NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -4 G 3.9239 8.3393 109.7361 44.5079 0.0000 173.4461 -3 P 4.2854 0.0000 0.0000 60.3104 32.0315 174.5006 -2 M 4.3172 8.3267 117.3472 55.4682 33.8552 178.1758 -1 G 3.8275 8.2203 104.3455 43.9265 0.0000 172.9297 *755 M 4.3192 8.1669 121.5886 55.6333 33.2085 175.5018 756 Q 4.2496 8.4139 119.4844 56.9909 29.7224 176.3097 757 S 4.6687 7.7851 111.7494 57.1157 64.9860 173.2310 758 I 4.4157 7.7954 121.6001 59.5953 38.5737 177.3015 759 R 3.9618 8.5620 116.8899 57.4567 28.9054 176.5138 760 E 4.6376 7.8029 119.5102 56.2568 32.0678 174.8890 761 Q 4.7326 7.9454 114.6288 55.7637 31.6321 174.0199 762 S 4.8090 8.6855 117.9316 59.0731 63.9179 172.9026 763 C 4.7648 8.8733 122.0999 58.1374 35.4650 172.7630 764 R 4.6617 8.6341 123.9463 56.5703 30.6617 175.6263 765 V 4.8613 9.3718 118.6729 59.8119 36.7952 174.5273 766 V 4.4248 8.4756 120.1291 60.6836 34.8033 173.7589 767 T 4.6225 8.5235 121.1906 61.7119 70.6519 173.4007 768 C 4.5698 7.7938 128.3298 59.3479 31.8365 174.3423 769 K 4.0234 8.9573 126.6695 58.8739 31.7484 178.7816 770 T 4.0520 7.9453 116.1244 65.5803 68.8023 175.2892 771 C 4.4639 7.8373 116.0637 58.9369 29.4122 174.1940 772 K 3.9000 7.9122 117.7976 57.2430 29.6232 175.0469 773 Y 4.8510 7.3664 116.1674 55.8771 40.7940 174.1258 774 T 4.9719 8.2941 116.6279 62.4734 71.5323 172.7914 775 H 4.0509 8.6593 124.0983 55.3200 33.5363 174.1431 776 F 4.4615 7.4823 118.0941 59.8245 38.9573 175.8137 777 K 4.4617 7.4792 117.0327 54.3831 35.1756 173.7081 778 P 4.1816 0.0000 0.0000 62.1077 32.0005 177.1251 779 K 4.2123 8.2394 120.1218 56.2801 33.9602 178.3409 780 E 4.0033 8.7738 121.2474 59.8740 29.3207 179.9386 781 T 3.8984 7.8519 109.3987 65.1145 68.9588 176.3716 782 C 4.0478 7.9759 119.2162 62.2724 28.3010 176.1357 783 V 3.8815 8.2281 120.2859 66.1362 30.9434 178.4269 784 S 4.2803 8.0879 113.8989 61.6347 62.7855 175.4625 785 E 4.0656 8.4280 118.0111 56.8305 29.6571 175.7783 786 N 4.2751 7.5805 114.7119 54.5793 37.3274 173.7420 787 H 4.4408 8.1201 113.4619 56.0124 30.0463 176.1023 788 D 4.3920 8.1568 119.9327 53.9524 41.9755 175.6790 789 F 5.3547 8.0136 116.2133 55.6034 41.5053 173.2330 790 H 5.1441 9.0851 118.0863 54.1731 30.7267 173.8801 791 W 5.2224 9.0519 123.5223 56.4377 30.8451 174.9367 792 H 4.7319 8.9489 117.0990 55.2606 31.8092 172.0483 793 N 5.1494 8.9233 117.5085 53.3996 40.2349 173.9039 794 G 4.2451 8.9128 110.3870 45.5286 0.0000 171.2289 795 V 5.0842 8.3250 118.7846 60.7590 34.1758 175.0109 796 K 4.8798 8.1644 124.7439 55.1124 35.4090 175.4725 797 R 4.1128 8.6771 120.5694 54.2852 33.4596 174.4859 798 F 5.1007 7.8452 121.6808 55.9475 41.6777 174.8067 799 F 5.5343 9.1647 120.4081 55.7914 43.6658 173.6756 800 K 5.3071 9.4367 121.1881 55.2041 35.9698 174.5719 801 C 4.7637 9.1634 127.1305 56.9517 33.0223 172.8584 802 P 4.2465 0.0000 0.0000 65.5446 30.8714 177.1183 803 C 4.1580 7.7905 112.3882 58.9235 29.9458 174.2313 804 G 4.0381 8.1159 108.2257 44.9808 0.0000 173.6648 805 N 4.6598 8.1128 118.5647 53.9882 40.1903 173.6485 806 R 5.4948 8.5092 121.3444 55.3277 34.4404 173.9830 807 T 4.5155 8.3525 114.2049 61.7435 71.5233 171.8947 808 I 5.3318 8.1185 122.9757 59.8859 41.2900 174.6630 809 S 4.7980 9.3452 118.9871 56.9787 66.0922 174.4617 810 L 4.2366 8.4597 121.4515 55.8664 42.1978 176.9019 811 D 4.7787 7.7380 118.6193 52.4009 42.3516 177.0469 812 R 4.2056 7.9878 117.7743 57.9388 29.5175 176.6511 813 L 3.7772 7.2033 117.7380 53.2302 45.4861 172.5079 814 P 4.3079 0.0000 0.0000 62.3201 31.9968 176.3259 815 K 4.2710 8.3687 118.6701 58.4446 33.4215 177.6640 816 K 4.3510 7.9001 118.0891 56.5866 33.3558 176.4155 817 H 4.8491 8.7615 118.0358 55.4292 29.2335 174.8693 818 C 4.3551 8.6748 122.1070 59.6909 31.6838 174.9910 819 S 4.4066 8.8984 122.3471 60.8266 62.9688 175.0268 820 T 4.4283 7.9477 115.8298 64.2882 69.6563 174.8857 821 C 4.6429 8.0496 111.9781 57.0435 31.1448 174.8410 822 G 3.9458 7.9989 107.9978 45.0477 0.0000 173.3934 823 L 4.3510 7.2927 119.8150 54.3188 42.7396 174.9254 824 F 4.6152 8.3187 120.3424 56.8829 39.9415 175.0002 825 K 4.4404 7.2224 128.7500 55.1753 33.4810 176.8000 826 W 4.5583 7.3491 118.8610 57.1861 29.5756 175.2402 827 E 4.8534 9.4826 125.7554 54.0714 32.0727 174.8707 828 R 4.3026 8.8802 127.3087 56.5913 30.7062 175.6712 829 V 4.4900 8.5534 119.2423 59.6111 35.7140 175.9740 830 G 4.0030 8.2136 110.5631 45.0204 0.0000 173.3046 831 M 3.9161 8.3286 119.0522 55.5280 33.1450 177.1543 832 L 4.0175 7.8284 122.5195 54.5745 41.9053 178.4892 833 K 3.9789 8.5261 116.8340 56.2407 29.7785 175.2680 834 E 4.7241 7.1558 112.4894 55.4914 32.2910 176.1710 835 K 4.0539 8.7382 120.9378 59.1911 32.6076 176.9149 836 T 4.0571 7.1885 109.9690 61.7433 70.1159 172.7347 837 G 4.0607 8.3389 115.4124 44.1507 0.0000 171.6345 838 P 4.5114 0.0000 0.0000 61.7428 32.3031 176.1723 839 K 4.0431 8.3003 118.6844 56.7370 32.3651 176.4975 840 L 4.2769 8.4259 122.8348 55.2677 44.8369 175.6962 841 G 3.8082 9.5781 112.2758 46.3278 0.0000 173.7861 842 G 3.7609 8.2643 107.0538 46.4697 0.0000 173.4170 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 -4 G 8.34 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 -3 P 0.00 4.29 0.00 2.27 2.06 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 -2 M 8.33 4.32 0.00 2.15 2.12 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 2.56 2.53 0.00 -1 G 8.22 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *755 M 8.17 4.32 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 756 Q 8.41 4.25 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 757 S 7.79 4.67 0.00 3.98 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 0.00 758 I 7.80 4.42 1.88 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 1.47 0.81 0.91 0.00 0.00 759 R 8.56 3.96 0.00 2.04 2.05 0.00 3.03 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 760 E 7.80 4.64 0.00 1.99 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 2.28 2.34 0.00 761 Q 7.95 4.73 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.10 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 762 S 8.69 4.81 0.00 3.80 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 0.00 763 C 8.87 4.76 0.00 3.01 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 0.00 764 R 8.63 4.66 0.00 1.96 2.01 0.00 3.27 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.90 0.00 765 V 9.37 4.86 2.02 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 0.76 0.00 0.00 0.66 0.00 0.00 766 V 8.48 4.42 0.67 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 -0.11 0.00 0.00 0.01 0.00 0.00 767 T 8.52 4.62 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 1.12 0.00 0.00 768 C 7.79 4.57 0.00 2.40 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 769 K 8.96 4.02 0.00 1.63 1.73 0.00 1.59 0.00 0.00 1.33 0.00 0.00 2.68 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.26 7.81 770 T 7.95 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 771 C 7.84 4.46 0.00 3.09 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 0.00 772 K 7.91 3.90 0.00 1.92 1.93 0.00 1.53 0.00 0.00 1.78 0.00 0.00 3.16 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.35 7.81 773 Y 7.37 4.85 0.00 2.98 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 0.00 774 T 8.29 4.97 4.20 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 1.19 0.00 0.00 775 H 8.66 4.05 0.00 3.20 3.16 0.00 5.58 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 776 F 7.48 4.46 0.00 3.15 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 0.00 777 K 7.48 4.46 0.00 1.96 1.91 0.00 1.67 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.47 7.81 778 P 0.00 4.18 0.00 1.69 0.52 0.00 3.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.44 0.00 779 K 8.24 4.21 0.00 1.82 1.77 0.00 1.57 0.00 0.00 1.36 0.00 0.00 2.66 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.40 7.81 780 E 8.77 4.00 0.00 2.07 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 2.43 2.47 0.00 781 T 7.85 3.90 4.25 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 1.22 0.00 0.00 782 C 7.98 4.05 0.00 3.31 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 783 V 8.23 3.88 2.29 0.00 0.00 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 1.12 0.00 0.00 784 S 8.09 4.28 0.00 4.07 3.93 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 0.00 785 E 8.43 4.07 0.00 1.90 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 2.45 2.40 0.00 786 N 7.58 4.28 0.00 2.94 2.91 0.00 0.00 7.46 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 787 H 8.12 4.44 0.00 3.26 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 788 D 8.16 4.39 0.00 2.52 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 F 8.01 5.35 0.00 2.75 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 0.00 790 H 9.09 5.14 0.00 3.08 3.27 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 791 W 9.05 5.22 0.00 3.17 3.18 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 0.00 0.00 0.00 0.00 792 H 8.95 4.73 0.00 3.27 3.42 0.00 5.45 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 793 N 8.92 5.15 0.00 2.81 2.79 0.00 0.00 6.72 8.02 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 0.00 794 G 8.91 4.25 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 0.00 0.00 0.00 795 V 8.32 5.08 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 0.88 0.00 0.00 0.94 0.00 0.00 796 K 8.16 4.88 0.00 1.78 1.83 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.57 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.27 0.81 7.81 797 R 8.68 4.11 0.00 1.62 1.46 0.00 3.23 0.00 0.00 3.04 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 798 F 7.85 5.10 0.00 3.00 2.77 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 0.00 0.00 0.00 799 F 9.16 5.53 0.00 2.70 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 0.00 800 K 9.44 5.31 0.00 1.89 1.70 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.46 7.81 801 C 9.16 4.76 0.00 1.93 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 0.00 802 P 0.00 4.25 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.86 0.00 803 C 7.79 4.16 0.00 3.05 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 0.00 804 G 8.12 4.04 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 0.00 0.00 0.00 805 N 8.11 4.66 0.00 2.87 2.65 0.00 0.00 7.01 7.88 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 0.00 806 R 8.51 5.49 0.00 1.78 1.87 0.00 3.61 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 807 T 8.35 4.52 3.72 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 -0.22 0.00 0.00 808 I 8.12 5.33 1.80 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 1.44 0.80 0.75 0.00 0.00 809 S 9.35 4.80 0.00 3.76 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 810 L 8.46 4.24 0.00 1.55 1.65 0.71 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 811 D 7.74 4.78 0.00 2.77 2.50 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 0.00 812 R 7.99 4.21 0.00 2.06 2.11 0.00 3.25 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 813 L 7.20 3.78 0.00 1.74 1.54 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 814 P 0.00 4.31 0.00 1.77 1.47 0.00 2.75 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 0.00 815 K 8.37 4.27 0.00 1.86 1.96 0.00 1.54 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.42 7.81 816 K 7.90 4.35 0.00 2.04 1.92 0.00 1.50 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.57 7.81 817 H 8.76 4.85 0.00 3.24 3.47 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 818 C 8.67 4.36 0.00 2.44 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 0.00 819 S 8.90 4.41 0.00 3.99 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 0.00 820 T 7.95 4.43 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 1.20 0.00 0.00 821 C 8.05 4.64 0.00 2.97 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 0.00 822 G 8.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.29 4.35 0.00 1.83 1.82 0.70 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 824 F 8.32 4.62 0.00 2.62 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 0.00 825 K 7.22 4.44 0.00 1.43 1.54 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.22 1.29 7.81 826 W 7.35 4.56 0.00 2.73 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 0.00 827 E 9.48 4.85 0.00 2.10 1.97 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 2.24 2.33 0.00 828 R 8.88 4.30 0.00 1.99 1.88 0.00 2.31 0.00 0.00 2.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 829 V 8.55 4.49 2.09 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 0.78 0.00 0.00 0.97 0.00 0.00 830 G 8.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.33 3.92 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 832 L 7.83 4.02 0.00 1.41 1.46 0.70 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 833 K 8.53 3.98 0.00 1.86 1.92 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.26 1.31 7.81 834 E 7.16 4.72 0.00 2.05 1.82 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 2.23 2.14 0.00 835 K 8.74 4.05 0.00 1.76 1.90 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.41 7.81 836 T 7.19 4.06 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 0.00 837 G 8.34 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 0.00 0.00 0.00 838 P 0.00 4.51 0.00 2.18 2.07 0.00 3.77 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 1.98 1.98 0.00 839 K 8.30 4.04 0.00 1.76 1.80 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.43 7.81 840 L 8.43 4.28 0.00 1.53 1.48 0.92 1.11 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 0.00 841 G 9.58 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 0.00 0.00 0.00 842 G 8.26 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.