NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 5.0393 8.3244 122.8254 56.9991 41.5393 175.1230 2 V 3.4177 7.6601 122.2654 63.9234 33.1620 175.5443 3 N 4.6177 7.5222 118.7650 50.4393 37.7792 172.2031 4 Q 4.4189 7.0076 116.6405 55.6054 31.5551 173.8560 5 H 4.3627 8.7187 115.7127 55.3580 28.9800 175.0479 6 L 4.7312 8.5028 124.5467 53.1376 43.7985 175.6375 7 C 4.9638 8.1692 120.5998 58.4841 33.0098 175.4912 8 G 3.7721 8.4715 110.6552 46.4443 0.0000 177.1527 9 S 4.1119 8.6389 116.5950 61.3695 63.1213 176.4378 10 H 4.2196 8.2543 118.2739 58.5754 28.3080 177.4951 11 L 3.8926 7.7708 121.7825 58.0231 42.0821 178.9056 12 V 3.2472 7.4976 118.2357 66.0126 31.3860 177.9251 13 E 4.0636 8.3527 118.1119 59.1229 29.2021 179.1722 14 A 4.0708 7.7640 121.0471 55.1363 18.3590 179.6635 15 L 3.5846 7.5730 117.5028 57.7458 41.3735 179.0284 16 Y 4.2801 7.5820 119.3246 60.9048 38.5572 178.3645 17 L 3.7499 7.8353 118.3635 57.5654 41.7996 179.5076 18 V 3.7267 7.6930 117.2863 66.3530 31.9864 177.7948 19 C 4.3090 8.4981 116.5586 60.6858 28.5196 175.1241 20 G 3.6749 8.2675 109.9446 46.5597 0.0000 176.3167 21 E 4.2100 8.8052 122.4322 58.2545 29.5842 178.1581 22 R 3.9117 7.8086 118.0268 57.0764 30.2690 177.6163 23 G 3.9245 9.5330 104.6628 45.2826 0.0000 171.3459 24 F 4.8913 7.4151 112.2586 56.0941 40.1325 172.9231 25 F 5.0016 8.4675 115.2350 55.0004 40.1027 173.6953 26 Y 4.7590 8.9653 124.4036 56.2756 40.1049 175.1678 27 T 4.2782 7.9890 123.8775 60.8062 69.9030 172.2901 28 P 4.0749 0.0000 0.0000 65.2338 31.5780 178.7452 29 K 4.1970 7.5229 121.0832 55.1926 30.7211 176.9070 30 A 4.2090 8.0224 124.7232 52.0968 18.6466 177.6692 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 5.04 0.00 2.87 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 2 V 7.66 3.42 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 -0.12 0.00 0.00 3 N 7.52 4.62 0.00 2.73 2.73 0.00 0.00 6.72 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 7.01 4.42 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.97 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 5 H 8.72 4.36 0.00 3.18 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.50 4.73 0.00 1.56 1.55 0.86 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.17 4.96 0.00 2.90 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.47 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 4.11 0.00 4.01 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 H 8.25 4.22 0.00 3.37 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.77 3.89 0.00 1.80 1.77 0.87 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.50 3.25 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 0.95 0.00 0.00 0.27 0.00 0.00 13 E 8.35 4.06 0.00 2.08 2.05 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 2.30 2.54 0.00 14 A 7.76 4.07 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.57 3.58 0.00 0.94 0.22 0.73 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.58 4.28 0.00 3.17 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 17 L 7.84 3.75 0.00 1.86 1.85 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.69 3.73 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 0.76 0.00 0.00 0.80 0.00 0.00 19 C 8.50 4.31 0.00 3.24 3.24 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 0.00 20 G 8.27 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.81 4.21 0.00 1.98 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 0.00 2.31 2.28 0.00 22 R 7.81 3.91 0.00 2.06 2.05 0.00 3.23 0.00 0.00 3.25 7.35 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 9.53 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 0.00 0.00 0.00 24 F 7.42 4.89 0.00 3.03 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 25 F 8.47 5.00 0.00 3.17 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 26 Y 8.97 4.76 0.00 3.12 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 27 T 7.99 4.28 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 28 P 0.00 4.07 0.00 1.93 2.02 0.00 3.43 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.29 0.00 29 K 7.52 4.20 0.00 1.69 1.75 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.47 7.81 30 A 8.02 4.21 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00