NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 802 N 4.6795 8.2827 119.2048 53.4648 40.9957 176.2615 803 K 3.7144 7.9888 119.4403 58.7870 32.3521 176.1133 804 A 4.6517 8.1303 118.9229 52.4954 19.6706 177.1795 805 Q 4.3639 7.8204 120.5961 58.9465 28.9041 177.3593 806 R 4.1151 7.5288 118.1565 57.8605 30.0234 177.1977 807 L 4.3863 7.8265 118.6810 56.8657 42.5955 177.6680 808 Q 4.0155 7.6922 119.2137 59.2391 29.4384 177.5530 809 T 4.0542 7.8145 115.7787 65.7972 68.4419 176.4639 810 E 3.9981 7.6371 119.0865 58.9247 29.7129 178.2643 811 L 3.9903 7.6485 120.5467 58.2363 42.2621 178.6113 812 D 4.4361 8.1551 118.6479 56.7229 40.7920 178.9664 813 V 3.6081 7.6779 118.7767 65.8440 31.4973 177.9349 814 S 4.0943 8.1086 112.9297 61.4427 62.1726 175.9879 815 E 3.9565 8.2886 121.1779 59.5299 29.3047 179.0859 816 Q 3.9434 7.9497 119.1543 59.2781 29.1193 178.6437 817 V 3.6480 7.8024 119.2874 65.7665 31.5818 177.4936 818 Q 4.0496 8.5420 119.8772 59.6800 28.8019 178.8932 819 R 4.0216 8.2603 118.8584 59.2211 29.9790 178.6450 820 D 4.2621 8.0094 118.5470 57.7231 40.8971 179.1433 821 F 4.0601 8.1652 117.8059 59.9892 38.8155 177.8716 822 V 3.6108 8.3761 118.6294 66.3489 31.3222 178.3503 823 K 4.2359 8.2758 119.4399 58.6876 31.8620 179.1722 824 L 3.9393 8.1410 121.1920 58.2059 42.0486 179.2837 825 S 4.2234 8.5661 114.6354 61.4213 62.6152 176.3183 826 Q 4.0202 8.3827 121.9314 59.1343 28.4092 179.1408 827 T 3.9393 8.0125 116.5903 66.5972 68.4577 176.7541 828 L 3.9937 8.0023 120.8924 58.0944 41.6266 179.7493 829 Q 3.9848 8.2545 117.8829 58.7831 28.6017 178.8845 830 V 3.5858 7.8763 119.3589 66.0706 31.6738 177.9997 831 Q 4.0055 8.2393 117.8406 59.0664 28.5384 179.0415 832 L 3.9924 8.1625 120.0307 57.8204 41.8081 179.2178 833 E 3.9513 8.3791 119.2946 59.2653 29.3013 179.0822 834 R 3.9664 7.9877 117.5619 59.1743 30.3387 178.7439 835 I 3.8468 7.7072 119.4914 64.4166 36.9071 178.4210 836 R 3.8933 7.9196 118.3548 59.0286 29.9360 177.5702 837 Q 4.3076 7.6224 114.4423 54.9726 29.5433 175.5563 838 A 4.4011 7.4923 124.1174 51.7164 19.6516 177.5934 839 D 5.0503 7.9527 121.5091 53.0770 41.9456 177.0610 840 S 4.6708 7.3916 110.9686 56.8674 66.3379 176.6183 841 L 4.0209 8.0249 123.9615 57.7077 41.3984 179.3979 842 E 3.8598 8.1148 118.9778 59.4326 29.6277 178.6402 843 R 3.8982 8.4581 118.9697 59.5404 30.0706 178.5956 844 I 3.7300 7.7379 119.5847 64.4762 36.9379 178.6783 845 R 3.9743 8.4384 117.8378 58.8116 30.0903 178.8652 846 A 4.1098 8.0601 120.8390 55.3793 18.6131 179.4782 847 I 3.6633 7.9203 118.4405 64.8866 36.9342 178.6562 848 L 4.1203 7.8284 118.6908 56.9065 41.4742 177.7916 849 N 4.8993 7.8564 115.2490 52.5940 40.2062 174.7505 850 D 4.7858 7.0665 119.2057 53.0779 42.5054 176.8098 851 T 4.1490 8.0891 118.4046 63.3294 69.3009 174.4729 852 K 4.2499 7.8333 120.5501 55.2089 33.9228 175.3193 853 L 3.3818 9.0408 125.1477 56.4250 39.5904 174.3755 854 T 3.8051 8.1640 111.1949 61.6203 70.1097 172.8151 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 N 8.28 4.68 0.00 2.82 2.88 0.00 0.00 6.71 5.12 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 0.00 803 K 7.99 3.71 0.00 1.95 1.78 0.00 1.65 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.56 7.81 804 A 8.13 4.65 1.27 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 0.00 0.00 0.00 805 Q 7.82 4.36 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 806 R 7.53 4.12 0.00 1.77 1.90 0.00 3.29 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 807 L 7.83 4.39 0.00 1.95 1.63 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 808 Q 7.69 4.02 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 809 T 7.81 4.05 4.24 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 1.21 0.00 0.00 810 E 7.64 4.00 0.00 2.21 2.10 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 2.31 2.31 0.00 811 L 7.65 3.99 0.00 1.75 1.86 0.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 812 D 8.16 4.44 0.00 2.76 2.70 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 0.00 813 V 7.68 3.61 2.23 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 1.01 0.00 0.00 0.94 0.00 0.00 814 S 8.11 4.09 0.00 4.05 4.06 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 0.00 815 E 8.29 3.96 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.43 0.00 816 Q 7.95 3.94 0.00 2.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 817 V 7.80 3.65 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 1.17 0.00 0.00 1.05 0.00 0.00 818 Q 8.54 4.05 0.00 2.45 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 819 R 8.26 4.02 0.00 2.09 1.97 0.00 3.25 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 820 D 8.01 4.26 0.00 2.76 2.35 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.17 4.06 0.00 3.14 3.11 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 0.00 0.00 0.00 822 V 8.38 3.61 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 1.14 0.00 0.00 1.00 0.00 0.00 823 K 8.28 4.24 0.00 1.79 1.82 0.00 1.72 0.00 0.00 1.94 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.30 7.81 824 L 8.14 3.94 0.00 1.82 1.84 0.95 1.04 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 0.00 825 S 8.57 4.22 0.00 4.09 4.34 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 0.00 826 Q 8.38 4.02 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 827 T 8.01 3.94 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 828 L 8.00 3.99 0.00 1.86 1.74 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 829 Q 8.25 3.98 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.60 0.00 830 V 7.88 3.59 2.20 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 1.03 0.00 0.00 0.99 0.00 0.00 831 Q 8.24 4.01 0.00 2.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 832 L 8.16 3.99 0.00 1.81 1.72 0.93 0.92 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 0.00 833 E 8.38 3.95 0.00 2.08 2.08 0.00 0.00 0.00 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 2.40 0.00 834 R 7.99 3.97 0.00 1.98 1.98 0.00 3.22 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 835 I 7.71 3.85 2.06 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 1.41 0.70 0.91 0.00 0.00 836 R 7.92 3.89 0.00 1.91 2.14 0.00 3.25 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 837 Q 7.62 4.31 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 838 A 7.49 4.40 1.31 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 0.00 839 D 7.95 5.05 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.39 4.67 0.00 3.99 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 L 8.02 4.02 0.00 1.71 1.76 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 842 E 8.11 3.86 0.00 2.03 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 2.38 2.37 0.00 843 R 8.46 3.90 0.00 1.91 2.05 0.00 3.19 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 844 I 7.74 3.73 1.99 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 1.52 0.64 0.91 0.00 0.00 845 R 8.44 3.97 0.00 1.90 2.00 0.00 3.17 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 846 A 8.06 4.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.92 3.66 2.03 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 1.52 1.28 0.91 0.00 0.00 848 L 7.83 4.12 0.00 1.83 1.73 0.92 1.06 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 0.00 849 N 7.86 4.90 0.00 2.80 2.82 0.00 0.00 6.98 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 D 7.07 4.79 0.00 2.96 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 T 8.09 4.15 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 1.20 0.00 0.00 852 K 7.83 4.25 0.00 1.66 1.69 0.00 1.97 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.32 1.33 7.81 853 L 9.04 3.38 0.00 1.69 1.62 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 854 T 8.16 3.81 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 1.20 0.00 0.00