NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8105 8.3249 115.8635 56.3057 39.8162 175.4041 2 V 3.3753 7.1006 114.2190 62.5697 32.3091 175.2376 3 N 4.6183 7.5049 119.7650 50.8118 37.7975 172.2785 4 Q 4.4160 7.0424 116.4103 55.3300 31.9062 174.0755 5 H 4.3725 8.6188 115.5999 55.2163 28.8914 175.1326 6 L 4.7167 8.5089 124.7652 53.1606 43.0369 175.6664 7 C 4.9653 8.2168 120.8635 58.5694 32.9519 175.4090 8 G 3.9134 8.4358 110.9866 46.5410 0.0000 177.3421 9 S 4.1032 8.7042 117.4497 61.2267 63.2519 176.2216 10 H 4.0878 8.2367 117.7052 58.7827 28.3730 177.4433 11 L 3.9172 7.7968 121.5036 58.1003 42.0271 178.9363 12 V 3.2026 7.4170 117.8887 65.7844 31.4219 177.6027 13 E 3.9162 8.6174 119.3152 59.1147 29.4523 178.6857 14 A 4.1820 7.8095 120.7717 55.1845 18.4501 179.5667 15 L 3.6262 7.6998 117.5132 57.7900 41.4748 179.0139 16 Y 4.1873 7.5652 119.3788 60.8392 38.5142 178.4066 17 L 3.7934 7.7920 118.2686 57.8021 41.8578 179.3905 18 V 3.7870 7.7041 116.9991 66.0320 31.6769 177.5371 19 C 4.3032 8.7171 116.9751 60.4642 28.5466 174.9041 20 G 3.6243 8.3109 109.5437 46.5261 0.0000 176.1183 21 E 4.2243 8.7886 121.3112 57.8961 29.9797 178.4880 22 R 3.8886 7.7580 119.3506 58.0073 30.2068 177.4437 23 G 3.9880 9.5434 102.2298 45.1654 0.0000 171.1191 24 F 4.8842 7.3571 112.4974 55.7582 40.4626 173.0477 25 F 4.8914 8.0876 114.7959 55.0458 40.0698 173.8636 26 Y 4.7130 8.9424 124.8922 56.2304 39.2774 174.9495 27 T 4.3275 7.9062 118.8133 58.4869 69.0183 172.7708 28 P 3.8168 0.0000 0.0000 66.2367 31.9050 178.7578 29 K 4.2542 7.5903 121.3340 52.6424 30.2085 179.1259 30 A 4.3941 7.8687 127.3581 52.0536 19.0503 176.7310 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 F 8.32 4.81 0.00 3.17 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 7.10 3.38 1.78 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 -0.31 0.00 0.00 0.67 0.00 0.00 3 N 7.50 4.62 0.00 2.64 2.73 0.00 0.00 6.73 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.04 4.42 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.09 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 5 H 8.62 4.37 0.00 3.18 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.51 4.72 0.00 1.58 1.58 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.22 4.97 0.00 2.87 2.76 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 8 G 8.44 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.70 4.10 0.00 3.99 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 10 H 8.24 4.09 0.00 3.48 3.40 0.00 5.63 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.80 3.92 0.00 1.83 1.78 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.42 3.20 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.19 0.00 0.00 13 E 8.62 3.92 0.00 2.09 2.15 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 2.33 2.35 0.00 14 A 7.81 4.18 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 3.63 0.00 0.94 0.16 0.81 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.57 4.19 0.00 3.09 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.79 3.79 0.00 1.97 1.79 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.70 3.79 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 0.77 0.00 0.00 0.86 0.00 0.00 19 C 8.72 4.30 0.00 3.23 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.31 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.79 4.22 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 22 R 7.76 3.89 0.00 2.02 2.09 0.00 3.17 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 9.54 3.99 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 0.00 0.00 0.00 24 F 7.36 4.88 0.00 3.03 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 25 F 8.09 4.89 0.00 3.14 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 8.94 4.71 0.00 3.20 3.13 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 27 T 7.91 4.33 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 1.37 0.00 0.00 28 P 0.00 3.82 0.00 2.10 1.90 0.00 3.48 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.82 0.00 29 K 7.59 4.25 0.00 1.79 1.67 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.32 1.00 7.81 30 A 7.87 4.39 1.15 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 0.00 0.00