NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 731 D 4.5814 8.3644 120.3131 52.7575 41.7318 176.4411 732 K 4.0765 7.7283 119.3814 57.4063 32.7598 173.3574 733 V 3.6505 8.0555 114.4045 63.8443 31.8353 177.6565 734 A 3.8905 7.8758 120.2670 55.1884 18.3665 179.3425 735 V 3.3905 7.7716 116.1239 66.2136 31.3631 177.9069 736 K 3.8623 7.9682 118.9782 59.6479 31.9569 178.5187 737 N 4.3029 8.7271 116.8573 56.6848 38.3441 176.3990 738 A 3.8409 8.4627 122.5738 54.5217 18.1952 179.4533 739 I 2.8924 7.6727 115.7430 64.0773 37.4948 178.0824 740 R 3.8473 7.7148 118.4575 59.7303 29.8947 178.3299 741 A 3.9514 7.9936 120.0039 55.5416 18.2505 178.8612 742 A 3.8687 8.4916 119.6070 55.2806 18.4013 179.0036 743 Y 4.7955 8.1150 113.6780 61.6084 38.2727 179.4991 744 R 4.1855 8.2324 118.4971 59.6683 30.0447 178.9051 745 Q 3.8869 8.3352 118.4790 58.8483 29.1031 178.1731 746 V 3.2231 7.7710 118.4952 65.0699 32.1795 176.7154 747 F 4.8919 8.0719 115.3341 56.6872 38.8716 176.0142 748 E 4.2499 8.0996 117.0515 55.4147 27.0049 173.8272 749 R 4.3714 7.1421 115.0367 55.9946 33.6173 173.3917 750 D 4.7184 8.7339 121.5072 53.5808 41.2815 176.8382 751 L 4.1075 8.3145 124.5187 54.1535 42.4457 176.6168 752 E 4.1722 8.4575 121.7688 55.6966 30.3393 176.3702 753 P 4.1161 0.0000 0.0000 65.9443 31.0626 177.7653 754 Y 3.9372 8.1895 114.8540 58.7636 38.0285 177.2398 755 I 3.5175 7.9805 122.7523 63.1733 38.3084 177.4470 756 I 3.6268 7.2947 119.9524 64.5361 36.7715 177.9446 757 N 4.3223 8.8268 117.5861 56.5783 38.5079 176.5942 758 S 4.3634 7.3843 109.2173 59.2536 62.7757 174.1000 759 E 4.2240 7.8134 116.4376 57.3234 32.1073 176.4044 760 F 5.1632 8.2139 117.7472 57.2578 40.1962 178.0367 761 T 3.9857 8.3086 119.0731 66.6523 68.3889 175.7116 762 A 4.0296 8.0180 122.1268 55.3906 18.4937 179.4674 763 L 4.0847 8.0309 116.6878 58.0424 41.7231 179.5869 764 E 4.3264 8.4596 118.2710 59.5467 29.4447 179.3591 765 S 4.1587 8.3983 113.3505 61.3446 62.4313 176.3654 766 K 4.0356 8.7928 121.5894 59.2188 31.7776 179.0976 767 L 4.1108 8.4881 120.9697 58.3535 41.8658 178.9660 768 S 4.1646 7.8792 113.5644 61.8085 62.8784 175.8915 769 N 4.6702 8.0330 115.5758 51.8781 39.5941 175.1854 770 N 4.1805 7.6653 117.4405 54.9758 37.5361 173.2973 771 E 4.6115 8.8687 117.9144 56.4792 32.2840 177.0235 772 I 4.8390 7.4138 109.7310 58.3479 40.9157 174.8014 773 N 4.7862 9.6029 121.1069 51.6034 40.3015 176.2317 774 V 3.5886 8.2091 118.8455 65.9539 31.3317 177.4449 775 K 4.0721 8.3652 120.9044 59.0881 31.9648 178.6404 776 E 3.9211 8.6732 118.7575 59.3521 29.1656 179.0744 777 F 4.0063 8.1762 119.6279 61.2148 39.6914 176.9265 778 I 3.9573 8.2126 119.5907 64.5744 37.0479 178.1256 779 E 3.9240 8.4532 120.1317 58.9586 29.1147 179.0061 780 G 3.5820 7.9442 105.6407 47.5705 0.0000 175.4504 781 L 4.4593 7.7744 121.4432 57.6617 41.4930 179.7699 782 G 3.0039 8.0047 106.4278 47.7223 0.0000 174.0307 783 T 4.4458 7.5388 108.3582 61.1943 69.1622 174.4839 784 S 4.8117 7.8016 116.8868 57.1784 64.7960 174.7285 785 E 3.9502 9.0760 122.8785 59.8785 29.6654 178.2350 786 L 4.0510 8.5156 120.3435 58.6509 42.1440 178.8251 787 Y 4.4046 8.3680 116.9374 58.8611 38.9813 177.9491 *789 K 3.8281 8.0108 118.8461 55.7653 34.1171 176.8721 790 E 3.8656 8.3990 117.5738 57.5935 29.7518 177.0745 791 F 4.9861 8.4088 114.5484 57.2044 39.8775 174.5568 792 Y 4.3559 7.1241 119.8776 57.8706 40.9205 177.1157 793 A 4.1148 8.1914 124.5058 55.0955 18.9786 177.0205 794 P 4.0153 0.0000 0.0000 64.8750 31.3027 175.4827 795 Y 5.0127 7.1826 114.1234 55.1363 41.9296 173.0275 796 P 4.6623 0.0000 0.0000 62.9471 33.3246 176.2874 797 N 4.2017 8.7819 113.3288 57.6226 39.2815 178.1278 798 T 4.0293 7.7770 115.9750 65.6819 68.4114 176.3269 799 K 4.1488 7.8825 120.5456 58.5471 32.4264 178.5496 800 V 3.9198 7.1776 117.4157 66.3703 31.7179 177.5305 801 I 3.8439 7.8045 119.4986 64.2278 36.9908 177.9815 802 E 3.9148 8.2023 118.7488 58.3909 29.9791 179.2916 *804 G 4.2200 7.9678 109.4949 46.0629 0.0000 175.5291 805 T 3.8699 8.3411 117.4286 66.2234 68.4403 176.5750 806 K 4.2797 7.9027 122.5807 59.4587 32.1091 178.6633 807 H 4.0176 7.7846 114.5529 58.4384 28.6690 176.8922 808 F 4.6232 8.6096 117.8615 57.9820 39.7418 176.6664 809 L 4.6763 7.9763 115.0410 53.4844 43.1166 175.9468 810 G 4.2438 8.1597 106.7773 44.7658 0.0000 172.3107 811 R 4.4767 7.6675 112.9256 55.7117 32.8040 173.7160 812 A 4.6486 8.2527 121.1242 49.7002 20.5523 175.0933 813 P 4.5986 0.0000 0.0000 63.1935 31.5053 176.9484 814 L 4.0286 8.5595 125.3956 57.8431 41.5806 176.7907 815 N 4.6619 7.4198 112.8199 51.3801 39.5932 174.1077 816 Q 3.9813 8.5722 117.4239 59.3835 29.0958 178.2307 817 K 3.8592 8.1009 120.3283 59.2474 32.1515 178.2862 818 E 3.8312 9.0568 119.9857 59.2474 29.6587 178.3944 819 I 3.7797 7.3133 119.3289 64.9215 37.0340 178.0813 820 Q 3.9899 7.9777 116.9533 59.0941 28.8562 178.9120 821 Q 4.0758 7.8718 118.7798 59.4016 28.7602 178.5361 822 Y 4.4876 7.8248 117.5075 61.2323 37.8137 178.4399 823 N 4.2261 8.1397 118.0843 56.6163 39.0702 177.0415 824 Q 4.0013 8.1110 119.6044 58.9918 28.8300 178.6580 825 I 4.0943 7.6712 121.7009 63.7076 37.2272 178.1907 826 L 4.6294 8.4468 121.1512 57.4439 41.3427 179.6053 827 A 4.1374 7.8706 118.9386 54.6306 18.5000 179.3862 828 S 4.3878 7.9567 113.3551 60.5150 63.2947 176.5819 829 Q 4.7895 7.9104 121.1367 54.4839 30.4912 177.8176 830 G 3.8667 8.2559 107.8788 45.7784 0.0000 175.0181 831 L 4.1566 8.5510 119.0610 58.4780 42.2143 180.1299 832 K 3.8209 8.2165 117.6034 59.3980 31.9187 178.7799 833 A 4.1058 7.9851 120.4836 54.4365 18.2634 179.3716 834 F 4.3445 8.1482 118.9945 61.5226 39.6213 177.2115 835 I 2.9539 7.4183 117.5883 63.9914 37.2023 177.9321 836 G 3.7664 7.5285 106.0863 47.7799 0.0000 175.7030 837 A 4.0078 7.3004 118.2963 53.0816 18.4946 178.2375 *839 V 3.1934 7.6756 120.9811 63.5859 33.0351 175.9458 840 N 4.7157 8.3076 114.6999 52.9141 39.7100 176.2480 841 G 4.0938 7.2869 116.6412 45.5285 0.0000 176.0105 *843 E 4.1622 8.8177 121.0444 56.2852 31.7292 177.2787 844 Y 3.7564 8.0182 118.6358 60.5295 38.8776 177.2125 845 L 4.2233 8.0681 121.3148 58.6146 42.0135 178.9100 846 Q 4.1319 8.0051 115.0583 58.3078 28.8492 177.5590 847 T 3.9463 7.3476 116.4894 65.0897 69.3621 176.2910 848 F 4.7334 8.1156 118.8561 57.6158 39.6741 177.6467 849 G 3.9701 7.7807 107.4305 45.0211 0.0000 172.7242 850 E 4.4329 8.6054 115.7920 57.4260 30.0504 177.3426 851 D 4.8969 8.1365 115.8152 54.0994 42.2581 175.8643 852 T 4.5346 7.3175 115.1202 61.7024 70.2342 174.3541 853 V 3.8469 7.9684 124.6313 61.0400 32.4911 174.2445 854 P 2.0000 0.0000 0.0000 62.2907 31.7621 174.8535 855 Y 4.6994 5.9900 116.7656 54.9963 40.9412 174.2086 856 R 4.3232 8.6634 121.3963 56.7588 30.6685 176.6528 857 R 4.4193 8.9537 124.0198 56.4690 30.2136 176.0910 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 731 D 8.36 4.58 0.00 2.79 2.86 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 0.00 732 K 7.73 4.08 0.00 1.91 1.81 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.58 7.81 733 V 8.06 3.65 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 0.77 0.00 0.00 0.91 0.00 0.00 734 A 7.88 3.89 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 0.00 735 V 7.77 3.39 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 0.91 0.00 0.00 0.88 0.00 0.00 736 K 7.97 3.86 0.00 1.93 1.87 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.62 7.81 737 N 8.73 4.30 0.00 2.80 2.79 0.00 0.00 6.91 7.31 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 0.00 738 A 8.46 3.84 1.10 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 0.00 739 I 7.67 2.89 1.63 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.32 0.49 0.00 0.00 740 R 7.71 3.85 0.00 1.82 2.05 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 741 A 7.99 3.95 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 0.00 742 A 8.49 3.87 1.28 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 0.00 0.00 743 Y 8.12 4.80 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 0.00 744 R 8.23 4.19 0.00 2.09 2.01 0.00 3.33 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.82 0.00 745 Q 8.34 3.89 0.00 1.88 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 746 V 7.77 3.22 1.64 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 -0.05 0.00 0.00 0.48 0.00 0.00 747 F 8.07 4.89 0.00 3.44 3.22 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 0.00 748 E 8.10 4.25 0.00 2.28 2.11 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 2.28 2.29 0.00 749 R 7.14 4.37 0.00 1.89 2.04 0.00 3.29 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 750 D 8.73 4.72 0.00 2.76 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 0.00 751 L 8.31 4.11 0.00 1.12 1.21 -0.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 752 E 8.46 4.17 0.00 1.81 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 2.52 2.41 0.00 753 P 0.00 4.12 0.00 2.22 2.16 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 754 Y 8.19 3.94 0.00 3.12 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 0.00 755 I 7.98 3.52 1.49 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.36 0.53 0.00 0.00 756 I 7.29 3.63 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.34 1.15 0.00 0.00 757 N 8.83 4.32 0.00 2.84 2.91 0.00 0.00 7.14 7.45 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 0.00 758 S 7.38 4.36 0.00 3.70 3.99 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 0.00 0.00 0.00 759 E 7.81 4.22 0.00 1.65 1.12 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 0.00 1.88 1.96 0.00 760 F 8.21 5.16 0.00 3.19 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 0.00 761 T 8.31 3.99 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 1.26 0.00 0.00 762 A 8.02 4.03 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 0.00 763 L 8.03 4.08 0.00 1.72 1.50 1.09 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 764 E 8.46 4.33 0.00 2.48 2.15 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 2.74 2.97 0.00 765 S 8.40 4.16 0.00 3.97 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 0.00 766 K 8.79 4.04 0.00 2.02 1.91 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.71 7.81 767 L 8.49 4.11 0.00 1.98 1.81 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 768 S 7.88 4.16 0.00 4.04 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 0.00 769 N 8.03 4.67 0.00 2.90 2.85 0.00 0.00 7.25 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 0.00 770 N 7.67 4.18 0.00 2.77 2.77 0.00 0.00 6.92 7.27 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 0.00 771 E 8.87 4.61 0.00 2.15 1.98 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 2.26 2.39 0.00 772 I 7.41 4.84 2.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 0.95 0.00 0.00 773 N 9.60 4.79 0.00 3.13 3.02 0.00 0.00 6.84 6.54 0.00 0.00 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 V 8.21 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 1.13 0.00 0.00 0.88 0.00 0.00 775 K 8.37 4.07 0.00 1.97 2.02 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 0.97 7.81 776 E 8.67 3.92 0.00 2.21 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 2.31 2.55 0.00 777 F 8.18 4.01 0.00 3.07 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 778 I 8.21 3.96 2.26 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.32 1.11 0.00 0.00 779 E 8.45 3.92 0.00 1.98 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 2.13 2.06 0.00 780 G 7.94 3.58 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 0.00 0.00 0.00 781 L 7.77 4.46 0.00 1.95 1.67 0.17 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 782 G 8.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.54 4.45 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 1.09 0.00 0.00 784 S 7.80 4.81 0.00 4.41 4.58 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 0.00 785 E 9.08 3.95 0.00 1.96 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 2.33 2.25 0.00 786 L 8.52 4.05 0.00 1.75 1.94 0.90 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 787 Y 8.37 4.40 0.00 3.67 3.35 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 *789 K 8.01 3.83 0.00 1.91 1.85 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.67 7.81 790 E 8.40 3.87 0.00 1.36 1.12 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 0.00 2.23 2.50 0.00 791 F 8.41 4.99 0.00 2.30 3.12 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 0.00 0.00 0.00 0.00 792 Y 7.12 4.36 0.00 3.15 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 0.00 793 A 8.19 4.11 1.29 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 0.00 0.00 794 P 0.00 4.02 0.00 0.49 1.60 0.00 3.19 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 795 Y 7.18 5.01 0.00 2.88 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 0.00 796 P 0.00 4.66 0.00 2.21 2.17 0.00 3.85 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 797 N 8.78 4.20 0.00 2.74 2.79 0.00 0.00 6.96 7.22 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 0.00 798 T 7.78 4.03 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 1.29 0.00 0.00 799 K 7.88 4.15 0.00 1.69 1.86 0.00 1.48 0.00 0.00 1.48 0.00 0.00 2.73 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.98 0.80 7.81 800 V 7.18 3.92 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 1.04 0.00 0.00 0.76 0.00 0.00 801 I 7.80 3.84 1.89 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.72 1.07 0.00 0.00 802 E 8.20 3.91 0.00 2.03 1.98 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 2.35 2.52 0.00 *804 G 7.97 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 0.00 805 T 8.34 3.87 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 1.39 0.00 0.00 806 K 7.90 4.28 0.00 1.77 1.58 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.24 1.25 7.81 807 H 7.78 4.02 0.00 2.50 2.29 0.00 5.74 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 808 F 8.61 4.62 0.00 2.96 3.10 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 0.00 809 L 7.98 4.68 0.00 1.85 1.73 1.11 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 810 G 8.16 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 0.00 0.00 0.00 0.00 811 R 7.67 4.48 0.00 2.01 2.04 0.00 2.79 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 812 A 8.25 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 0.00 813 P 0.00 4.60 0.00 2.11 2.15 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 814 L 8.56 4.03 0.00 1.64 1.76 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 815 N 7.42 4.66 0.00 2.89 2.91 0.00 0.00 5.89 7.24 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 0.00 816 Q 8.57 3.98 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 817 K 8.10 3.86 0.00 1.84 1.94 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 818 E 9.06 3.83 0.00 1.96 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 2.18 1.97 0.00 819 I 7.31 3.78 2.07 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 1.58 0.68 0.92 0.00 0.00 820 Q 7.98 3.99 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.95 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 821 Q 7.87 4.08 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.66 0.00 822 Y 7.82 4.49 0.00 3.07 2.55 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 0.00 0.00 0.00 0.00 823 N 8.14 4.23 0.00 3.00 2.90 0.00 0.00 7.12 6.92 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 0.00 824 Q 8.11 4.00 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 825 I 7.67 4.09 2.20 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 1.06 0.00 0.00 826 L 8.45 4.63 0.00 1.86 1.77 0.78 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 827 A 7.87 4.14 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 0.00 828 S 7.96 4.39 0.00 4.12 4.21 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 0.00 829 Q 7.91 4.79 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 830 G 8.26 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.55 4.16 0.00 1.73 1.71 1.11 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 832 K 8.22 3.82 0.00 1.83 1.84 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.51 7.81 833 A 7.99 4.11 1.45 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 0.00 0.00 834 F 8.15 4.34 0.00 2.93 3.32 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 0.00 835 I 7.42 2.95 1.49 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.58 0.00 0.00 0.00 836 G 7.53 3.77 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 0.00 0.00 0.00 837 A 7.30 4.01 1.53 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 0.00 0.00 0.00 *839 V 7.68 3.19 1.72 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 0.32 0.00 0.00 0.64 0.00 0.00 840 N 8.31 4.72 0.00 2.70 2.75 0.00 0.00 7.02 7.63 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 0.00 841 G 7.29 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 *843 E 8.82 4.16 0.00 2.04 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 2.19 2.22 0.00 844 Y 8.02 3.76 0.00 3.09 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 0.00 845 L 8.07 4.22 0.00 1.89 1.71 0.99 0.78 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 0.00 846 Q 8.01 4.13 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 847 T 7.35 3.95 3.19 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 0.21 0.00 0.00 848 F 8.12 4.73 0.00 2.16 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.78 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 0.00 0.00 0.00 850 E 8.61 4.43 0.00 2.09 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 2.41 2.38 0.00 851 D 8.14 4.90 0.00 2.66 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 0.00 852 T 7.32 4.53 4.54 0.00 0.00 0.00 0.00 0.00 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 0.00 853 V 7.97 3.85 1.98 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 0.66 0.00 0.00 0.82 0.00 0.00 854 P 0.00 2.00 0.00 1.61 1.31 0.00 3.47 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.54 0.00 855 Y 5.99 4.70 0.00 2.98 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 0.00 856 R 8.66 4.32 0.00 1.83 1.96 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 857 R 8.95 4.42 0.00 1.96 1.87 0.00 3.03 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 * Residues marked with a * may have inaccurate shift predictions.