NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1H T 4.3434 8.1744 110.9434 61.3098 70.1736 172.3416 1G F 4.0734 8.5401 123.4702 58.2060 39.9659 173.7433 1F G 3.6487 7.4586 114.8234 45.9057 0.0000 174.2206 1E S 4.0589 7.7419 115.8118 59.3095 63.3046 175.3970 1D G 3.8859 8.3273 107.6665 45.2728 0.0000 173.2852 1C E 4.4014 7.4038 117.6109 56.1183 31.0674 176.6879 1B A 4.0215 7.6821 121.1939 52.0292 18.8994 177.1857 1A D 4.5889 8.3750 121.1183 53.1110 40.3355 175.0590 1 C 4.8093 7.7222 119.8714 56.8823 33.0198 175.6091 2 G 4.0084 8.8443 106.5098 45.6114 0.0000 173.2648 3 L 4.6623 7.3112 118.7047 52.7233 43.5710 176.2382 4 R 4.3628 9.2216 124.0866 54.7779 30.9967 175.5401 5 P 4.2353 0.0000 0.0000 65.8708 31.3389 177.4502 6 L 4.0710 7.7828 113.7689 55.2680 41.8508 176.6902 7 F 4.8100 7.5421 114.6335 57.0967 42.0908 176.9476 8 E 4.0316 8.8275 121.5974 59.9161 30.2274 179.9083 9 K 4.0301 8.1716 116.3879 58.6357 32.1977 177.7269 10 K 4.4055 7.8059 115.2354 55.4427 32.4550 175.8768 11 S 3.8343 7.8731 113.5636 59.6686 60.6907 171.6960 12 L 4.8396 8.3991 119.2952 53.0035 43.7681 175.7009 13 E 4.9788 8.5860 121.3779 54.4922 31.7779 175.7818 14 D 4.6907 8.3169 122.2970 52.1196 40.7285 176.6689 14A K 3.9936 8.7055 118.8331 59.5348 31.9727 178.3807 14B T 4.4816 7.7136 105.6044 61.1652 69.0962 175.2718 14C E 3.8572 8.2304 125.1432 59.8092 29.3899 178.8664 14D R 3.8648 7.9049 118.2901 59.1812 29.9368 177.7961 14E E 3.8881 7.7052 118.3873 59.2778 29.6633 178.6026 14F L 3.8970 7.6517 118.5022 57.4477 41.6801 178.9674 14G L 3.9087 7.4813 120.0910 58.1398 42.2269 178.8208 14H E 4.0483 8.5523 118.8062 58.6833 29.1511 179.0654 14I S 4.2386 7.1520 113.5043 60.9111 63.2172 175.1751 14J Y 4.3989 7.1002 120.1890 60.6959 37.8184 175.8975 14K I 3.8111 7.2548 119.5174 61.5503 36.8724 175.2717 14L D 4.6864 8.5298 125.9055 53.0831 41.9146 176.6066 14M G 3.8618 8.4289 112.1094 44.7923 0.0000 174.0154 15 R 4.1167 8.5466 123.1888 56.5118 30.1882 176.4538 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 1H T 8.17 4.34 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1G F 8.54 4.07 0.00 3.11 3.01 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 0.00 0.00 0.00 0.00 1F G 7.46 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E S 7.74 4.06 0.00 3.96 3.97 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 1D G 8.33 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C E 7.40 4.40 0.00 1.92 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 2.22 2.34 0.00 1B A 7.68 4.02 1.18 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 0.00 0.00 1A D 8.37 4.59 0.00 2.63 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.72 4.81 0.00 3.08 2.96 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 2 G 8.84 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.31 4.66 0.00 1.70 1.62 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.22 4.36 0.00 2.22 2.08 0.00 3.25 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 5 P 0.00 4.24 0.00 2.03 2.13 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 6 L 7.78 4.07 0.00 1.43 1.01 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.54 4.81 0.00 3.10 2.96 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 8 E 8.83 4.03 0.00 2.13 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 2.44 2.46 0.00 9 K 8.17 4.03 0.00 2.02 1.93 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.53 7.81 10 K 7.81 4.41 0.00 1.63 1.74 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.62 7.81 11 S 7.87 3.83 0.00 4.04 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 12 L 8.40 4.84 0.00 1.59 1.59 0.83 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.59 4.98 0.00 1.98 1.87 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 2.36 2.31 0.00 14 D 8.32 4.69 0.00 2.39 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14A K 8.71 3.99 0.00 1.74 1.92 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.47 7.81 14B T 7.71 4.48 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 14C E 8.23 3.86 0.00 2.40 1.94 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 2.29 2.27 0.00 14D R 7.90 3.86 0.00 1.90 1.88 0.00 3.24 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 14E E 7.71 3.89 0.00 1.91 2.12 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 2.25 2.30 0.00 14F L 7.65 3.90 0.00 1.60 1.49 0.88 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14G L 7.48 3.91 0.00 1.68 1.84 0.98 1.09 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 14H E 8.55 4.05 0.00 1.95 1.94 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 2.31 2.49 0.00 14I S 7.15 4.24 0.00 3.86 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14J Y 7.10 4.40 0.00 3.10 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 14K I 7.25 3.81 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.52 0.93 0.00 0.00 14L D 8.53 4.69 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14M G 8.43 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.55 4.12 0.00 1.82 1.85 0.00 3.25 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00