.9003 7.9781 119.8668 64.6091 37.2600 178.7942 21 S 4.2378 8.7055 116.2198 61.3477 62.4068 176.2502 22 S 4.3922 7.7568 115.3278 59.7659 62.6311 175.2042 23 L 4.3936 7.6244 121.1395 55.1776 41.8807 176.2759 24 C 4.3223 7.9108 122.2017 59.7792 28.2981 173.4142 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 D 8.22 4.60 0.00 2.92 2.88 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 V 8.40 3.38 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 1.10 0.00 0.00 0.93 0.00 0.00 3 L 8.31 3.93 0.00 1.86 1.69 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 4 A 9.23 3.83 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.07 3.53 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 6 L 7.98 4.09 0.00 1.88 1.79 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.88 4.02 0.00 3.95 3.92 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 S 8.28 4.02 0.00 3.95 3.76 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 9 S 7.53 3.80 0.00 4.15 4.13 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 C 8.87 4.42 0.00 3.08 3.15 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 11 C 8.12 4.02 0.00 2.95 2.92 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 K 7.99 3.88 0.00 1.45 1.12 0.00 1.18 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.04 7.81 13 W 9.53 4.70 0.00 3.55 3.02 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 0.00 0.00 0.00 14 G 7.13 4.98 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 15 C 7.94 5.05 0.00 2.94 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 16 S 9.38 4.74 0.00 4.03 3.78 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 17 K 8.58 3.85 0.00 1.82 1.83 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.52 7.81 18 S 8.03 4.13 0.00 4.09 4.11 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 19 E 8.05 3.99 0.00 2.09 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 0.00 2.35 2.48 0.00 20 I 7.98 3.90 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 1.54 0.78 0.92 0.00 0.00 21 S 8.71 4.24 0.00 3.88 3.92 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 22 S 7.76 4.39 0.00 4.03 3.92 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 23 L 7.62 4.39 0.00 1.78 1.71 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 24 C 7.91 4.32 0.00 3.07 2.82 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