NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 802 F 5.0504 8.3093 119.3963 57.9545 39.2990 173.3497 803 T 4.5776 8.2463 115.7406 58.5524 71.7600 173.3113 804 N 4.6219 8.6418 119.9473 52.5155 38.2466 173.7772 805 V 4.4262 7.4607 120.6419 60.3261 34.2509 175.1155 806 S 4.5010 8.8725 123.6993 59.4819 63.8707 174.7776 807 C 4.8514 8.5972 117.6403 56.1924 42.2738 173.4323 808 T 4.4570 8.7353 118.1006 64.8925 72.0405 174.3462 809 T 4.6803 7.5180 114.2397 61.0037 72.8483 174.6704 810 S 4.1797 8.3247 117.5555 61.1530 61.9941 176.5522 811 K 2.0000 7.2504 121.6508 58.0590 31.6546 178.5932 812 E 4.1785 7.4119 116.9515 58.8806 29.9180 179.0852 813 C 4.1671 7.3160 117.3464 59.6809 41.3459 176.3801 814 W 4.3878 7.3830 119.8758 60.1396 29.0629 178.3994 815 S 4.2142 7.6122 113.2101 61.9155 62.1988 177.2931 816 V 3.6299 7.8622 120.7364 65.9948 31.2778 177.4827 817 C 4.2257 7.9359 116.4583 60.1950 39.9066 175.9165 818 Q 3.9910 8.0472 119.7109 59.0804 28.6517 178.0625 819 R 4.0269 7.6803 118.6032 59.6013 30.2649 177.5701 820 L 3.9749 8.3450 119.4435 58.2122 42.0420 176.3039 821 H 4.7956 8.2747 112.6241 53.8746 31.9830 173.6430 822 N 5.2219 7.1677 126.3955 52.8116 38.7069 173.3945 823 T 4.7691 7.6344 106.7312 61.4952 72.5746 172.0601 824 S 4.4204 8.0308 116.2271 58.0357 66.8981 171.6664 825 R 3.3638 8.5313 124.6175 57.0655 28.2039 174.8637 826 G 4.7079 8.4394 108.6578 45.7944 0.0000 171.8435 827 K 4.4091 8.8523 126.5708 56.7615 34.0419 175.3226 828 C 4.9975 8.6308 122.8698 55.0332 43.6324 172.7279 829 M 4.7791 8.4199 124.9671 53.2595 33.9970 176.4958 830 N 4.2059 8.8442 119.2541 56.4950 38.3987 176.0649 831 K 4.1740 7.0661 118.2091 57.4459 32.8671 176.2340 832 K 4.6860 7.2909 118.1638 54.5984 36.3246 176.4601 833 C 4.3907 9.1063 123.5748 57.2842 38.9800 172.9788 834 R 4.9357 8.5068 125.2197 55.1526 31.8131 174.8807 835 C 5.0818 9.1234 120.5683 56.5880 40.3803 172.2150 836 Y 4.7202 8.4463 118.6972 56.5319 42.8879 175.9087 837 S 4.4154 8.8537 113.6074 58.7293 63.4238 174.0030 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 802 F 8.31 5.05 0.00 3.07 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 0.00 803 T 8.25 4.58 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 1.25 0.00 0.00 804 N 8.64 4.62 0.00 2.71 2.81 0.00 0.00 6.69 7.72 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 0.00 805 V 7.46 4.43 2.32 0.00 0.00 0.00 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 0.98 0.00 0.00 806 S 8.87 4.50 0.00 3.78 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 0.00 807 C 8.60 4.85 0.00 2.79 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 0.00 808 T 8.74 4.46 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 0.00 809 T 7.52 4.68 4.07 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 1.10 0.00 0.00 810 S 8.32 4.18 0.00 4.24 4.15 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 0.00 811 K 7.25 2.00 0.00 1.42 1.47 0.00 1.58 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.16 1.27 7.81 812 E 7.41 4.18 0.00 2.12 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 2.20 2.34 0.00 813 C 7.32 4.17 0.00 2.92 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 814 W 7.38 4.39 0.00 3.48 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 0.00 815 S 7.61 4.21 0.00 3.92 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 0.00 816 V 7.86 3.63 2.25 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 0.99 0.00 0.00 1.01 0.00 0.00 817 C 7.94 4.23 0.00 3.32 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 818 Q 8.05 3.99 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 819 R 7.68 4.03 0.00 2.14 1.93 0.00 3.49 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 820 L 8.34 3.97 0.00 1.67 1.20 0.93 1.11 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 0.00 821 H 8.27 4.80 0.00 3.28 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 N 7.17 5.22 0.00 2.87 2.94 0.00 0.00 5.77 7.73 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 0.00 823 T 7.63 4.77 4.53 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 0.00 0.00 0.00 1.24 0.00 0.00 824 S 8.03 4.42 0.00 3.78 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 825 R 8.53 3.36 0.00 1.70 1.85 0.00 3.39 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.00 826 G 8.44 4.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.85 4.41 0.00 1.84 1.71 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.53 1.44 7.81 828 C 8.63 5.00 0.00 3.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 829 M 8.42 4.78 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 830 N 8.84 4.21 0.00 2.67 2.90 0.00 0.00 6.92 7.60 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 0.00 831 K 7.07 4.17 0.00 1.83 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.40 7.81 832 K 7.29 4.69 0.00 1.73 1.89 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.45 1.49 7.81 833 C 9.11 4.39 0.00 3.06 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 0.00 834 R 8.51 4.94 0.00 1.79 1.99 0.00 2.63 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.00 835 C 9.12 5.08 0.00 3.00 3.15 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 0.00 836 Y 8.45 4.72 0.00 3.22 2.89 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 0.00 837 S 8.85 4.42 0.00 3.98 3.82 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