NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 791 T 4.2474 8.1744 110.9475 61.1042 70.8873 173.4890 792 F 4.0413 8.2894 125.3223 57.4017 39.5169 172.6328 793 K 4.4244 7.7926 127.4125 54.8701 35.2972 176.1821 794 S 4.4301 7.8951 115.4969 56.3381 63.3176 171.6459 795 A 5.3022 8.0653 125.0642 49.6493 22.4692 175.4842 796 V 4.8625 8.6627 112.4330 59.4559 36.6861 174.3943 797 K 4.8443 8.8473 124.3396 54.2887 34.5158 175.2583 798 A 4.4087 8.6714 130.3644 52.3889 18.7836 177.7585 799 L 4.3269 8.9655 122.4097 55.4208 42.7018 176.8629 800 F 4.9972 8.0078 115.5459 55.5205 43.1230 174.2792 801 D 4.8653 8.9870 120.9295 54.9931 41.8764 175.3698 802 Y 4.4701 8.4556 122.2643 55.9463 42.2963 173.4215 803 K 4.3690 7.7679 127.9258 54.3329 33.4380 175.7283 804 A 4.2017 8.3252 129.7422 53.1345 18.2432 177.1821 805 Q 4.4412 9.6821 120.3274 55.7907 30.8957 175.8501 806 R 4.7679 7.6859 115.6836 53.7084 34.0382 175.7731 807 E 4.0052 8.8636 120.3712 58.9469 29.9056 177.1120 808 D 4.9666 8.1473 116.9252 53.1433 39.8498 175.0685 809 E 5.5602 7.8855 118.2135 55.3112 31.8839 175.4481 810 L 4.6866 9.3335 124.6390 55.0416 43.4202 175.9108 811 T 4.9406 8.5899 121.0315 61.8974 70.9160 173.3523 812 F 5.0934 8.4772 119.8940 56.2133 42.0224 172.8703 813 T 5.1185 8.3669 108.7463 59.1681 71.9068 173.5195 814 K 4.0484 8.8420 123.6756 58.8678 32.4293 177.1418 815 S 4.2748 8.9979 121.3976 57.9540 62.0342 169.3589 816 A 4.0791 7.6356 122.7170 52.2274 19.3448 176.5827 817 I 4.5694 8.2823 121.7913 59.9627 38.7039 175.1185 818 I 4.5572 8.4012 128.9765 59.7930 39.0614 175.2435 819 Q 4.8244 8.8996 125.2144 53.7995 32.4651 174.8141 820 N 4.1983 8.4344 114.7752 54.4339 36.0504 175.1724 821 V 4.2226 8.0190 117.6736 62.5562 32.8818 175.1374 822 E 4.3545 8.9582 129.6056 54.9591 31.0970 174.5514 823 K 3.5231 8.2320 126.4778 54.6230 33.3190 175.7822 824 Q 4.7771 8.2850 121.4814 54.0661 32.5386 175.0604 825 D 4.9407 8.8812 119.4451 54.6148 41.0366 177.1961 826 G 4.0079 8.3563 106.6807 45.4396 0.0000 175.4283 827 G 3.7493 8.6739 107.8739 44.3851 0.0000 173.1613 828 W 5.1858 7.9045 119.2296 54.6106 32.8356 174.5109 829 W 5.5306 8.9356 124.0765 54.8445 32.5504 174.6110 830 R 4.9573 8.2233 116.7732 54.9978 32.8346 175.0667 831 G 4.5567 8.3055 105.4617 46.5138 0.0000 170.9743 832 D 5.6609 8.3115 119.5968 52.7589 43.8286 175.1532 833 Y 4.6306 9.1201 121.8822 57.1243 43.0036 174.3273 834 G 3.3817 8.5612 113.1287 46.6196 0.0000 174.6512 835 G 3.8587 8.3087 105.6429 45.0323 0.0000 174.0765 836 K 4.5302 7.8521 119.4051 54.2012 34.0025 175.3368 837 K 4.7211 8.3102 123.1119 55.5217 33.7691 175.6856 838 Q 3.4401 8.8329 127.0047 57.0596 26.7931 173.7465 839 L 4.6762 7.5743 115.9748 53.5420 44.3569 176.8250 840 W 5.5403 9.2488 121.5495 56.5348 30.9054 175.5919 841 F 5.3909 9.3243 117.0406 55.1536 41.5572 171.7867 842 P 3.6838 0.0000 0.0000 61.6311 31.7050 178.0127 843 S 3.3805 7.8306 118.1686 60.4736 62.8301 175.4392 844 N 4.5021 7.7022 116.1797 53.7924 37.2216 174.8455 845 Y 4.5191 8.1057 116.6813 58.6036 38.6138 174.9862 846 V 5.0481 7.4253 112.2971 59.4647 36.2683 174.3069 847 E 4.7153 8.9561 123.1268 54.2293 31.7806 175.0209 848 E 4.4100 9.0700 126.9198 57.0486 30.3972 176.8671 849 M 4.3997 8.4103 124.7796 53.5988 31.9413 175.9971 850 I 3.8289 8.0853 124.4308 61.0517 38.1728 176.4406 851 N 4.4752 8.5610 120.2067 53.6574 38.4347 175.1154 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 791 T 8.17 4.25 4.26 0.00 0.00 0.00 0.00 0.00 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 0.00 792 F 8.29 4.04 0.00 3.08 3.03 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 0.00 0.00 0.00 793 K 7.79 4.42 0.00 1.68 1.50 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.42 7.81 794 S 7.90 4.43 0.00 3.76 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 0.00 795 A 8.07 5.30 1.24 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 0.00 0.00 0.00 796 V 8.66 4.86 2.31 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 1.00 0.00 0.00 0.94 0.00 0.00 797 K 8.85 4.84 0.00 1.73 1.60 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.25 1.29 7.81 798 A 8.67 4.41 1.13 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 0.00 0.00 799 L 8.97 4.33 0.00 1.46 1.03 0.97 0.78 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 0.00 800 F 8.01 5.00 0.00 2.97 2.94 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 0.00 0.00 0.00 801 D 8.99 4.87 0.00 2.67 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 0.00 802 Y 8.46 4.47 0.00 2.11 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 7.77 4.37 0.00 1.57 1.37 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.76 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.23 1.31 7.81 804 A 8.33 4.20 1.39 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 0.00 0.00 0.00 805 Q 9.68 4.44 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 806 R 7.69 4.77 0.00 1.88 1.73 0.00 2.98 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 807 E 8.86 4.01 0.00 1.92 2.01 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 2.32 2.40 0.00 808 D 8.15 4.97 0.00 3.16 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 E 7.89 5.56 0.00 2.27 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.35 0.00 810 L 9.33 4.69 0.00 2.11 2.05 1.15 0.98 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 0.00 811 T 8.59 4.94 4.32 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 0.00 0.00 0.00 1.25 0.00 0.00 812 F 8.48 5.09 0.00 2.55 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 0.00 813 T 8.37 5.12 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 1.27 0.00 0.00 814 K 8.84 4.05 0.00 1.73 1.80 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.33 7.81 815 S 9.00 4.27 0.00 3.98 4.16 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 0.00 0.00 0.00 0.00 816 A 7.64 4.08 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.28 4.57 1.89 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 1.34 0.92 0.89 0.00 0.00 818 I 8.40 4.56 1.50 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.02 0.69 0.00 0.00 819 Q 8.90 4.82 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.32 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 820 N 8.43 4.20 0.00 3.00 2.89 0.00 0.00 6.89 7.68 0.00 0.00 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 8.02 4.22 2.16 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 0.81 0.00 0.00 1.18 0.00 0.00 822 E 8.96 4.35 0.00 2.01 1.67 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 2.20 2.22 0.00 823 K 8.23 3.52 0.00 1.18 0.77 0.00 1.33 0.00 0.00 0.94 0.00 0.00 2.36 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.66 7.81 824 Q 8.29 4.78 0.00 2.47 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 7.24 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 825 D 8.88 4.94 0.00 2.74 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 0.00 826 G 8.36 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 0.00 827 G 8.67 3.75 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 0.00 0.00 0.00 828 W 7.90 5.19 0.00 3.22 3.20 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 0.00 829 W 8.94 5.53 0.00 2.14 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.22 4.96 0.00 1.33 0.66 0.00 2.21 0.00 0.00 2.93 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.30 0.00 831 G 8.31 4.56 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 0.00 832 D 8.31 5.66 0.00 2.69 2.57 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 0.00 833 Y 9.12 4.63 0.00 2.96 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.56 3.38 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 0.00 0.00 0.00 0.00 835 G 8.31 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 0.00 836 K 7.85 4.53 0.00 1.97 1.79 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.60 7.81 837 K 8.31 4.72 0.00 1.65 1.68 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.47 7.81 838 Q 8.83 3.44 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 839 L 7.57 4.68 0.00 1.81 1.80 1.10 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 840 W 9.25 5.54 0.00 3.39 3.36 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 0.00 841 F 9.32 5.39 0.00 3.15 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.68 0.00 1.90 0.97 0.00 2.47 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.61 0.00 843 S 7.83 3.38 0.00 2.72 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 0.00 844 N 7.70 4.50 0.00 2.65 2.78 0.00 0.00 6.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 845 Y 8.11 4.52 0.00 3.39 3.38 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 0.00 846 V 7.43 5.05 2.18 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 0.58 0.00 0.00 1.15 0.00 0.00 847 E 8.96 4.72 0.00 1.98 1.77 0.00 0.00 0.00 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 2.27 0.00 848 E 9.07 4.41 0.00 2.00 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 2.62 2.72 0.00 849 M 8.41 4.40 0.00 1.90 2.13 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 850 I 8.09 3.83 1.87 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 1.43 0.75 0.91 0.00 0.00 851 N 8.56 4.48 0.00 2.65 2.66 0.00 0.00 6.84 7.56 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