NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 818 K 4.2353 8.3149 119.9976 54.7078 33.2639 173.4624 819 E 4.7112 7.0096 121.5998 56.6162 33.2676 173.0692 820 E 4.4725 8.1223 116.6079 57.5415 33.2977 174.3399 821 V 4.6296 7.6249 115.6159 60.9710 35.6809 173.6845 822 T 5.2110 8.3690 116.3895 62.2799 71.9997 173.6178 823 I 4.4208 8.7681 121.1620 59.1487 40.1677 174.8796 824 K 4.5711 8.6605 126.4169 55.5228 33.4910 175.5736 825 V 4.5271 8.0661 125.0066 61.2240 32.9713 174.7547 826 N 4.7322 8.7957 125.2096 52.4800 39.0602 174.0821 827 L 4.6053 9.8262 126.0875 54.7352 43.5294 176.9616 828 I 4.9369 8.5505 123.0821 59.9762 40.5222 174.8276 829 F 4.6641 9.3651 126.0341 55.8107 40.7332 177.1368 830 A 4.3283 7.9848 121.5277 53.0123 17.6067 178.3861 831 D 4.6784 9.1743 119.2292 58.3350 42.6523 177.2039 832 G 4.2228 8.5497 105.0412 45.6432 0.0000 174.3334 833 K 4.2351 8.2484 120.0653 56.5375 32.9342 176.9162 834 I 5.2310 8.4031 118.2307 59.6148 40.6074 174.7299 835 Q 4.6832 9.0852 120.3462 54.6759 33.3364 174.5125 836 T 4.8758 8.6371 114.3427 60.6408 69.8976 174.1652 837 A 4.2145 8.2892 131.7477 52.6906 21.7526 174.6360 838 E 4.7440 7.1322 111.0951 55.8173 32.7248 176.2584 839 F 5.0874 8.9720 126.0501 55.7332 41.6235 174.8231 840 K 5.7800 8.1646 121.8861 54.5224 35.6165 174.8088 841 G 3.8590 8.6279 105.4650 44.4264 0.0000 172.8608 842 T 4.5323 8.7704 108.6391 60.6405 70.2336 176.0563 843 F 3.8408 8.6557 126.7974 61.2282 40.2136 177.1619 844 E 3.9315 8.1519 119.8931 59.2172 29.8754 177.5237 845 E 3.9525 8.4763 118.8773 60.3999 29.6862 178.6201 846 A 3.4281 8.1498 115.5172 55.1194 18.3098 179.4717 847 T 3.1701 7.6220 112.1759 65.7930 68.9431 176.2263 848 A 4.0645 7.9238 122.6766 54.7439 18.2655 179.6813 849 E 3.7753 7.9939 117.3120 59.4772 29.3963 178.9207 850 A 2.0000 6.8430 120.0835 54.5726 17.9744 178.5819 851 Y 3.9406 6.8698 113.4828 59.7948 38.3783 178.2059 852 R 3.9787 8.1568 120.1013 59.2593 30.0515 177.9366 853 Y 4.1543 8.7547 120.0859 60.7298 38.8116 177.9952 854 A 3.9428 7.6786 121.3144 54.8854 18.1544 179.0319 855 D 4.4916 7.9096 116.4598 56.4300 41.3409 178.5701 856 L 4.0634 7.4151 120.8399 57.9958 42.1612 178.6584 857 L 3.6832 8.1900 118.9476 58.6185 41.5680 180.2914 858 A 4.9483 8.3714 122.1613 56.8145 18.5162 179.6620 859 K 4.0576 7.4096 111.8717 57.7171 31.7701 178.2578 860 V 4.3840 8.1031 115.2837 63.5285 35.5817 172.7259 861 N 5.1170 8.1843 116.7919 51.6976 42.0013 175.7517 862 G 4.0932 8.1241 108.7718 46.4099 0.0000 172.4727 863 E 4.7884 8.8457 120.0827 56.3715 31.3691 175.0878 864 Y 5.6326 8.0029 117.7975 55.8978 41.0864 174.4365 865 T 4.7575 8.5607 115.8231 61.0189 71.8441 173.8690 866 W 5.4677 7.9109 119.0895 54.3248 26.8507 174.3277 867 D 4.5288 8.1298 121.9824 55.6789 42.4696 175.8334 868 L 5.1365 8.3991 123.5563 52.3611 44.9339 176.1458 869 E 3.9822 8.7255 122.1543 56.6084 30.2290 176.7591 870 D 4.5482 8.8054 123.2098 55.0268 41.9536 174.2162 871 G 4.1045 8.8194 109.7362 44.4591 0.0000 175.2009 872 G 4.3067 7.7270 103.7822 45.8913 0.0000 173.2767 873 N 4.9243 7.7699 115.6172 52.9480 39.4452 174.7149 874 H 5.0907 7.6146 113.7389 56.8877 32.2736 173.0997 875 M 4.8473 8.4629 126.3329 54.4444 34.6300 175.9352 876 N 5.3002 8.0434 111.9654 53.0266 39.8702 174.6161 877 I 4.1966 7.9453 122.8412 60.5978 39.2687 176.1968 878 K 4.8263 8.2004 123.9887 55.0268 34.4903 175.6862 879 F 5.1641 8.9830 124.0229 56.4569 41.6429 175.0474 880 A 4.2796 8.7071 117.8012 52.5046 22.6106 176.0701 881 G 3.5908 8.6310 111.6235 45.2406 0.0000 173.6507 882 K 4.2356 7.9496 120.8274 57.6038 32.4256 177.8639 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 818 K 8.31 4.24 0.00 1.88 1.93 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 819 E 7.01 4.71 0.00 2.05 1.92 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 2.06 2.36 0.00 820 E 8.12 4.47 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 2.29 2.29 0.00 821 V 7.62 4.63 2.14 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 0.79 0.00 0.00 0.98 0.00 0.00 822 T 8.37 5.21 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 823 I 8.77 4.42 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.96 0.75 0.00 0.00 824 K 8.66 4.57 0.00 1.67 1.72 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.44 7.81 825 V 8.07 4.53 2.28 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 1.04 0.00 0.00 1.04 0.00 0.00 826 N 8.80 4.73 0.00 2.87 2.86 0.00 0.00 7.17 6.74 0.00 0.00 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 L 9.83 4.61 0.00 1.89 1.72 1.18 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 828 I 8.55 4.94 2.06 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 1.33 0.80 1.01 0.00 0.00 829 F 9.37 4.66 0.00 3.14 3.04 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 0.00 0.00 0.00 830 A 7.98 4.33 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.17 4.68 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 832 G 8.55 4.22 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 0.00 0.00 0.00 833 K 8.25 4.24 0.00 1.95 1.70 0.00 1.54 0.00 0.00 1.88 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.49 7.81 834 I 8.40 5.23 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.96 1.07 0.00 0.00 835 Q 9.09 4.68 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 836 T 8.64 4.88 4.22 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 1.22 0.00 0.00 837 A 8.29 4.21 0.81 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 0.00 0.00 838 E 7.13 4.74 0.00 1.78 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 839 F 8.97 5.09 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 840 K 8.16 5.78 0.00 1.60 1.70 0.00 1.75 0.00 0.00 2.36 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.23 7.81 841 G 8.63 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 0.00 842 T 8.77 4.53 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 843 F 8.66 3.84 0.00 3.13 3.04 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 0.00 0.00 0.00 844 E 8.15 3.93 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 845 E 8.48 3.95 0.00 2.06 1.92 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 2.32 2.50 0.00 846 A 8.15 3.43 1.20 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 0.00 0.00 847 T 7.62 3.17 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 848 A 7.92 4.06 1.36 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 0.00 849 E 7.99 3.78 0.00 1.88 2.06 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 2.56 2.50 0.00 850 A 6.84 2.00 0.34 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 0.00 851 Y 6.87 3.94 0.00 2.89 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 852 R 8.16 3.98 0.00 1.96 2.11 0.00 3.13 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 853 Y 8.75 4.15 0.00 3.32 3.34 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 0.00 854 A 7.68 3.94 1.01 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 0.00 855 D 7.91 4.49 0.00 2.73 2.81 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 0.00 856 L 7.42 4.06 0.00 1.85 1.71 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 857 L 8.19 3.68 0.00 1.49 1.15 0.82 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 858 A 8.37 4.95 1.56 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 0.00 0.00 859 K 7.41 4.06 0.00 1.80 1.88 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.39 7.81 860 V 8.10 4.38 2.07 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 0.64 0.00 0.00 0.92 0.00 0.00 861 N 8.18 5.12 0.00 2.68 2.65 0.00 0.00 6.84 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 0.00 862 G 8.12 4.09 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 0.00 0.00 0.00 863 E 8.85 4.79 0.00 1.90 1.81 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 2.42 2.20 0.00 864 Y 8.00 5.63 0.00 2.11 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 0.00 0.00 0.00 865 T 8.56 4.76 4.28 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 1.19 0.00 0.00 866 W 7.91 5.47 0.00 3.42 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 0.00 867 D 8.13 4.53 0.00 2.86 2.67 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 0.00 868 L 8.40 5.14 0.00 1.67 1.69 1.32 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 869 E 8.73 3.98 0.00 2.05 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 2.36 2.33 0.00 870 D 8.81 4.55 0.00 2.67 2.67 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 0.00 871 G 8.82 4.10 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 0.00 0.00 0.00 872 G 7.73 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 873 N 7.77 4.92 0.00 2.80 2.92 0.00 0.00 6.82 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 874 H 7.61 5.09 0.00 3.21 3.13 0.00 5.72 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 875 M 8.46 4.85 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 876 N 8.04 5.30 0.00 2.58 2.77 0.00 0.00 7.00 7.96 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 0.00 877 I 7.95 4.20 1.65 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.66 -0.12 0.00 0.00 878 K 8.20 4.83 0.00 1.64 1.69 0.00 1.68 0.00 0.00 1.86 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.69 7.81 879 F 8.98 5.16 0.00 2.98 3.05 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 0.00 880 A 8.71 4.28 1.22 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 0.00 0.00 881 G 8.63 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 K 7.95 4.24 0.00 1.90 1.90 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.55 7.81