NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 798 I 4.0000 8.0249 121.4364 60.1926 38.5712 175.4190 799 P 4.1399 0.0000 0.0000 61.5577 32.1391 175.7728 800 A 3.9755 8.5596 123.9483 55.1362 19.3052 179.8547 801 W 4.3848 8.2242 110.8717 58.6122 28.2454 176.5117 802 A 4.3836 6.9673 120.7465 51.2496 19.1061 176.3187 803 S 4.4598 7.7111 108.9087 59.7055 65.6229 177.0797 804 G 4.3624 8.1788 112.3631 43.4519 0.0000 174.7550 805 N 4.3510 9.0419 124.8170 56.2749 38.7748 175.6205 806 L 4.0770 7.9578 120.0417 57.6281 41.6623 179.1277 807 L 4.1081 7.8798 119.6062 58.5328 42.1538 178.5999 808 T 3.9068 7.5904 115.8237 67.1263 68.3880 176.4464 809 Q 4.0192 8.6481 119.6766 58.8960 28.6994 178.7939 810 A 4.0410 8.0563 121.6135 55.1716 18.4552 179.7598 811 I 3.6952 8.2095 118.7461 64.5122 37.2127 178.5750 812 R 3.9722 8.2700 119.7042 59.5902 29.9573 178.2242 813 Q 4.0983 8.4858 119.5825 59.4088 28.8084 178.1739 814 Q 4.0255 8.1805 119.6760 59.1260 29.1396 177.2335 815 Y 4.0497 7.9115 119.9302 60.8454 38.9721 177.0999 816 Y 4.4294 7.8723 115.5216 58.6637 39.5885 175.9802 817 K 4.6563 7.8318 118.5621 53.6257 32.2847 173.7570 818 P 4.4095 0.0000 0.0000 62.4305 32.3141 177.5378 819 I 4.0672 8.0260 115.6223 60.1338 38.8314 176.6840 820 D 4.5824 8.1750 120.7737 53.8464 39.1529 176.7538 821 V 3.6706 7.9696 118.8213 63.7976 31.8552 177.3444 822 D 4.3780 8.2899 118.7828 56.7624 40.4447 178.1589 823 R 4.2263 7.5284 113.8301 58.1074 30.4300 178.0526 824 M 3.9449 8.0395 118.3337 57.5417 32.0957 176.2861 825 Y 4.7433 8.0721 115.2593 58.8839 40.6998 178.0467 826 G 4.0152 8.4914 106.9793 47.5143 0.0000 174.3934 827 T 4.2194 7.7356 108.6569 63.0055 69.7076 175.4808 828 I 3.8683 7.1484 122.2357 60.7969 37.5951 175.7236 829 D 4.5325 8.6204 124.5109 54.7527 41.3311 175.9915 830 S 4.8638 8.1727 117.6188 55.5934 65.9152 172.5096 831 P 4.3945 0.0000 0.0000 62.2918 31.8488 176.5217 832 K 4.0782 8.5811 120.4263 56.6029 32.7799 178.3957 833 L 4.0296 8.5758 122.5429 57.6568 41.3090 179.5371 834 E 4.2190 8.1547 116.2734 58.8151 30.0549 178.1431 835 E 4.2556 8.4149 119.4504 58.0814 29.5126 178.2746 836 L 4.0886 7.3376 117.4323 57.0242 41.6196 177.9282 837 F 4.6514 7.9896 114.1459 57.1321 39.5329 175.0742 838 N 5.2285 8.0413 120.4873 51.4992 40.8106 174.5077 839 K 4.0888 8.5665 118.5458 57.5166 32.7734 177.1198 840 S 4.3695 8.5062 115.8866 58.4772 63.2377 173.9549 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 798 I 8.02 4.00 1.76 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.98 0.68 0.00 0.00 799 P 0.00 4.14 0.00 1.67 2.01 0.00 3.23 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 800 A 8.56 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 801 W 8.22 4.38 0.00 3.52 3.25 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 0.00 802 A 6.97 4.38 -0.05 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 0.00 0.00 803 S 7.71 4.46 0.00 3.92 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 804 G 8.18 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 805 N 9.04 4.35 0.00 2.78 2.84 0.00 0.00 6.90 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 806 L 7.96 4.08 0.00 1.75 1.81 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 807 L 7.88 4.11 0.00 1.98 1.95 1.07 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 808 T 7.59 3.91 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 809 Q 8.65 4.02 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 810 A 8.06 4.04 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 811 I 8.21 3.70 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.11 0.93 0.00 0.00 812 R 8.27 3.97 0.00 1.96 2.19 0.00 3.19 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 813 Q 8.49 4.10 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 814 Q 8.18 4.03 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 815 Y 7.91 4.05 0.00 2.84 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 816 Y 7.87 4.43 0.00 3.13 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 0.00 817 K 7.83 4.66 0.00 1.91 1.74 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.42 7.81 818 P 0.00 4.41 0.00 2.13 1.98 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.85 0.00 819 I 8.03 4.07 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.63 0.90 0.00 0.00 820 D 8.17 4.58 0.00 2.70 2.56 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 0.00 0.00 0.00 0.00 821 V 7.97 3.67 2.30 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 0.92 0.00 0.00 0.98 0.00 0.00 822 D 8.29 4.38 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 823 R 7.53 4.23 0.00 1.96 2.01 0.00 3.02 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.53 0.00 824 M 8.04 3.94 0.00 1.14 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 825 Y 8.07 4.74 0.00 3.20 2.85 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 0.00 0.00 0.00 0.00 826 G 8.49 4.02 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 0.00 0.00 0.00 827 T 7.74 4.22 4.23 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 1.23 0.00 0.00 828 I 7.15 3.87 2.08 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.41 0.94 0.00 0.00 829 D 8.62 4.53 0.00 2.67 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 830 S 8.17 4.86 0.00 3.82 3.73 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 0.00 0.00 0.00 0.00 831 P 0.00 4.39 0.00 2.16 2.04 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 832 K 8.58 4.08 0.00 1.89 1.79 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.43 7.81 833 L 8.58 4.03 0.00 1.71 1.77 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 834 E 8.15 4.22 0.00 2.15 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 2.29 2.42 0.00 835 E 8.41 4.26 0.00 2.21 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 0.00 2.32 2.35 0.00 836 L 7.34 4.09 0.00 1.81 1.42 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 837 F 7.99 4.65 0.00 3.01 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 0.00 838 N 8.04 5.23 0.00 2.80 2.79 0.00 0.00 6.90 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 839 K 8.57 4.09 0.00 1.75 1.75 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.44 7.81 840 S 8.51 4.37 0.00 3.95 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00