NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 729 L 4.3416 8.1844 120.6318 54.2536 43.2273 177.3808 730 D 4.3479 7.9256 113.1530 54.8999 43.5696 171.5344 731 E 4.2980 8.1310 117.9564 55.9510 31.9689 175.6358 732 D 4.7360 8.2323 118.0021 53.3898 40.3984 174.6163 733 I 4.2389 6.7928 116.7148 59.9180 41.2818 173.2706 734 I 4.0158 7.7052 124.4860 60.4732 37.8190 175.2945 735 A 4.6604 8.1357 125.5733 50.1830 20.3388 177.7970 736 E 4.0472 8.8963 122.5820 59.4233 29.7343 179.1753 737 E 4.0495 8.2838 116.8707 58.5786 29.5739 177.1132 738 N 4.8754 9.1624 113.7818 52.7137 39.6318 174.2551 739 I 4.0276 7.3331 120.1144 60.3067 37.4052 175.5359 740 V 4.1342 8.1707 126.1889 60.9572 31.7292 175.5901 741 S 4.5291 8.4364 123.4775 58.5702 63.7150 173.7795 742 R 4.6117 9.6166 121.6716 55.4107 30.9653 177.8647 743 S 4.5369 8.6890 112.9813 58.1615 65.9577 174.5044 744 E 4.1330 7.4924 121.5113 54.7815 28.2365 174.6618 745 F 5.3098 7.6902 123.3112 53.9337 38.7902 173.8034 746 P 4.5756 0.0000 0.0000 63.0090 32.2253 176.6953 747 E 4.7086 8.7693 118.6676 57.3231 30.4656 176.6329 748 S 4.8928 7.8614 111.5909 57.1030 65.6485 173.1452 749 W 4.7106 8.4158 117.8147 56.9111 30.1807 172.8276 750 L 3.9179 8.8581 116.1779 55.5862 39.8600 175.0305 751 W 4.4801 8.2761 125.1126 56.3591 29.6183 173.5611 752 N 4.8789 7.4644 118.7503 51.4724 41.2277 174.6544 753 V 4.2947 7.9988 117.8109 61.3717 33.4634 174.2481 754 E 4.7744 8.5894 125.9243 54.4776 32.4974 175.2123 755 D 4.8271 8.2674 119.8292 52.6360 43.8965 177.5626 756 L 5.1165 8.2496 125.5342 53.9189 39.5629 176.8798 757 K 4.3136 7.6838 116.3450 56.1807 33.2580 177.2097 758 E 4.0855 7.7110 119.3511 55.2498 30.0172 174.3974 759 P 4.5330 0.0000 0.0000 61.8544 30.7918 174.9407 760 P 4.2724 0.0000 0.0000 62.9645 31.8652 176.6403 761 K 4.3879 8.0108 120.0517 55.9027 35.1339 176.1629 762 N 4.1095 9.7168 121.5933 54.4355 35.7513 175.5677 763 G 3.8712 8.6017 104.4729 45.6025 0.0000 174.5933 764 I 4.3439 7.0058 120.2460 58.6968 37.9306 175.3071 765 S 4.2399 8.4067 120.8616 58.8462 63.3601 174.5142 766 T 4.5184 8.2388 119.4501 61.6091 71.3531 173.2019 767 K 4.5255 8.5957 127.1531 54.3386 34.3877 174.7842 768 L 4.6039 8.3522 125.4246 53.3102 43.1563 175.6482 769 M 4.5381 8.4672 122.8338 53.3946 34.3045 174.9826 770 N 4.6275 8.6767 122.3202 51.9655 38.9720 173.6532 771 I 4.6512 7.9248 118.5493 58.8327 40.2873 175.0078 772 F 4.6464 8.7204 120.9316 55.4390 40.2260 175.9580 773 L 3.8740 8.3914 125.9128 54.5697 41.9827 177.1575 774 K 4.0617 7.3134 120.5714 55.1759 33.2032 177.9262 775 D 4.0890 7.7684 120.4156 57.1121 40.9447 178.0531 776 S 4.4411 7.6844 115.2632 59.1244 63.2706 173.8696 777 I 4.4871 7.8775 125.0120 60.6157 36.6728 174.4993 778 T 4.1878 7.5123 121.1432 61.5667 71.2047 170.9741 779 T 4.6831 8.0327 116.7856 61.7036 71.0347 174.1307 780 W 4.6273 8.9223 127.1850 56.1838 30.9349 175.1472 781 E 4.7880 8.9773 124.5686 54.6376 31.2023 174.8366 782 I 4.2878 8.4008 129.0695 59.9436 38.9876 174.6828 783 L 5.0687 8.5664 128.5021 53.0639 44.4876 175.0319 784 A 4.7789 8.5920 127.0454 50.0264 22.0024 174.8351 785 V 4.9298 8.3292 121.1889 60.9324 34.6113 174.6861 786 S 4.8250 8.7171 121.2761 56.6382 65.9232 172.5035 787 M 5.1751 8.5675 121.7834 53.9140 33.8506 174.2974 788 S 4.8207 9.4170 121.5036 56.3566 65.4311 174.6443 789 D 4.9653 8.9534 125.8008 55.6905 39.8781 177.9729 790 K 4.0920 7.9001 119.5234 59.0578 32.0952 178.1008 791 K 4.3977 8.0607 113.7512 55.4795 34.1953 178.1804 792 G 3.8264 9.4456 107.2248 45.1474 0.0000 172.6517 793 I 5.0529 7.8287 122.6238 60.1284 40.1152 176.5001 794 C 4.3687 8.0162 122.2345 58.7667 33.5168 172.7269 795 V 4.2063 8.5050 126.8257 61.9360 30.1520 175.0350 796 A 4.1542 8.4250 128.7577 51.7982 19.0404 176.9019 797 D 4.5145 8.6109 119.2524 53.8212 41.6260 174.7664 798 P 4.7958 0.0000 0.0000 62.6458 32.7062 176.0375 799 F 4.9222 8.8050 123.4609 56.8964 42.4123 173.4211 800 E 4.7939 8.6012 125.5324 55.3447 31.2728 176.0225 801 V 4.1819 8.3444 121.8963 61.6300 35.0174 173.9906 802 T 4.7910 8.6061 124.8509 61.9850 70.2496 174.0685 803 V 4.1666 8.1683 127.8748 62.1706 33.0215 174.9439 804 M 4.7390 8.1756 126.5002 55.7321 34.9188 172.7650 805 Q 4.7594 8.3029 116.1096 55.4612 31.9575 174.3684 806 D 4.7713 8.7786 122.3780 56.8246 42.1513 176.1035 807 F 5.6118 8.1650 118.7511 55.8094 42.8057 173.4457 808 F 4.3768 6.7018 117.9949 56.5650 40.6578 172.0717 809 I 4.9156 9.6255 120.4864 59.6431 39.5784 175.5244 810 D 4.6902 9.4857 126.2086 52.6647 42.7717 175.0201 811 L 4.4557 8.4073 129.4868 54.3329 41.7909 175.9494 812 R 4.3592 8.3108 125.9120 54.7976 29.1111 176.0169 813 L 4.3741 8.0425 122.9538 52.8631 43.1380 175.4800 814 P 4.7065 0.0000 0.0000 61.7406 33.7910 175.2840 815 Y 4.3437 8.6576 118.2373 60.6056 38.8440 175.7646 816 S 4.7167 7.7183 111.2451 57.3705 65.7386 174.3328 817 V 4.4590 8.7041 116.7540 59.6969 35.2247 174.5425 818 V 4.7322 7.9966 121.7370 60.9440 33.2824 174.9480 819 R 4.0187 8.3711 127.8501 58.5544 30.1470 175.8660 820 N 4.5311 9.3390 121.4362 53.4104 36.8178 173.7103 821 E 4.6137 7.8783 117.7565 54.5439 31.3649 175.1958 822 Q 4.5934 8.4774 123.7624 55.1940 30.5340 175.1069 823 V 4.5303 8.2390 118.4622 59.9320 35.0643 173.7521 824 E 4.7577 8.4500 122.1396 55.3842 31.3645 175.8388 825 I 4.2049 8.6662 121.4873 60.5836 39.7236 174.9559 826 R 5.0120 8.4920 121.8946 54.4501 33.1171 174.5424 827 A 4.7207 8.8829 126.6740 50.8394 20.4496 175.9266 828 V 4.3401 8.6778 123.7381 61.9276 33.4697 174.6533 829 L 4.7272 8.7926 128.8719 53.4885 43.5258 174.9763 830 Y 4.2209 8.1995 122.6232 56.2435 39.9375 174.4726 831 N 4.7266 8.4788 123.2505 51.8631 40.7338 173.3432 832 Y 4.8182 9.0519 125.1437 57.7891 38.8595 176.3559 833 R 4.0036 8.7224 120.2641 56.1900 30.7144 177.2222 834 Q 3.8903 9.0267 122.0318 59.2731 29.0637 178.1734 835 N 5.0550 8.5237 117.5152 48.4554 38.1230 173.2266 836 Q 4.7771 7.3122 117.9976 56.2074 30.8103 174.7397 837 E 4.4046 9.0746 120.8304 56.3325 31.1696 175.6278 838 L 4.7039 8.5528 121.2377 52.9476 44.7289 175.2888 839 K 4.9022 8.5597 124.4553 54.8793 34.1628 174.6867 840 V 5.0454 8.9675 127.8797 60.2183 34.7001 174.5715 841 R 4.8516 8.2907 127.7422 54.2950 30.5587 174.8584 842 V 4.6075 8.0175 126.0066 60.3735 34.6385 174.8595 843 E 5.1008 9.0398 123.4532 55.1501 33.1778 173.5912 844 L 4.2951 8.2392 130.0484 53.9711 42.3064 176.3766 845 L 4.1912 8.3198 127.2102 54.8256 42.4351 176.8537 846 H 4.2836 8.6752 121.7885 55.9202 30.7180 174.3004 847 N 4.8265 8.2223 123.9108 50.8797 40.9481 172.6246 848 P 4.1305 0.0000 0.0000 65.9930 31.3377 176.7499 849 A 4.3389 8.1634 119.7722 52.0374 18.2905 175.9362 850 F 5.1842 8.1451 115.3853 57.2207 43.2357 174.3790 851 C 4.7567 9.5872 123.2717 57.9632 32.2810 172.5338 852 S 4.7817 8.2567 119.8098 55.7142 66.5478 175.0448 853 L 3.9715 8.7531 117.9410 55.9503 41.2543 176.7099 854 A 4.6752 8.1426 123.5450 50.4771 20.7064 176.7302 855 T 4.6889 8.4863 113.3830 59.3043 71.5363 175.2627 856 T 3.7191 8.2795 111.8579 64.2294 68.5429 174.5657 857 K 4.2963 7.4747 117.5893 57.6994 33.7795 176.5449 858 R 4.1033 8.3665 119.7735 55.8695 30.5342 176.3942 859 R 4.6275 8.3296 124.0964 55.6973 31.5937 175.5423 860 H 5.0746 8.5078 118.9345 54.4869 31.0715 171.9334 861 Q 5.2404 8.4888 121.7829 53.2672 31.3153 174.5267 862 Q 4.7390 8.5169 118.6870 54.5231 32.9658 174.1955 863 T 5.0203 8.3143 115.6657 62.2100 71.2342 174.2264 864 V 4.5984 9.3041 119.2711 59.7208 36.4690 174.6716 865 T 4.9917 8.4055 118.0309 62.0174 71.0388 173.5915 866 I 4.3875 8.3393 127.6127 58.7329 39.3354 174.0985 867 P 4.6295 0.0000 0.0000 62.1425 32.2109 173.9803 868 P 4.4488 0.0000 0.0000 61.1466 32.6094 176.3525 869 K 3.7947 7.5202 118.6033 56.3965 30.2094 173.4181 870 S 4.6592 6.8156 112.0075 58.3014 67.9723 176.5290 871 S 4.8177 8.6520 113.6815 56.5862 65.2975 173.0405 872 L 4.5436 8.3310 125.1715 53.3154 44.0928 174.8619 873 S 4.6763 8.4685 120.9573 57.2764 63.9799 173.4897 874 V 4.1286 8.6164 126.3589 60.1673 33.7558 172.6716 875 P 4.6964 0.0000 0.0000 62.8144 32.2604 175.8081 876 Y 4.7777 9.0827 121.3844 56.4530 41.5298 174.6835 877 V 4.8855 8.6621 118.1683 60.1839 33.6156 175.2930 878 I 4.9522 8.3229 116.5603 58.8993 42.2062 173.8826 879 V 4.7386 8.2143 120.5763 60.7767 34.5928 172.3569 880 P 4.3736 0.0000 0.0000 62.7047 31.8739 176.8707 881 L 4.8430 8.1409 122.3873 54.4275 44.1027 177.0441 882 K 4.4656 7.5107 117.2116 54.0835 35.6198 176.4848 883 T 3.9072 8.3383 113.2976 62.2932 69.6284 173.8728 884 G 3.6469 7.9340 108.9331 45.3690 0.0000 172.2768 885 L 4.5967 8.3748 124.2258 54.4964 42.3430 177.4158 886 Q 4.7791 8.4883 125.8140 54.1544 32.2192 174.6133 887 E 5.0458 8.8287 120.8056 54.6678 31.8142 174.9415 888 V 3.9030 8.1261 127.2696 61.9532 33.5646 174.4006 889 E 5.2614 8.3051 126.7129 53.6895 33.0826 173.8004 890 V 4.8795 8.4725 125.9467 61.0700 34.9946 174.1311 891 K 5.2920 8.9125 124.5410 54.7823 36.4947 175.1376 892 A 5.3608 9.2169 123.4666 49.7519 23.3308 174.8831 893 A 4.9112 8.2157 120.0912 50.2538 22.8207 175.7259 894 V 4.1581 7.8825 114.7416 60.4781 32.9384 175.8411 895 Y 4.4766 8.0948 121.8270 59.2684 38.1718 174.8662 896 H 5.5495 9.4953 121.8923 57.5561 28.4135 175.5105 897 H 4.7838 7.7074 114.1715 55.2296 30.5993 174.5309 898 F 4.7402 8.5442 114.6340 56.9390 39.4396 174.7802 899 I 4.8183 7.2518 122.0991 59.8227 40.3975 176.7486 900 S 5.2142 8.4529 118.4171 57.4919 65.8008 172.6301 901 D 5.0948 9.1767 120.6235 53.0521 45.2478 174.3295 902 G 4.4776 8.3996 106.5682 45.2508 0.0000 172.1693 903 V 4.7500 8.7155 125.1217 61.1977 34.5406 174.4792 904 R 4.8306 9.1783 127.8305 54.5245 30.3501 174.5249 905 K 4.7500 8.4859 123.3853 54.6817 35.0201 175.3936 906 S 5.1193 8.5499 117.3030 56.6998 66.2731 173.4747 907 L 4.8571 8.6423 122.7874 53.5751 44.2297 175.7039 908 K 4.1406 8.0124 119.4543 56.3847 33.0463 176.0854 909 V 4.6078 8.5715 126.0342 61.5584 33.3127 174.7773 910 V 4.5987 8.7728 127.6868 60.2752 34.7093 173.1267 911 P 4.8335 0.0000 0.0000 62.3626 32.6463 176.0383 912 E 4.1887 8.5154 117.5726 56.6052 29.9004 176.1049 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 729 L 8.18 4.34 0.00 1.67 1.78 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 730 D 7.93 4.35 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 E 8.13 4.30 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 732 D 8.23 4.74 0.00 2.70 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 0.00 733 I 6.79 4.24 2.15 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.63 0.96 0.00 0.00 734 I 7.71 4.02 1.80 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.27 0.95 0.00 0.00 735 A 8.14 4.66 1.33 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 0.00 0.00 0.00 0.00 0.00 736 E 8.90 4.05 0.00 1.97 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 2.39 2.31 0.00 737 E 8.28 4.05 0.00 1.99 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 0.00 2.33 2.41 0.00 738 N 9.16 4.88 0.00 2.84 2.85 0.00 0.00 7.01 7.33 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 0.00 739 I 7.33 4.03 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.68 0.95 0.00 0.00 740 V 8.17 4.13 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 0.82 0.00 0.00 0.95 0.00 0.00 741 S 8.44 4.53 0.00 3.93 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 0.00 742 R 9.62 4.61 0.00 2.00 1.71 0.00 3.34 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 743 S 8.69 4.54 0.00 3.89 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 0.00 744 E 7.49 4.13 0.00 1.75 1.69 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 2.21 2.15 0.00 745 F 7.69 5.31 0.00 3.01 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 0.00 746 P 0.00 4.58 0.00 2.16 2.19 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.09 0.00 747 E 8.77 4.71 0.00 2.06 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 2.35 2.38 0.00 748 S 7.86 4.89 0.00 4.01 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 0.00 749 W 8.42 4.71 0.00 3.46 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 0.00 750 L 8.86 3.92 0.00 1.01 1.23 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 751 W 8.28 4.48 0.00 3.38 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 0.00 752 N 7.46 4.88 0.00 2.81 2.70 0.00 0.00 6.36 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 0.00 753 V 8.00 4.29 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 0.76 0.00 0.00 0.83 0.00 0.00 754 E 8.59 4.77 0.00 1.91 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 2.15 2.19 0.00 755 D 8.27 4.83 0.00 2.59 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 756 L 8.25 5.12 0.00 1.61 1.61 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 757 K 7.68 4.31 0.00 1.72 1.83 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.38 7.81 758 E 7.71 4.09 0.00 2.05 1.86 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 2.56 2.38 0.00 759 P 0.00 4.53 0.00 2.03 2.02 0.00 3.69 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 2.01 2.09 0.00 760 P 0.00 4.27 0.00 2.02 1.99 0.00 3.62 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 761 K 8.01 4.39 0.00 1.73 1.64 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.62 7.81 762 N 9.72 4.11 0.00 2.86 2.90 0.00 0.00 7.24 7.65 0.00 0.00 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 G 8.60 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 0.00 764 I 7.01 4.34 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.97 0.88 0.00 0.00 765 S 8.41 4.24 0.00 3.83 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.24 4.52 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 1.17 0.00 0.00 767 K 8.60 4.53 0.00 1.95 1.62 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.39 7.81 768 L 8.35 4.60 0.00 1.64 1.55 0.90 0.84 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 0.00 769 M 8.47 4.54 0.00 1.96 1.92 0.00 0.00 0.00 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0.00 2.97 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 0.00 795 V 8.51 4.21 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 0.81 0.00 0.00 0.93 0.00 0.00 796 A 8.42 4.15 1.26 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 0.00 0.00 0.00 797 D 8.61 4.51 0.00 2.70 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 0.00 798 P 0.00 4.80 0.00 1.97 2.13 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 799 F 8.80 4.92 0.00 3.06 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.60 4.79 0.00 1.75 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 0.00 2.20 2.24 0.00 801 V 8.34 4.18 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 1.15 0.00 0.00 0.51 0.00 0.00 802 T 8.61 4.79 4.21 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.10 0.00 844 L 8.24 4.30 0.00 0.27 0.55 0.62 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 845 L 8.32 4.19 0.00 1.65 1.56 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 846 H 8.68 4.28 0.00 3.08 3.20 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 847 N 8.22 4.83 0.00 2.81 2.84 0.00 0.00 6.92 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 848 P 0.00 4.13 0.00 2.22 2.26 0.00 3.81 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 2.01 2.04 0.00 849 A 8.16 4.34 1.15 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 0.00 0.00 850 F 8.15 5.18 0.00 2.97 2.82 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 0.00 0.00 0.00 851 C 9.59 4.76 0.00 2.97 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 0.00 852 S 8.26 4.78 0.00 3.86 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 0.00 853 L 8.75 3.97 0.00 1.27 1.59 0.77 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 854 A 8.14 4.68 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 0.00 855 T 8.49 4.69 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 1.22 0.00 0.00 856 T 8.28 3.72 4.18 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 1.12 0.00 0.00 857 K 7.47 4.30 0.00 1.83 1.86 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.32 7.81 858 R 8.37 4.10 0.00 1.79 1.80 0.00 3.25 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 859 R 8.33 4.63 0.00 1.86 1.87 0.00 3.21 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 860 H 8.51 5.07 0.00 3.23 3.19 0.00 5.80 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 861 Q 8.49 5.24 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.56 0.00 0.00 0.00 0.00 0.00 2.23 2.20 0.00 862 Q 8.52 4.74 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 863 T 8.31 5.02 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 1.29 0.00 0.00 864 V 9.30 4.60 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 0.74 0.00 0.00 0.94 0.00 0.00 865 T 8.41 4.99 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 1.19 0.00 0.00 866 I 8.34 4.39 1.83 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 1.17 0.96 0.80 0.00 0.00 867 P 0.00 4.63 0.00 1.90 1.98 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 868 P 0.00 4.45 0.00 1.94 2.16 0.00 3.81 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 2.01 2.24 0.00 869 K 7.52 3.79 0.00 1.93 1.89 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.39 7.81 870 S 6.82 4.66 0.00 3.73 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 0.00 871 S 8.65 4.82 0.00 3.35 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 0.00 872 L 8.33 4.54 0.00 1.66 1.42 0.83 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 873 S 8.47 4.68 0.00 3.82 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.62 4.13 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 0.55 0.00 0.00 0.81 0.00 0.00 875 P 0.00 4.70 0.00 1.85 2.16 0.00 3.49 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 876 Y 9.08 4.78 0.00 2.81 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.66 4.89 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 0.74 0.00 0.00 0.96 0.00 0.00 878 I 8.32 4.95 1.94 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 1.09 1.33 0.83 0.00 0.00 879 V 8.21 4.74 2.13 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 1.01 0.00 0.00 0.97 0.00 0.00 880 P 0.00 4.37 0.00 2.04 1.87 0.00 3.67 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.27 0.00 881 L 8.14 4.84 0.00 1.41 1.59 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 882 K 7.51 4.47 0.00 1.55 1.57 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.22 1.23 7.81 883 T 8.34 3.91 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 1.20 0.00 0.00 884 G 7.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 L 8.37 4.60 0.00 1.63 1.61 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 886 Q 8.49 4.78 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.03 0.00 887 E 8.83 5.05 0.00 1.97 1.86 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 2.22 2.29 0.00 888 V 8.13 3.90 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 0.55 0.00 0.00 0.67 0.00 0.00 889 E 8.31 5.26 0.00 2.00 1.66 0.00 0.00 0.00 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 2.34 0.00 890 V 8.47 4.88 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 1.02 0.00 0.00 0.92 0.00 0.00 891 K 8.91 5.29 0.00 1.71 1.64 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.37 7.81 892 A 9.22 5.36 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 893 A 8.22 4.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 894 V 7.88 4.16 1.86 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 -0.12 0.00 0.00 0.64 0.00 0.00 895 Y 8.09 4.48 0.00 2.65 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 0.00 0.00 0.00 0.00 896 H 9.50 5.55 0.00 3.27 3.49 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 H 7.71 4.78 0.00 3.12 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 898 F 8.54 4.74 0.00 2.91 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 0.00 899 I 7.25 4.82 1.70 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.87 1.06 0.00 0.00 900 S 8.45 5.21 0.00 3.88 3.80 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 0.00 0.00 0.00 0.00 901 D 9.18 5.09 0.00 2.94 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 0.00 902 G 8.40 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 903 V 8.72 4.75 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 1.14 0.00 0.00 1.03 0.00 0.00 904 R 9.18 4.83 0.00 1.85 1.87 0.00 3.47 0.00 0.00 3.37 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 905 K 8.49 4.75 0.00 1.73 1.63 0.00 1.73 0.00 0.00 1.48 0.00 0.00 2.26 0.00 0.00 2.19 0.00 0.00 0.00 0.00 1.05 1.13 7.81 906 S 8.55 5.12 0.00 3.73 3.74 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 0.00 907 L 8.64 4.86 0.00 1.66 1.72 1.01 0.59 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 0.00 908 K 8.01 4.14 0.00 1.60 1.60 0.00 1.02 0.00 0.00 1.26 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.23 7.81 909 V 8.57 4.61 2.26 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 0.87 0.00 0.00 0.83 0.00 0.00 910 V 8.77 4.60 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 1.01 0.00 0.00 0.91 0.00 0.00 911 P 0.00 4.83 0.00 2.10 2.01 0.00 3.79 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 1.97 1.94 0.00 912 E 8.52 4.19 0.00 2.07 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 2.22 2.34 0.00