NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 804 D 4.6154 8.2076 120.3157 52.9914 40.6389 175.8774 805 D 4.3711 8.5816 116.4179 53.5860 39.0560 174.6230 806 D 4.5502 8.1176 120.0676 53.9489 42.5420 176.3136 807 L 4.3618 8.3697 127.0699 53.9232 42.9702 175.8983 808 V 4.5414 8.4053 119.0257 59.5711 35.8117 174.9965 809 D 4.6845 8.9425 122.0120 51.8672 41.4069 176.7661 810 A 4.0366 8.6184 121.7983 55.8102 18.1628 178.5255 811 E 4.2982 8.3803 111.9443 56.5102 29.5493 177.4735 812 G 3.8460 8.3823 107.4378 45.4353 0.0000 173.7612 813 N 4.6712 8.3214 117.5986 52.0909 39.5253 174.8868 814 L 4.6549 8.1413 121.0011 54.4175 43.1497 176.3904 815 V 4.1015 8.0958 120.4072 61.6204 32.9138 174.6202 816 E 4.3466 9.6356 128.5409 56.2956 30.3966 175.9076 817 N 4.3027 8.7273 124.9453 56.3895 38.8936 174.9935 818 G 4.0619 9.3556 115.9972 44.8071 0.0000 173.2968 819 G 4.0066 9.1878 108.8558 46.3184 0.0000 173.1265 820 T 4.7872 8.2036 112.8042 61.2092 70.4745 173.2240 821 Y 4.9732 8.8431 121.4019 56.7184 43.3852 173.2758 822 Y 4.8175 9.2565 119.0187 56.8766 40.5425 175.3882 823 L 5.1012 8.8537 124.1160 53.4644 42.2790 175.6155 824 L 4.9622 8.6313 123.7803 52.6146 44.7775 173.9015 825 P 5.1470 0.0000 0.0000 61.6631 33.3786 175.4413 826 H 4.7633 8.2064 116.9758 54.0938 29.9992 176.2083 827 I 3.5037 8.2284 113.0505 63.4453 37.3729 176.3015 828 W 4.7150 7.4933 121.1386 55.3469 28.6058 175.0860 829 A 4.5681 7.4206 118.6525 51.8294 21.8337 175.7119 830 H 4.8181 8.6130 116.7193 55.1586 31.0817 175.9371 831 G 3.9677 8.7973 108.3476 44.7773 0.0000 171.8343 832 G 4.2165 8.3327 107.6436 45.9539 0.0000 172.5739 833 G 4.7841 8.6845 111.1300 45.9131 0.0000 172.0648 834 I 4.8028 8.4710 120.1038 61.2668 38.8098 175.6456 835 E 4.8726 9.2238 125.5857 55.1519 33.9309 174.2087 836 T 5.2039 8.3013 108.6209 60.7097 71.9155 173.0084 837 A 4.5603 8.6984 122.4053 50.7126 23.3240 175.5388 838 K 4.7513 8.6586 121.8772 55.0171 31.7813 175.4493 839 T 4.6078 8.7729 116.8286 60.0409 72.1616 175.7268 840 G 4.1203 8.3745 109.7451 46.6033 0.0000 174.1612 841 N 4.6490 8.7224 120.4851 52.5490 38.0034 175.2770 842 E 3.9007 7.5002 117.7162 57.0848 29.8858 175.8576 843 P 4.4164 0.0000 0.0000 64.5977 31.8279 174.5351 844 C 4.8576 7.5999 110.5654 52.6932 44.7766 171.4381 845 P 4.4298 0.0000 0.0000 63.3691 30.3195 176.1123 846 L 4.7679 8.6613 121.9184 54.5019 44.0189 175.7609 847 T 4.7272 8.2055 117.9885 61.7821 70.7418 173.9443 848 V 4.3096 8.1769 127.2403 62.5726 32.5925 175.3400 849 V 4.7861 8.6270 120.2527 59.7784 36.8041 174.0142 850 R 4.7120 8.8136 122.6541 54.6274 31.0655 175.9390 851 S 4.3269 9.0804 122.2649 58.4572 62.9598 173.4306 852 P 4.4254 0.0000 0.0000 64.3771 31.9456 175.7283 853 N 4.5942 7.9575 118.7702 51.8321 37.8538 174.8331 854 E 4.8262 8.6925 124.5273 58.1321 29.4652 178.6042 855 V 3.8404 8.0812 118.1490 63.9990 32.2922 175.9341 856 S 4.3593 8.2311 115.9370 57.5313 62.9872 174.9574 857 K 3.8580 8.4134 126.2987 57.4877 32.6015 177.8920 858 G 4.1544 7.8302 105.8052 44.6448 0.0000 171.9312 859 E 4.9047 8.9779 120.2749 54.2381 31.5611 174.7741 860 P 4.2400 0.0000 0.0000 62.8898 32.8635 174.8584 861 I 4.8033 9.8864 124.5659 59.4321 39.7492 174.6463 862 R 4.4089 9.2527 128.8900 55.9049 31.4064 174.8843 863 I 4.8878 8.4384 127.4992 59.8066 39.5832 174.8895 864 S 5.2853 9.2039 123.2582 56.6748 66.5871 173.1940 865 S 4.8442 9.1363 117.3574 56.5057 64.5262 174.4037 866 Q 3.9733 8.6462 124.7472 58.4991 28.8584 177.2892 867 F 4.2448 7.6549 116.1002 58.0625 39.4775 175.3862 868 R 4.3335 8.4939 124.8912 56.4118 30.1194 176.3662 869 S 4.5974 7.4377 111.1971 56.4995 65.4260 174.1930 870 L 4.3189 8.1103 120.4285 56.4812 42.4886 176.4325 871 F 6.0587 7.0132 112.0982 53.7519 41.3277 174.5966 872 I 4.1992 8.3603 119.9552 60.0098 37.3209 174.9269 873 P 4.8436 0.0000 0.0000 61.7889 32.1706 176.0054 874 R 3.9865 8.4720 118.9587 57.5844 30.4145 176.7508 875 G 4.0745 8.8009 107.9092 46.3938 0.0000 173.3555 876 S 4.6346 7.5801 112.3335 57.2230 63.2332 173.9900 877 L 4.5255 8.1513 125.1414 54.5485 42.6032 176.5142 878 V 4.8027 8.5803 112.9144 59.9249 36.4047 174.3087 879 A 4.9893 8.9197 124.7776 50.5407 21.3631 176.0344 880 L 4.7616 8.5970 120.5877 52.7397 44.7747 175.9037 881 G 3.9173 8.3803 109.6778 44.4517 0.0000 171.6827 882 F 4.8524 8.5185 120.1025 56.9771 39.3374 176.8230 883 A 4.0022 8.7386 126.1133 53.4112 18.7165 177.2699 884 N 4.9332 7.1595 109.5494 51.2884 38.6723 171.5609 885 P 4.4806 0.0000 0.0000 61.9560 32.4397 174.9227 886 P 4.4123 0.0000 0.0000 61.9533 32.2568 175.9854 887 S 4.5473 8.5053 115.5783 60.0194 62.1301 173.0566 888 C 5.9120 8.1986 133.6702 55.8641 40.1230 172.8960 889 A 4.8991 7.1320 124.8490 50.4601 19.7840 176.8550 890 A 4.1685 9.0895 127.8579 54.6891 18.5747 177.2461 891 S 4.7502 7.6649 107.0529 56.3491 66.6565 171.6537 892 P 4.6386 0.0000 0.0000 62.3937 31.4796 175.1989 893 W 4.9660 7.0938 118.5965 56.6379 29.4960 176.4762 894 W 4.9592 9.6512 124.7903 57.4601 29.6808 175.5587 895 T 4.9107 9.0760 115.6285 60.9715 70.9792 172.4555 896 V 4.5486 8.3009 126.9736 61.7562 32.5055 175.1074 897 V 4.5693 8.8245 127.5620 60.7224 35.1540 174.1107 898 D 4.8987 8.6838 124.6253 54.5082 42.1592 175.1703 899 S 4.5714 8.1204 117.0202 57.0273 65.9098 174.8100 900 P 4.4924 0.0000 0.0000 65.2255 31.0253 177.4426 901 Q 4.2642 7.7701 115.1789 55.3391 28.8355 175.8113 902 G 3.7456 8.3017 106.5784 43.2775 0.0000 170.4210 903 P 4.6723 0.0000 0.0000 62.9485 32.1832 175.6466 904 A 4.8932 9.2013 127.2510 49.8626 22.4149 175.5117 905 V 4.4164 8.3176 121.7728 62.4508 32.6620 175.2335 906 K 5.1648 9.4787 126.9131 54.9754 37.0606 175.2534 907 L 5.1417 8.8923 121.3317 53.5774 44.0476 176.3239 908 S 4.8477 8.4512 114.0948 56.7900 65.8189 174.3040 909 Q 4.6060 8.7528 122.0316 55.5670 29.0208 175.7886 910 Q 4.6934 7.8310 116.9792 53.3129 32.1840 175.5073 911 K 4.0485 8.7203 120.6781 56.9295 32.6732 176.1855 912 L 4.7586 8.2926 122.6462 51.8136 43.7936 174.7770 913 P 4.3454 0.0000 0.0000 62.7076 31.8985 176.9559 914 E 3.6257 9.0039 121.0533 59.7466 29.0619 179.8040 915 K 4.0524 7.9683 116.7919 58.9867 32.8562 177.6923 916 D 4.7744 8.4533 119.2764 54.2733 41.2011 176.6034 917 I 4.6140 7.4206 111.5503 61.1618 40.0272 176.3526 918 L 4.2845 7.7308 122.8596 53.6606 39.9557 176.5486 919 V 4.3262 7.1949 108.6211 60.4959 35.1209 175.6347 920 F 5.7322 7.5115 118.9502 55.1433 42.7620 174.4507 921 K 4.5954 8.1173 119.6819 55.7113 35.3460 175.0387 922 F 5.2497 8.8170 126.1667 57.4020 40.7527 174.6855 923 E 4.8664 9.4065 121.1213 54.6868 32.9195 174.5652 924 K 3.5762 9.0624 128.4152 56.6451 33.4637 176.9011 925 V 3.7475 7.7011 126.4266 63.1483 30.3226 179.9290 926 S 3.0966 8.2382 114.0671 59.8007 66.9781 172.9129 927 H 4.4727 8.0441 124.6413 54.5465 29.4482 175.1483 928 S 4.6721 9.7805 116.5422 56.4644 64.5555 172.0151 929 N 4.3861 7.7721 127.9364 53.3252 36.3202 174.7339 930 I 4.6358 7.0034 117.7038 59.8184 40.5338 175.6246 931 H 4.6045 8.5883 121.9793 54.5380 27.6210 173.9154 932 V 4.7960 7.5165 122.6724 61.4384 34.2441 173.6297 933 Y 5.2951 9.2365 123.2665 56.6201 42.7121 174.7913 934 K 5.2830 9.4786 121.5979 54.4169 35.6518 174.7964 935 L 5.2312 8.6604 122.4730 53.5492 44.9249 174.9577 936 L 5.1433 9.3670 126.4882 53.3436 44.5623 174.5473 937 Y 5.2217 8.7783 123.5676 56.2448 40.3283 174.3215 938 C 4.9526 8.6965 124.0392 55.4877 43.2360 173.0881 939 Q 4.4192 8.7001 118.8226 54.4483 33.3581 173.9722 940 H 4.7354 8.6124 118.3754 54.3208 29.6141 175.8096 941 D 4.7110 8.2744 127.1509 53.6710 41.3144 176.3802 942 E 3.6859 8.0979 118.7416 57.5088 27.3590 176.1771 943 E 4.0400 7.9316 124.0083 58.9698 31.1919 176.9109 944 D 4.4645 7.8553 118.5123 53.4928 40.8935 175.4208 945 V 4.5808 8.0752 121.5411 61.3163 33.1848 174.6414 946 K 4.5093 8.8388 128.6709 54.6637 35.1994 174.2230 947 C 5.1584 8.4973 122.4394 54.1655 39.6711 173.8077 948 D 4.7560 7.0200 122.4786 50.2442 39.3817 176.9534 949 Q 4.4874 6.9568 114.7717 56.1860 33.7697 175.2051 950 Y 5.0301 8.5709 121.5495 57.1589 40.9845 173.9884 951 I 4.7219 8.7286 121.3794 60.1426 39.8385 175.7273 952 G 4.5817 10.2283 112.6691 44.9089 0.0000 170.3911 953 I 5.0757 7.7900 119.3918 59.8350 39.1868 175.6867 954 H 4.7199 9.3826 126.6064 53.8653 32.1110 172.0524 955 R 4.2965 8.5386 126.5926 56.4935 30.7568 175.5096 956 D 4.7774 8.7673 125.9746 51.4840 42.1586 177.3605 957 R 3.8573 8.7862 117.1810 59.8302 29.8734 177.6526 958 N 4.5816 8.1617 111.0809 53.3512 38.5676 176.0527 959 G 3.9731 8.3552 108.4969 44.9290 0.0000 173.9538 960 N 4.3698 8.2595 118.6063 53.5762 39.8301 175.0432 961 R 4.6715 8.5665 123.3671 54.8876 29.9141 175.2438 962 R 4.4164 8.4972 122.8901 55.9359 31.9836 175.5176 963 L 4.9622 8.5359 123.4930 54.1929 42.1220 176.3712 964 V 4.7566 9.0121 116.9014 59.5102 36.9017 175.4310 965 V 4.4846 8.4419 122.7673 62.4430 30.4143 174.9704 966 T 4.6272 8.1752 123.0337 61.4245 70.1477 174.6420 967 E 4.1321 9.0307 124.4921 59.3928 29.6992 176.5448 968 E 4.5796 7.4237 114.3078 56.0314 34.1824 173.3501 969 N 4.2158 8.7142 112.1938 53.3723 34.9284 173.1205 970 P 4.3033 0.0000 0.0000 63.3439 31.9764 175.5176 971 L 4.3467 8.8225 124.2688 54.9054 43.2259 175.0450 972 E 5.1177 8.9261 125.3937 54.6416 32.0213 175.3022 973 L 5.2312 9.5948 123.7024 52.9207 46.4092 175.6059 974 V 4.7115 8.7819 121.5277 61.1863 34.6264 174.1247 975 L 5.0384 8.5478 127.9439 53.5935 43.3704 175.0184 976 L 5.0424 8.7862 126.6142 52.6267 44.4907 175.4797 977 K 3.5463 9.0392 127.4932 56.7825 32.8130 176.1307 978 A 4.3811 7.8366 127.8207 51.9649 18.6680 176.0493 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 804 D 8.21 4.62 0.00 2.85 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 0.00 805 D 8.58 4.37 0.00 2.96 2.87 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 0.00 806 D 8.12 4.55 0.00 2.97 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 0.00 807 L 8.37 4.36 0.00 1.69 1.41 0.74 -0.45 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 0.00 808 V 8.41 4.54 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 0.77 0.00 0.00 0.85 0.00 0.00 809 D 8.94 4.68 0.00 3.23 2.92 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 0.00 810 A 8.62 4.04 1.38 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 0.00 811 E 8.38 4.30 0.00 2.13 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 2.35 0.00 812 G 8.38 3.85 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 0.00 0.00 0.00 813 N 8.32 4.67 0.00 3.29 2.78 0.00 0.00 7.00 6.32 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 0.00 814 L 8.14 4.65 0.00 1.54 1.64 0.63 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 815 V 8.10 4.10 1.92 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 0.46 0.00 0.00 0.46 0.00 0.00 816 E 9.64 4.35 0.00 2.12 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 2.41 2.39 0.00 817 N 8.73 4.30 0.00 2.64 2.77 0.00 0.00 7.50 8.04 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 0.00 818 G 9.36 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 0.00 819 G 9.19 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 0.00 820 T 8.20 4.79 4.05 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 1.13 0.00 0.00 821 Y 8.84 4.97 0.00 2.86 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 0.00 822 Y 9.26 4.82 0.00 3.14 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 0.00 823 L 8.85 5.10 0.00 1.86 1.80 1.01 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 824 L 8.63 4.96 0.00 1.70 1.61 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 825 P 0.00 5.15 0.00 1.91 1.96 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 826 H 8.21 4.76 0.00 3.39 3.54 0.00 5.48 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 827 I 8.23 3.50 1.27 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.36 0.71 0.00 0.00 828 W 7.49 4.71 0.00 3.56 3.28 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 0.00 829 A 7.42 4.57 1.16 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 0.00 0.00 830 H 8.61 4.82 0.00 3.15 3.21 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 831 G 8.80 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 0.00 832 G 8.33 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 0.00 833 G 8.68 4.78 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 0.00 0.00 0.00 834 I 8.47 4.80 2.23 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.43 1.08 0.00 0.00 835 E 9.22 4.87 0.00 1.86 1.78 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 2.21 2.27 0.00 836 T 8.30 5.20 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 0.60 0.00 0.00 837 A 8.70 4.56 1.21 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 0.00 0.00 838 K 8.66 4.75 0.00 1.74 1.73 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.61 7.81 839 T 8.77 4.61 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 0.00 840 G 8.37 4.12 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 0.00 0.00 0.00 841 N 8.72 4.65 0.00 2.84 2.93 0.00 0.00 5.85 7.66 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 0.00 842 E 7.50 3.90 0.00 2.11 2.21 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 2.36 2.33 0.00 843 P 0.00 4.42 0.00 2.04 2.10 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 844 C 7.60 4.86 0.00 2.99 3.01 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 0.00 845 P 0.00 4.43 0.00 1.96 2.06 0.00 3.57 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 846 L 8.66 4.77 0.00 1.73 1.78 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 847 T 8.21 4.73 4.29 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 1.18 0.00 0.00 848 V 8.18 4.31 1.76 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 -0.12 0.00 0.00 0.22 0.00 0.00 849 V 8.63 4.79 2.17 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 0.60 0.00 0.00 0.96 0.00 0.00 850 R 8.81 4.71 0.00 1.79 1.84 0.00 3.32 0.00 0.00 3.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 851 S 9.08 4.33 0.00 3.96 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 0.00 852 P 0.00 4.43 0.00 2.21 2.15 0.00 3.80 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 1.97 1.93 0.00 853 N 7.96 4.59 0.00 2.77 2.75 0.00 0.00 6.73 7.12 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 0.00 854 E 8.69 4.83 0.00 2.08 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 0.00 2.26 2.27 0.00 855 V 8.08 3.84 2.22 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 0.72 0.00 0.00 0.90 0.00 0.00 856 S 8.23 4.36 0.00 3.83 3.69 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 0.00 857 K 8.41 3.86 0.00 1.26 0.74 0.00 1.33 0.00 0.00 0.83 0.00 0.00 2.73 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.17 1.16 7.81 858 G 7.83 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 0.00 0.00 0.00 859 E 8.98 4.90 0.00 2.34 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 2.26 2.02 0.00 860 P 0.00 4.24 0.00 1.91 1.75 0.00 3.77 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 861 I 9.89 4.80 1.85 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.19 0.45 0.00 0.00 862 R 9.25 4.41 0.00 1.74 1.70 0.00 2.90 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 863 I 8.44 4.89 1.87 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.69 0.95 0.00 0.00 864 S 9.20 5.29 0.00 3.63 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 865 S 9.14 4.84 0.00 3.84 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 0.00 866 Q 8.65 3.97 0.00 1.72 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.66 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 867 F 7.65 4.24 0.00 2.96 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 0.00 868 R 8.49 4.33 0.00 1.80 1.92 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 869 S 7.44 4.60 0.00 2.72 3.37 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 0.00 870 L 8.11 4.32 0.00 1.79 1.84 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 871 F 7.01 6.06 0.00 3.00 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 0.00 872 I 8.36 4.20 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.58 0.99 0.00 0.00 873 P 0.00 4.84 0.00 2.01 1.81 0.00 3.73 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.70 0.00 874 R 8.47 3.99 0.00 1.83 2.04 0.00 3.36 0.00 0.00 3.60 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 875 G 8.80 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 876 S 7.58 4.63 0.00 4.15 4.02 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 0.00 877 L 8.15 4.53 0.00 1.59 1.58 0.79 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 0.00 878 V 8.58 4.80 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 0.84 0.00 0.00 0.86 0.00 0.00 879 A 8.92 4.99 0.72 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 0.00 0.00 880 L 8.60 4.76 0.00 0.47 0.13 -0.04 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 881 G 8.38 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 898 D 8.68 4.90 0.00 2.74 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 0.00 899 S 8.12 4.57 0.00 3.89 3.89 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 0.00 900 P 0.00 4.49 0.00 2.06 2.17 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 901 Q 7.77 4.26 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.30 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 902 G 8.30 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 0.00 903 P 0.00 4.67 0.00 1.96 1.87 0.00 3.54 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 904 A 9.20 4.89 1.17 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 0.00 0.00 905 V 8.32 4.42 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 0.79 0.00 0.00 1.08 0.00 0.00 906 K 9.48 5.16 0.00 1.66 1.72 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.38 7.81 907 L 8.89 5.14 0.00 1.67 1.68 1.13 1.13 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 0.00 908 S 8.45 4.85 0.00 3.93 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 0.00 909 Q 8.75 4.61 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 910 Q 7.83 4.69 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 911 K 8.72 4.05 0.00 1.78 1.80 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.46 7.81 912 L 8.29 4.76 0.00 1.71 1.63 1.07 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 913 P 0.00 4.35 0.00 2.19 2.18 0.00 3.76 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 2.19 2.00 0.00 914 E 9.00 3.63 0.00 1.94 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 2.31 2.34 0.00 915 K 7.97 4.05 0.00 1.90 1.89 0.00 1.50 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.51 7.81 916 D 8.45 4.77 0.00 2.78 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 0.00 917 I 7.42 4.61 1.87 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.44 1.06 0.00 0.00 918 L 7.73 4.28 0.00 1.67 1.55 0.72 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 919 V 7.19 4.33 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 0.63 0.00 0.00 0.32 0.00 0.00 920 F 7.51 5.73 0.00 3.20 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 0.00 921 K 8.12 4.60 0.00 1.77 1.58 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.64 7.81 922 F 8.82 5.25 0.00 2.99 2.95 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 0.00 923 E 9.41 4.87 0.00 2.21 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 2.35 2.39 0.00 924 K 9.06 3.58 0.00 1.69 1.62 0.00 0.80 0.00 0.00 0.82 0.00 0.00 2.58 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.27 7.81 925 V 7.70 3.75 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 0.90 0.00 0.00 1.00 0.00 0.00 926 S 8.24 3.10 0.00 3.90 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 927 H 8.04 4.47 0.00 3.17 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 928 S 9.78 4.67 0.00 3.78 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 0.00 929 N 7.77 4.39 0.00 2.80 3.01 0.00 0.00 6.78 7.94 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 0.00 930 I 7.00 4.64 1.91 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 1.48 0.86 0.99 0.00 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1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 940 H 8.61 4.74 0.00 2.98 3.17 0.00 5.68 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 941 D 8.27 4.71 0.00 2.60 2.78 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 0.00 942 E 8.10 3.69 0.00 2.16 1.88 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 2.17 2.30 0.00 943 E 7.93 4.04 0.00 1.94 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 944 D 7.86 4.46 0.00 2.80 2.78 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 0.00 945 V 8.08 4.58 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 0.61 0.00 0.00 0.79 0.00 0.00 946 K 8.84 4.51 0.00 1.80 1.49 0.00 1.45 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.48 7.81 947 C 8.50 5.16 0.00 2.75 2.85 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.57 1.61 0.00 956 D 8.77 4.78 0.00 2.78 2.80 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 0.00 957 R 8.79 3.86 0.00 1.82 2.07 0.00 3.21 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 1.65 1.70 0.00 958 N 8.16 4.58 0.00 2.70 2.83 0.00 0.00 7.09 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 0.00 959 G 8.36 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 0.00 960 N 8.26 4.37 0.00 2.92 2.74 0.00 0.00 6.84 7.01 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 0.00 961 R 8.57 4.67 0.00 1.99 1.89 0.00 3.36 0.00 0.00 3.50 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 962 R 8.50 4.42 0.00 1.88 1.84 0.00 3.15 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 963 L 8.54 4.96 0.00 1.71 1.56 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 964 V 9.01 4.76 2.17 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 0.77 0.00 0.00 0.96 0.00 0.00 965 V 8.44 4.48 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 1.20 0.00 0.00 0.74 0.00 0.00 966 T 8.18 4.63 4.43 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 1.33 0.00 0.00 967 E 9.03 4.13 0.00 1.99 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 2.36 2.38 0.00 968 E 7.42 4.58 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 969 N 8.71 4.22 0.00 2.96 2.96 0.00 0.00 6.57 8.03 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 0.00 970 P 0.00 4.30 0.00 2.05 1.85 0.00 3.73 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 1.95 1.83 0.00 971 L 8.82 4.35 0.00 1.88 1.86 1.09 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 972 E 8.93 5.12 0.00 1.96 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 2.29 2.37 0.00 973 L 9.59 5.23 0.00 1.64 1.60 1.24 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 974 V 8.78 4.71 2.17 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 1.07 0.00 0.00 1.06 0.00 0.00 975 L 8.55 5.04 0.00 1.46 1.43 0.02 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 976 L 8.79 5.04 0.00 1.88 1.73 1.00 0.27 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 0.00 977 K 9.04 3.55 0.00 1.71 1.66 0.00 0.62 0.00 0.00 1.38 0.00 0.00 2.81 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.29 1.28 7.81 978 A 7.84 4.38 0.55 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 0.00 0.00