NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9579 8.2127 109.7373 45.5343 0.0000 173.5261 2 I 3.3822 8.2906 117.7321 63.2249 37.5529 173.7334 3 V 3.4834 8.3263 119.9248 66.0921 31.7632 177.3405 4 E 3.8615 8.0065 117.7901 59.2123 29.3330 178.8280 5 Q 3.9309 8.2869 119.8407 59.6146 28.9757 177.7810 6 C 4.2062 7.9917 115.8823 59.7946 40.1963 175.2219 7 C 4.2443 7.4206 119.1147 61.8642 31.6009 175.1282 8 T 4.2234 8.1236 110.1983 61.0882 69.1383 175.5486 9 S 4.3535 8.4518 112.2674 57.4187 62.3386 175.4794 10 I 4.3975 8.6071 103.8935 60.4703 40.1314 172.7109 11 C 5.0531 8.3941 115.0167 53.3412 39.4057 173.7978 12 S 4.9329 8.7922 115.7881 56.8589 66.2243 175.3777 13 L 3.9995 8.3002 122.3306 57.9429 41.0712 179.4677 14 Y 4.0545 7.8065 115.8979 61.0896 38.3283 177.8046 15 Q 4.2605 8.3681 119.0437 59.0591 28.7503 178.8867 16 L 4.1995 8.0121 119.7711 57.7262 41.7469 179.0880 17 E 3.9589 8.2483 118.9564 59.0255 29.2824 178.2667 18 N 4.4409 8.0315 114.8019 55.1412 38.6105 175.0348 19 Y 4.3413 7.7406 116.6806 57.7124 38.6925 175.8587 20 C 4.4113 7.6395 117.7967 59.5130 28.9033 173.5157 21 N 4.5344 8.5743 118.3128 53.7531 38.2011 175.2992 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 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 0.00 0.00 0.00 2 I 8.29 3.38 1.50 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.99 -0.01 0.00 0.00 3 V 8.33 3.48 2.01 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 0.96 0.00 0.00 0.80 0.00 0.00 4 E 8.01 3.86 0.00 2.21 1.96 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 2.39 2.40 0.00 5 Q 8.29 3.93 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 6 C 7.99 4.21 0.00 2.95 3.12 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 7.42 4.24 0.00 3.02 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 8 T 8.12 4.22 4.24 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 1.25 0.00 0.00 9 S 8.45 4.35 0.00 3.80 3.52 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 8.61 4.40 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 0.47 0.92 0.00 0.00 11 C 8.39 5.05 0.00 3.21 3.05 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 8.79 4.93 0.00 4.25 4.10 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 13 L 8.30 4.00 0.00 1.36 1.54 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.81 4.05 0.00 3.03 3.06 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 8.37 4.26 0.00 2.34 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 16 L 8.01 4.20 0.00 1.90 1.75 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.25 3.96 0.00 2.21 2.11 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 2.31 2.34 0.00 18 N 8.03 4.44 0.00 2.68 2.51 0.00 0.00 6.92 6.85 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 7.74 4.34 0.00 3.14 3.05 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 4.41 0.00 3.00 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 8.57 4.53 0.00 2.72 2.73 0.00 0.00 6.81 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