NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.4844 8.1600 109.1419 45.1111 0.0000 174.2813 2 I 3.0552 8.3125 119.6437 63.3454 37.3701 172.6522 3 V 3.5180 8.4089 119.8879 65.9568 31.7746 177.2249 4 E 3.9781 8.0453 117.7526 59.6663 29.2231 179.2594 5 Q 4.0971 8.5482 117.0176 58.2117 28.8379 176.6266 6 C 5.1586 8.1785 113.4254 56.0872 41.0762 174.1015 7 C 4.3888 7.8354 116.7476 60.0953 28.4577 174.0542 8 T 4.4143 7.9276 114.9543 64.4492 70.0407 174.3902 9 S 4.8033 7.6211 116.5306 56.2670 64.9069 173.6038 10 I 4.0494 8.2024 125.6106 61.5436 37.4365 176.4099 11 C 4.7678 8.5798 123.1011 56.1838 41.3745 174.4952 12 S 4.4979 9.5824 120.0213 57.4419 65.4614 175.2941 13 L 3.8557 8.1301 120.5641 58.2669 40.9242 179.3972 14 Y 4.1503 7.0746 115.1284 60.9713 38.2849 177.8869 15 Q 4.2218 8.1061 119.3174 58.7827 28.8829 178.3880 16 L 4.2282 8.0878 120.1077 57.9899 41.7139 179.2988 17 E 4.1091 8.1500 117.4798 58.9173 29.1146 178.8793 18 N 4.3187 7.8890 115.5276 55.3262 38.4963 175.1258 19 Y 4.5901 7.4515 116.1824 57.8026 38.3529 175.6332 20 C 4.4806 7.6158 118.2153 59.2644 29.0614 173.5538 21 N 4.5472 8.5566 117.8613 53.7746 38.2194 175.3791 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 8.16 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 3.06 0.82 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.14 0.67 0.00 0.00 3 V 8.41 3.52 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.87 0.00 0.00 4 E 8.05 3.98 0.00 2.27 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 5 Q 8.55 4.10 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.93 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 6 C 8.18 5.16 0.00 2.93 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 7 C 7.84 4.39 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 4.41 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 1.21 0.00 0.00 9 S 7.62 4.80 0.00 3.88 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 10 I 8.20 4.05 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 1.42 0.47 0.92 0.00 0.00 11 C 8.58 4.77 0.00 2.99 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 12 S 9.58 4.50 0.00 4.14 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 3.86 0.00 1.04 1.36 0.77 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.07 4.15 0.00 3.06 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 4.22 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 16 L 8.09 4.23 0.00 1.88 1.78 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.15 4.11 0.00 2.05 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 2.30 2.53 0.00 18 N 7.89 4.32 0.00 2.41 2.33 0.00 0.00 6.91 6.95 0.00 0.00 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 7.45 4.59 0.00 3.15 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 7.62 4.48 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 8.56 4.55 0.00 2.72 2.74 0.00 0.00 6.80 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