NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 814 P 4.2481 0.0000 0.0000 62.9349 32.6938 175.6867 815 T 4.4400 7.9920 109.0532 61.4608 71.0298 172.1012 816 I 4.8496 8.2831 123.4393 59.2537 39.3430 176.4829 817 F 4.0513 9.2407 127.5135 56.1415 39.7591 175.7844 818 E 4.0744 9.6941 126.1653 56.2513 30.2208 176.5100 819 E 4.0431 9.4452 128.0330 59.5328 29.5587 179.0219 820 R 4.0947 7.7357 111.2273 58.5190 29.6915 176.5237 821 H 4.7429 8.3272 115.5403 55.7793 30.0437 174.6562 822 L 4.8914 8.0960 120.1644 53.4230 41.5692 176.0505 823 K 4.2675 9.0887 127.2030 55.2740 33.1054 175.3452 824 Y 4.2631 8.8091 129.7197 58.9802 39.1875 175.5427 825 I 3.9445 8.0517 127.3065 61.7788 38.7908 175.7252 826 S 4.3013 6.5787 112.9446 58.4160 66.0708 173.1196 827 Q 4.5878 8.7063 121.5538 55.6983 28.8501 175.2899 828 L 4.3324 8.7265 126.6371 57.0535 42.8791 176.9062 829 G 4.0829 7.9073 103.3131 45.6043 0.0000 172.4605 830 K 4.9579 8.8289 121.1347 54.3542 35.3558 175.1450 831 G 4.1038 8.2735 113.8511 43.0174 0.0000 172.4876 832 N 4.3013 7.8615 116.0561 55.9191 38.5576 175.7628 833 F 4.8054 6.8277 109.8679 55.9579 41.0518 174.4616 834 G 3.9628 9.1987 113.0635 45.3602 0.0000 171.8474 835 S 4.8997 8.3091 112.4553 57.5731 67.1015 173.4366 836 V 4.9749 8.9397 119.6784 61.1358 34.2842 174.0934 837 E 5.2072 9.2156 125.0594 54.3195 33.7839 174.2666 838 L 4.5919 8.6862 123.8121 54.8380 43.4472 175.4498 839 C 5.2682 8.7130 122.7002 57.9145 33.3512 172.6342 840 R 4.8981 8.7311 119.6690 54.7174 32.8389 173.7324 841 Y 4.8550 9.2804 128.5399 57.7636 39.0729 172.9339 842 D 4.6041 9.1559 128.1626 51.1283 40.6634 174.1271 843 P 3.5563 0.0000 0.0000 64.5242 32.0731 177.8046 844 L 4.0914 7.7595 117.0448 55.0550 42.0932 178.4705 845 G 4.0646 7.8014 106.0274 45.2264 0.0000 174.0031 846 D 4.2393 7.2551 117.2653 55.4801 41.3009 176.5174 847 N 4.5145 9.6129 117.0417 54.1511 38.0010 174.1450 848 T 4.3762 7.8908 105.0674 61.7602 69.3337 175.1451 849 G 4.5427 8.5707 109.8123 45.6159 0.0000 173.9056 850 A 4.4845 8.6081 123.1423 51.5204 19.9866 176.7056 851 L 4.7090 8.4385 120.4427 54.5972 42.9402 176.6344 852 V 4.6063 8.9531 115.3482 59.7173 37.0688 173.9576 853 A 4.9118 8.7929 123.7287 50.4733 20.9228 176.1037 854 V 5.2349 8.4999 123.0082 60.4966 34.1551 174.3454 855 K 5.1764 8.6652 129.6195 55.4006 34.3755 174.9155 856 Q 4.8608 8.9090 122.9891 54.8534 32.3581 173.6551 857 L 4.3868 7.9633 120.7795 54.3582 42.7028 176.7773 858 Q 4.4079 8.4795 120.2886 56.1585 28.9345 176.2093 859 H 4.7084 7.4333 118.2493 54.8693 30.3434 170.8254 860 S 4.8457 7.7939 119.2004 56.7621 63.1152 174.0752 861 G 4.1416 7.9880 112.2751 44.1803 0.0000 171.0799 862 P 4.8590 0.0000 0.0000 60.5104 29.5584 173.9918 863 D 4.5717 7.5406 124.5517 53.9705 47.3800 177.2051 864 Q 3.9412 7.6355 116.3737 57.7825 29.1339 177.3363 865 Q 4.1628 7.8519 124.1191 59.6979 28.9979 178.4422 866 R 4.0220 7.9789 121.3237 61.4198 29.3488 181.0509 867 D 4.5606 7.6441 118.6067 57.4089 40.9144 178.6077 868 F 4.4658 8.2426 121.2569 61.2409 39.4608 176.8615 869 Q 3.8218 8.7327 119.6446 59.2463 28.8501 178.4203 870 R 3.8520 7.7549 119.7854 59.2977 29.7907 177.9350 871 E 3.9339 8.3831 119.2806 59.4360 29.7176 178.9885 872 I 3.6068 7.6179 119.7678 64.3660 36.8856 178.4783 873 Q 3.8428 7.6244 117.7094 58.7829 28.7475 178.5004 874 I 3.6610 7.7640 120.9812 64.3338 36.8687 178.1508 875 L 3.5980 7.6292 120.8162 57.9785 41.5890 179.1171 876 K 3.1233 7.2034 118.3168 58.8491 32.0727 178.2867 877 A 4.1079 7.4176 119.6719 52.7441 18.6179 177.4761 878 L 4.2802 6.6411 117.0982 54.8949 42.0798 177.1302 879 H 4.8233 9.4641 122.1409 53.4310 28.9630 172.3321 880 S 4.2565 7.4783 115.9493 55.9131 65.6275 174.6949 881 D 4.1356 8.1764 125.7562 56.3714 40.8112 177.0634 882 F 5.2013 7.4087 117.6596 56.9776 39.3805 174.7143 883 I 5.2270 7.4114 121.6059 59.2602 40.4850 175.5445 884 V 3.6778 8.6690 126.6276 62.1109 31.6069 176.0645 885 K 4.1618 10.0078 128.3681 56.3227 33.2167 175.1655 886 Y 4.4677 8.7557 128.8570 57.8419 39.6740 175.3943 887 R 4.1045 8.6893 125.1869 56.1621 32.9466 176.4906 888 G 3.9215 5.5224 103.8216 45.0188 0.0000 170.9065 889 V 4.8027 8.2754 111.8243 59.7174 36.1890 175.6159 890 S 4.5749 8.5288 116.1208 56.8239 64.0390 171.9476 891 Y 4.5505 8.3799 124.0876 57.3077 35.3520 175.4795 892 G 4.2459 8.4918 109.7565 43.4226 0.0000 167.0765 893 P 4.0492 0.0000 0.0000 63.0454 31.7202 175.2337 894 G 3.8970 8.3837 109.5802 46.9429 0.0000 173.1326 895 R 4.5763 7.8929 124.0150 54.8431 31.6389 175.1881 896 P 4.6847 0.0000 0.0000 63.9370 30.1243 175.1045 897 E 4.5162 8.0412 117.9581 55.3268 27.6883 178.5039 898 L 4.4590 7.7842 125.1591 55.1723 43.9588 176.8460 899 R 5.0019 8.3743 123.3323 54.4717 34.5932 173.7972 900 L 4.5838 9.0408 126.2489 54.1341 43.8248 175.1817 901 V 4.4666 8.3994 126.6975 61.4739 33.3821 174.3499 902 M 5.2214 9.0760 127.1507 52.7288 36.2567 174.9605 903 E 4.4107 8.9704 118.8597 56.7957 30.6486 175.6913 904 Y 4.7709 8.4756 121.2712 55.8614 40.8938 175.4414 905 L 4.2614 7.8868 127.1278 51.7334 41.9001 174.6992 906 P 3.7433 0.0000 0.0000 65.5845 31.3785 178.2731 907 S 4.1487 7.7224 111.7054 59.4086 63.1556 175.3192 908 G 3.8121 7.9650 109.8612 45.0213 0.0000 172.4530 909 C 4.7917 8.1864 113.0489 57.0186 32.4116 173.7430 910 L 3.8178 9.3233 125.2170 58.9679 41.7345 179.0246 911 R 3.8597 8.2182 117.0695 60.5366 29.8371 177.6737 912 D 4.4903 8.0757 117.5097 57.2230 41.0059 178.4084 913 F 4.1273 8.3233 121.2249 61.5239 39.0228 177.2901 914 L 4.2823 8.7751 118.6161 57.4999 41.1021 179.3479 915 Q 4.1099 7.3990 116.4701 58.4505 29.1152 177.9338 916 R 4.0120 8.3281 118.9506 58.4540 30.1262 176.6576 917 H 4.7653 7.6377 114.4385 55.2202 29.7219 175.3312 918 R 3.6777 8.4424 121.6497 58.7510 30.1641 176.6529 919 A 3.9190 7.8088 121.3081 52.8228 18.1071 179.7403 920 R 3.7923 8.1356 118.9079 57.8159 31.3639 177.1991 921 L 4.3031 7.8280 119.0582 54.1964 42.2118 176.4257 922 D 5.1020 8.3663 122.5463 50.6226 43.5843 176.6825 923 A 4.0848 8.5750 121.6758 55.7216 18.1849 179.9904 924 S 4.2509 8.1816 111.9520 61.7768 62.9626 176.5431 925 R 3.6945 8.0645 122.1437 59.0672 29.7899 178.5194 926 L 3.7156 7.6364 118.7148 57.6178 41.3943 179.5368 927 L 4.1677 8.2828 119.4213 57.4155 41.4611 179.2139 928 L 3.4352 7.8712 120.6018 58.3229 41.9124 178.7373 929 Y 4.3195 7.5099 116.5630 61.0644 37.6619 178.7294 930 S 4.2797 8.2701 116.2505 61.6956 63.0378 176.4528 931 S 4.0533 8.5531 116.0845 61.7656 62.0917 176.3894 932 Q 2.9592 8.0404 120.5890 58.5618 28.3878 178.8060 933 I 3.7696 8.0759 121.2661 64.3736 37.1240 177.9362 934 C 3.7071 8.4775 119.9764 62.1914 31.3508 175.6798 935 K 3.9569 7.9274 120.0820 59.6327 31.5996 179.6526 936 G 3.8838 8.1688 105.3151 47.4925 0.0000 175.1125 937 M 3.8036 7.6017 120.3801 57.8689 32.2088 177.7153 938 E 3.9721 8.3260 120.0560 59.2314 29.5761 178.1360 939 Y 4.0625 7.8714 118.5031 60.8279 39.2380 177.4494 940 L 4.0117 7.7593 120.1196 57.9548 41.6815 179.9143 941 G 3.6564 7.9554 105.2272 47.8767 0.0000 175.8946 942 S 4.1453 7.6718 115.3810 60.5933 62.0581 175.7097 943 R 4.2070 7.4949 120.6578 55.0727 29.7423 176.6744 944 R 3.7561 8.0814 117.2135 57.3752 28.2566 175.0888 945 C 5.2162 7.3843 113.3107 57.3975 34.1193 172.9396 946 V 4.6305 8.4116 125.3617 61.3047 33.4213 176.1187 947 H 4.1191 9.7252 127.6282 57.7037 30.0821 177.0793 948 R 4.5247 8.5471 119.5448 56.2164 29.6725 176.1125 949 D 5.2079 8.1139 116.6466 53.1701 41.6107 175.4985 950 L 3.9590 8.2606 120.1199 55.2554 43.0388 175.3946 951 A 4.7443 8.2731 125.6749 51.1584 22.1376 176.5537 952 A 4.2098 9.2071 124.1684 55.3004 18.5520 180.5117 953 R 4.0770 8.0544 110.6033 58.4704 29.8426 176.7608 954 N 4.8762 8.6031 116.0329 53.0009 39.8139 173.8572 955 I 4.8499 7.7399 121.1260 59.6018 39.6618 174.9665 956 L 4.7029 9.0866 126.6979 53.0627 44.9474 175.4555 957 V 4.1472 8.0559 121.4875 61.4288 32.0480 175.3414 958 E 3.9608 9.2024 130.4229 58.6183 29.9048 176.0961 959 S 4.5663 7.4610 110.5850 56.8611 65.7534 174.4400 960 E 4.0439 8.9424 119.8408 59.0674 29.0997 178.1973 961 A 4.8940 7.7115 120.0033 51.2580 19.8917 175.4424 962 H 4.9564 8.4713 119.6782 57.4586 33.1771 172.9192 963 V 4.8773 8.7023 119.1333 59.5841 35.0875 175.1527 964 K 4.9364 9.0702 120.5226 54.9096 37.1762 175.4972 965 I 4.5088 8.6561 123.0802 60.7777 38.5845 175.2914 966 A 5.0027 8.8740 128.9798 50.5026 22.3609 174.2818 967 D 4.1583 8.8660 114.7489 55.6103 39.1259 173.0086 968 F 4.6920 8.4345 125.4962 56.9386 39.7673 178.4351 969 G 3.9132 8.7181 112.4250 47.3079 0.0000 175.2996 970 L 4.4720 7.6675 116.9655 54.2619 42.9085 176.4469 971 A 4.5135 7.3095 119.6263 52.5693 19.2218 177.2452 972 K 4.6496 9.1186 118.5190 54.6011 36.6969 175.5357 973 L 4.7711 8.4915 124.0855 53.6075 42.7096 176.5787 974 L 4.2896 8.7165 125.6833 53.7299 42.2129 175.7195 975 P 4.3852 0.0000 0.0000 62.4923 31.9213 177.1208 976 L 3.9241 8.6510 120.7726 57.9462 41.5731 177.9341 977 D 4.7102 7.9674 114.6927 53.3484 40.0299 175.9233 978 K 4.7112 8.0450 118.5161 55.3568 35.9566 175.4870 979 D 4.6570 8.5466 119.1970 54.3607 41.0599 176.6042 *982 V 4.6469 7.5622 117.9856 62.9372 31.8281 174.8511 983 V 4.3747 8.3787 126.5092 60.9291 33.4105 175.4251 984 R 4.0836 8.7073 127.0483 58.9291 30.3076 177.4160 985 E 4.0393 7.9689 117.9503 55.4861 29.8418 175.1559 986 P 4.3937 0.0000 0.0000 61.5959 33.1083 174.9414 987 G 4.0210 7.5265 106.7047 44.3026 0.0000 173.1731 988 Q 4.2912 9.4067 117.2941 55.8828 29.2479 176.3661 989 S 4.3590 7.8385 112.9177 55.5802 65.0316 172.2122 990 P 4.4160 0.0000 0.0000 62.7021 31.3873 177.5863 991 I 3.9517 8.2166 113.7069 63.7746 37.2423 177.2814 992 F 4.4426 7.6492 117.6049 58.0165 38.6047 175.6915 993 W 4.3056 8.1977 121.2631 57.1150 29.8341 175.8078 994 Y 4.7575 6.9916 114.0497 56.0238 39.4393 175.9458 995 A 2.5800 7.9385 123.5003 50.3862 20.3660 176.9359 996 P 3.8406 0.0000 0.0000 66.0517 31.2412 178.8235 997 E 3.7957 7.8130 117.0353 58.8588 29.3458 179.2036 998 S 3.6792 7.2269 117.0855 60.5885 62.6403 176.3436 999 L 3.9132 7.4473 121.0392 57.3113 41.4478 178.9833 1000 S 4.4227 8.0585 113.2707 59.7398 62.8407 174.6653 1001 D 4.7677 7.6873 118.9352 52.7734 42.0644 175.4605 1002 N 4.4961 7.7650 114.8499 53.2966 35.9585 173.6053 1003 I 4.5476 6.7989 115.7777 59.7450 38.3053 175.2583 1004 F 4.8688 8.4920 124.0629 55.8785 41.9597 174.7716 1005 S 4.6872 8.6139 116.7658 56.7990 66.0418 175.6877 1006 R 4.1683 8.6555 118.2259 59.8116 29.4705 179.0867 1007 Q 4.1652 8.0680 117.6388 58.5127 28.7719 178.5631 1008 S 4.3787 8.0802 115.1106 61.1668 63.3583 176.0735 1009 D 4.6963 8.5073 122.7837 57.2086 40.3560 178.6791 1010 V 3.4401 7.7949 117.7968 65.7281 31.7888 177.3969 1011 W 4.7479 8.0668 129.3632 60.3905 30.6134 178.1321 1012 S 4.7853 8.6572 115.8194 61.0321 62.1537 176.5664 1013 F 4.4957 8.9193 124.0329 61.2524 39.1621 177.3479 1014 G 3.2682 8.2691 105.5084 47.7182 0.0000 175.8794 1015 V 3.8097 7.9183 120.0891 65.5425 31.5701 178.2178 1016 V 3.6748 7.8426 118.2238 65.8922 31.4363 177.6987 1017 L 3.9221 7.7614 119.0405 58.1457 41.2755 178.8064 1018 Y 4.0646 8.0861 119.0188 60.9145 38.6356 178.0723 1019 E 4.1831 8.4507 120.7704 58.8367 29.5372 179.1700 1020 L 3.7900 8.3512 119.1477 57.9556 41.5847 179.2888 1021 F 3.9123 8.0211 114.1849 58.4749 38.9114 176.4495 1022 T 4.4847 7.2328 109.0127 60.4388 69.1153 173.8409 1023 Y 3.4044 8.2690 118.2614 59.3893 36.1414 169.6695 1024 C 4.1265 8.2556 113.1816 60.8008 25.1805 173.4460 1025 D 4.6175 7.8804 117.8799 53.9226 41.7593 177.1626 1026 K 4.4147 8.7700 125.4661 59.4529 32.5609 179.5054 1027 S 4.2003 8.6854 113.4874 60.7229 62.8128 174.9962 1028 C 5.6727 7.7120 114.3751 56.5571 29.8537 174.7610 1029 S 4.6456 7.7764 115.6865 58.2597 64.8969 172.0012 1030 P 3.8154 0.0000 0.0000 65.9139 30.7855 179.0095 1031 S 3.0229 8.2053 112.7420 61.1984 62.9415 176.2178 1032 A 3.9659 7.5969 123.2347 55.3806 18.1393 179.5106 1033 E 3.7781 8.1969 116.8396 59.5060 29.4592 179.7971 1034 F 3.9710 7.8078 117.5756 60.5113 38.8115 177.6161 1035 L 4.0721 8.2116 119.2628 57.7176 41.1587 178.9709 1036 R 4.4090 7.5097 112.7675 56.6881 29.5718 176.5066 1037 M 4.5633 8.2861 120.1023 56.0192 34.2293 176.0224 1038 M 4.3272 8.0748 113.2587 54.5380 32.3596 174.9398 1039 G 3.9783 7.3553 109.4759 46.5422 0.0000 171.8613 1040 C 4.7021 9.1168 129.5698 59.6061 35.3300 175.7569 1041 E 3.6179 7.9987 113.1492 56.3887 30.8161 179.4865 1042 R 4.7143 6.7407 123.7823 56.5788 29.4809 174.7838 1043 D 4.9157 8.3669 115.2424 50.7850 39.8708 175.6436 1044 V 4.3755 7.3630 119.8802 60.2511 34.9246 173.6489 1045 P 4.2501 0.0000 0.0000 62.9734 32.9372 176.8854 1046 A 3.9914 8.6770 123.6630 55.3173 18.3835 179.5026 1047 L 3.7264 7.9615 118.2469 58.7332 41.8467 178.7126 1048 C 4.0684 7.9677 117.6643 62.5728 31.7223 175.3494 1049 R 3.9753 8.0226 120.1194 58.7967 29.5082 178.3591 1050 L 3.9066 8.3287 120.9636 58.1572 42.1705 178.6993 1051 L 3.8855 7.8355 118.9358 57.8350 41.6383 179.2246 1052 E 3.9500 7.9842 119.0127 59.1861 29.5884 178.9024 1053 L 4.0475 7.7489 118.5051 57.9394 41.8630 179.4603 1054 L 4.2993 8.2673 119.2266 57.9661 41.3309 179.3043 1055 E 4.0715 8.4696 118.6700 58.8607 29.6131 177.7246 1056 E 4.4024 7.7693 115.9610 56.2233 29.7034 177.4691 1057 G 4.0090 7.9169 107.7108 45.1452 0.0000 174.1055 1058 Q 4.1391 7.8691 119.6734 55.9152 29.0414 175.8271 1059 R 4.6122 8.0661 120.3456 53.7490 34.4606 174.8412 1060 L 3.4486 7.2716 119.1253 54.0243 41.9158 176.0378 1061 P 4.4162 0.0000 0.0000 61.9787 32.6530 175.2381 1062 A 3.9912 8.1422 121.8902 50.0707 18.4469 175.4157 1063 P 4.1583 0.0000 0.0000 62.9378 31.5572 174.1180 1064 P 4.2951 0.0000 0.0000 64.6133 31.5950 175.6193 1065 A 3.7444 8.6039 123.0282 53.0839 16.2363 176.0441 1066 C 4.4623 7.9759 119.3255 58.5865 32.3949 171.8046 1067 P 4.1232 0.0000 0.0000 63.2771 31.4903 176.2321 1068 A 3.8892 8.8874 124.7981 55.7710 18.1866 179.3521 1069 E 3.8291 8.2309 115.9855 59.7603 29.4596 179.8547 1070 V 3.3134 7.5869 117.9898 66.2002 31.4419 177.6705 1071 H 4.1431 7.9114 117.2996 58.9027 29.7336 177.0132 1072 E 3.7777 7.8430 120.5786 59.2237 29.2845 179.1342 1073 L 3.8585 7.6778 119.0158 57.7732 41.3600 179.3067 1074 M 3.1785 7.2172 117.7586 58.2457 32.0630 178.6724 1075 K 3.8513 7.5386 118.2838 59.3051 31.9808 179.4511 1076 L 3.8939 7.5356 119.3075 57.9403 41.0439 179.2944 1077 C 4.1247 7.5885 116.3086 61.5213 27.5983 174.7868 1078 W 3.9465 6.7126 119.0115 54.9209 29.7530 176.0715 1079 A 4.1937 7.3394 123.2971 51.6272 18.2955 176.6597 1080 P 4.5133 0.0000 0.0000 65.6614 31.3595 176.6688 1081 S 4.5708 8.0040 114.1347 55.7826 63.4356 172.6045 1082 P 4.3652 0.0000 0.0000 65.7870 30.9230 177.8168 1083 Q 4.2815 8.0243 114.7487 57.5810 29.0102 176.1372 1084 D 4.6251 8.1302 118.1024 55.1655 41.5291 177.1441 1085 R 4.3459 7.2877 117.4472 55.0327 30.7185 174.6926 1086 P 4.4815 0.0000 0.0000 62.1855 32.5741 176.8138 1087 S 4.3235 8.1495 114.5881 57.9173 65.3339 175.2635 1088 F 3.9834 8.5104 121.7136 60.6827 38.4527 178.0985 1089 S 4.1394 8.1622 112.4305 61.0769 61.6940 175.7342 1090 A 4.2287 7.6056 122.9534 54.2466 18.4525 179.5753 1091 L 4.1815 8.0489 118.1424 58.1263 41.6530 178.9691 1092 G 3.8162 8.4181 105.5853 48.1310 0.0000 173.6182 1093 P 4.2692 0.0000 0.0000 65.0159 31.2701 178.3102 1094 Q 3.9893 7.4963 117.6024 59.0306 28.9139 178.0619 1095 L 4.1005 8.1145 120.1325 57.8579 41.6544 179.0446 1096 D 4.6364 8.4501 119.0384 57.5529 40.6864 178.9563 1097 M 4.0893 8.0342 118.7592 58.5731 31.8614 178.6615 1098 L 4.0299 7.5675 117.1700 57.5046 42.0207 179.3973 1099 W 4.3262 8.7478 128.6511 60.6915 30.6419 178.0968 1100 S 3.8861 8.3948 112.5802 59.9263 62.3022 175.7911 1101 G 3.8377 7.6862 107.7200 45.5473 0.0000 174.5712 1102 S 4.4141 7.6942 117.8921 58.4328 63.3002 175.1117 1103 R 4.0334 7.4826 124.5618 56.4536 28.9182 180.4712 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 814 P 0.00 4.25 0.00 1.51 1.86 0.00 3.62 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 0.94 1.65 0.00 815 T 7.99 4.44 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 816 I 8.28 4.85 1.92 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 1.53 0.77 1.18 0.00 0.00 817 F 9.24 4.05 0.00 2.66 2.64 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 0.00 0.00 0.00 0.00 818 E 9.69 4.07 0.00 2.19 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 2.26 2.35 0.00 819 E 9.45 4.04 0.00 2.16 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 2.52 2.44 0.00 820 R 7.74 4.09 0.00 1.96 2.03 0.00 3.02 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 1.24 0.00 821 H 8.33 4.74 0.00 2.89 2.72 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 L 8.10 4.89 0.00 1.82 1.75 0.94 0.72 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 0.00 823 K 9.09 4.27 0.00 1.85 1.89 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.40 7.81 824 Y 8.81 4.26 0.00 3.13 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 I 8.05 3.94 1.64 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 1.26 0.84 0.72 0.00 0.00 826 S 6.58 4.30 0.00 3.75 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 0.00 827 Q 8.71 4.59 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 828 L 8.73 4.33 0.00 1.70 1.75 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 829 G 7.91 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 830 K 8.83 4.96 0.00 1.72 1.62 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.28 1.39 7.81 831 G 8.27 4.10 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 0.00 832 N 7.86 4.30 0.00 2.23 2.83 0.00 0.00 6.79 7.11 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 0.00 833 F 6.83 4.81 0.00 2.96 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 0.00 834 G 9.20 3.96 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 0.00 0.00 0.00 835 S 8.31 4.90 0.00 4.11 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 0.00 836 V 8.94 4.97 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 1.10 0.00 0.00 0.97 0.00 0.00 837 E 9.22 5.21 0.00 2.39 2.12 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 2.34 2.32 0.00 838 L 8.69 4.59 0.00 1.51 1.31 0.61 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 839 C 8.71 5.27 0.00 2.84 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 0.00 840 R 8.73 4.90 0.00 1.79 1.72 0.00 3.09 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 841 Y 9.28 4.85 0.00 3.17 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 0.00 842 D 9.16 4.60 0.00 2.68 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.56 0.00 1.78 1.48 0.00 3.46 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.18 0.00 844 L 7.76 4.09 0.00 1.68 1.66 0.87 1.04 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 0.00 845 G 7.80 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 0.00 0.00 0.00 846 D 7.26 4.24 0.00 2.68 2.68 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 0.00 847 N 9.61 4.51 0.00 2.79 2.96 0.00 0.00 7.13 7.58 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 0.00 848 T 7.89 4.38 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 1.25 0.00 0.00 849 G 8.57 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 0.00 0.00 0.00 0.00 850 A 8.61 4.48 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 L 8.44 4.71 0.00 1.64 1.49 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 852 V 8.95 4.61 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 0.58 0.00 0.00 0.71 0.00 0.00 853 A 8.79 4.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 854 V 8.50 5.23 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 1.17 0.00 0.00 0.79 0.00 0.00 855 K 8.67 5.18 0.00 1.96 1.80 0.00 1.87 0.00 0.00 2.10 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.57 1.64 7.81 856 Q 8.91 4.86 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.19 2.47 0.00 857 L 7.96 4.39 0.00 1.30 1.41 -0.44 0.58 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 0.00 858 Q 8.48 4.41 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.10 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 859 H 7.43 4.71 0.00 2.90 3.09 0.00 5.74 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 860 S 7.79 4.85 0.00 3.90 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 0.00 861 G 7.99 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 0.00 0.00 0.00 862 P 0.00 4.86 0.00 2.05 2.04 0.00 3.71 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 2.02 2.07 0.00 863 D 7.54 4.57 0.00 2.65 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 864 Q 7.64 3.94 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 2.16 2.09 0.00 865 Q 7.85 4.16 0.00 2.46 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.68 0.00 866 R 7.98 4.02 0.00 1.86 1.93 0.00 3.30 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.30 0.00 867 D 7.64 4.56 0.00 3.01 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 0.00 868 F 8.24 4.47 0.00 3.17 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 0.00 869 Q 8.73 3.82 0.00 2.40 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 870 R 7.75 3.85 0.00 1.90 2.08 0.00 3.17 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 871 E 8.38 3.93 0.00 2.26 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 0.00 2.37 2.64 0.00 872 I 7.62 3.61 1.82 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.48 0.83 0.00 0.00 873 Q 7.62 3.84 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 874 I 7.76 3.66 1.92 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 1.34 0.67 0.75 0.00 0.00 875 L 7.63 3.60 0.00 1.60 1.55 0.60 0.69 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 0.00 876 K 7.20 3.12 0.00 0.84 1.54 0.00 1.53 0.00 0.00 1.49 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 0.71 7.81 877 A 7.42 4.11 1.25 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 0.00 878 L 6.64 4.28 0.00 1.65 1.69 0.44 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 879 H 9.46 4.82 0.00 3.00 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 S 7.48 4.26 0.00 2.84 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 881 D 8.18 4.14 0.00 1.58 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 0.00 0.00 0.00 882 F 7.41 5.20 0.00 3.24 3.09 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 0.00 883 I 7.41 5.23 1.90 0.00 0.00 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 1.54 0.74 0.99 0.00 0.00 884 V 8.67 3.68 2.19 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 0.86 0.00 0.00 0.99 0.00 0.00 885 K 10.01 4.16 0.00 1.87 1.79 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.41 7.81 886 Y 8.76 4.47 0.00 3.09 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 0.00 887 R 8.69 4.10 0.00 1.42 1.88 0.00 3.49 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 888 G 5.52 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 0.00 889 V 8.28 4.80 1.65 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 0.71 0.00 0.00 0.70 0.00 0.00 890 S 8.53 4.57 0.00 3.92 3.64 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 0.00 0.00 0.00 0.00 891 Y 8.38 4.55 0.00 2.95 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 0.00 892 G 8.49 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 0.00 893 P 0.00 4.05 0.00 2.20 2.19 0.00 3.82 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 894 G 8.38 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 0.00 0.00 0.00 895 R 7.89 4.58 0.00 2.09 2.20 0.00 3.08 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 896 P 0.00 4.68 0.00 2.15 2.53 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.98 0.00 897 E 8.04 4.52 0.00 1.65 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 2.27 1.87 0.00 898 L 7.78 4.46 0.00 1.81 1.85 0.93 0.61 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 0.00 899 R 8.37 5.00 0.00 1.71 1.76 0.00 3.19 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 900 L 9.04 4.58 0.00 1.64 1.70 1.02 0.60 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 0.00 901 V 8.40 4.47 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.52 0.00 0.00 902 M 9.08 5.22 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 903 E 8.97 4.41 0.00 1.95 1.95 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 2.52 2.26 0.00 904 Y 8.48 4.77 0.00 2.66 2.97 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 0.00 905 L 7.89 4.26 0.00 1.61 1.57 0.87 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 906 P 0.00 3.74 0.00 1.86 2.01 0.00 3.38 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.52 0.00 907 S 7.72 4.15 0.00 3.92 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 0.00 908 G 7.97 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 0.00 909 C 8.19 4.79 0.00 3.34 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 0.00 910 L 9.32 3.82 0.00 1.56 1.92 0.78 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 911 R 8.22 3.86 0.00 1.96 1.96 0.00 3.28 0.00 0.00 3.36 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.85 0.00 912 D 8.08 4.49 0.00 2.80 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 0.00 913 F 8.32 4.13 0.00 3.26 3.24 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 0.00 914 L 8.78 4.28 0.00 1.99 1.92 0.93 0.99 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 2.22 2.15 0.00 991 I 8.22 3.95 1.61 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.79 0.00 0.00 992 F 7.65 4.44 0.00 3.12 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 0.00 993 W 8.20 4.31 0.00 3.05 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 994 Y 6.99 4.76 0.00 2.96 2.84 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 0.00 0.00 0.00 995 A 7.94 2.58 0.91 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 0.00 0.00 996 P 0.00 3.84 0.00 2.06 2.07 0.00 2.20 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 997 E 7.81 3.80 0.00 2.04 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 0.00 2.28 2.23 0.00 998 S 7.23 3.68 0.00 3.63 2.84 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 0.00 0.00 0.00 999 L 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.44 0.00 1008 S 8.08 4.38 0.00 4.06 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 1009 D 8.51 4.70 0.00 3.32 3.21 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 1010 V 7.79 3.44 2.30 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 0.71 0.00 0.00 0.39 0.00 0.00 1011 W 8.07 4.75 0.00 3.65 3.39 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 1012 S 8.66 4.79 0.00 4.43 4.38 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 1013 F 8.92 4.50 0.00 3.66 3.45 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 1014 G 8.27 3.27 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 0.00 1015 V 7.92 3.81 2.19 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 0.21 0.00 0.00 1.06 0.00 0.00 1016 V 7.84 3.67 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 0.94 0.00 0.00 1.15 0.00 0.00 1017 L 7.76 3.92 0.00 1.74 1.61 0.39 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 1018 Y 8.09 4.06 0.00 3.31 3.26 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 1019 E 8.45 4.18 0.00 2.36 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 0.00 2.61 2.68 0.00 1020 L 8.35 3.79 0.00 1.59 1.21 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 1021 F 8.02 3.91 0.00 2.87 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 1022 T 7.23 4.48 4.17 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 0.54 0.00 0.00 1023 Y 8.27 3.40 0.00 3.06 3.24 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 1024 C 8.26 4.13 0.00 3.21 3.13 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 1025 D 7.88 4.62 0.00 3.00 2.58 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 1026 K 8.77 4.41 0.00 1.95 1.89 0.00 1.67 0.00 0.00 2.08 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.56 7.81 1027 S 8.69 4.20 0.00 3.98 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 1028 C 7.71 5.67 0.00 3.32 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 1029 S 7.78 4.65 0.00 4.31 4.39 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 1030 P 0.00 3.82 0.00 1.06 1.47 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.65 0.00 1031 S 8.21 3.02 0.00 3.98 3.98 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 1032 A 7.60 3.97 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 1033 E 8.20 3.78 0.00 1.64 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 2.51 2.54 0.00 1034 F 7.81 3.97 0.00 2.74 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 1035 L 8.21 4.07 0.00 1.69 1.72 0.99 1.26 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 1036 R 7.51 4.41 0.00 1.98 1.99 0.00 2.96 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.66 0.00 1037 M 8.29 4.56 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 1038 M 8.07 4.33 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.94 0.00 1039 G 7.36 3.98 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 0.00 0.00 0.00 1040 C 9.12 4.70 0.00 3.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1041 E 8.00 3.62 0.00 2.03 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 2.33 2.32 0.00 1042 R 6.74 4.71 0.00 1.97 1.84 0.00 2.98 0.00 0.00 3.28 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.37 0.00 1043 D 8.37 4.92 0.00 2.74 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 1044 V 7.36 4.38 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 0.87 0.00 0.00 0.94 0.00 0.00 1045 P 0.00 4.25 0.00 2.18 1.97 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 1046 A 8.68 3.99 1.35 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 0.00 0.00 1047 L 7.96 3.73 0.00 1.69 1.65 0.81 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 1048 C 7.97 4.07 0.00 3.01 3.07 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 1049 R 8.02 3.98 0.00 2.01 1.94 0.00 3.22 0.00 0.00 3.12 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.72 0.00 1050 L 8.33 3.91 0.00 1.75 1.75 0.36 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 1051 L 7.84 3.89 0.00 1.69 1.66 0.84 0.46 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 1052 E 7.98 3.95 0.00 2.21 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 2.32 2.36 0.00 1053 L 7.75 4.05 0.00 2.09 1.87 1.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 1054 L 8.27 4.30 0.00 1.85 1.83 0.83 1.16 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 1055 E 8.47 4.07 0.00 1.98 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 2.34 2.36 0.00 1056 E 7.77 4.40 0.00 2.20 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 2.35 2.48 0.00 1057 G 7.92 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 1058 Q 7.87 4.14 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.66 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 1059 R 8.07 4.61 0.00 1.77 1.71 0.00 3.15 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 1060 L 7.27 3.45 0.00 1.01 0.98 -0.20 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 1061 P 0.00 4.42 0.00 2.16 2.04 0.00 3.51 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 1062 A 8.14 3.99 1.07 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 1063 P 0.00 4.16 0.00 2.26 1.73 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.80 0.00 1064 P 0.00 4.30 0.00 2.07 2.07 0.00 3.80 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 1065 A 8.60 3.74 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 1066 C 7.98 4.46 0.00 2.95 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 1067 P 0.00 4.12 0.00 2.16 2.17 0.00 3.77 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 1.80 2.01 0.00 1068 A 8.89 3.89 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 1069 E 8.23 3.83 0.00 1.99 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 2.37 2.40 0.00 1070 V 7.59 3.31 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 -0.09 0.00 0.00 0.50 0.00 0.00 1071 H 7.91 4.14 0.00 3.14 3.32 0.00 5.74 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 1072 E 7.84 3.78 0.00 2.11 1.87 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 2.43 2.42 0.00 1073 L 7.68 3.86 0.00 1.69 1.59 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1074 M 7.22 3.18 0.00 0.96 1.82 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 1075 K 7.54 3.85 0.00 1.73 1.78 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.32 7.81 1076 L 7.54 3.89 0.00 1.74 1.59 0.83 0.60 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 1077 C 7.59 4.12 0.00 2.34 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 1078 W 6.71 3.95 0.00 3.10 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 1079 A 7.34 4.19 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1080 P 0.00 4.51 0.00 2.26 2.35 0.00 3.87 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 1081 S 8.00 4.57 0.00 3.91 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 1082 P 0.00 4.37 0.00 2.29 2.50 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 1083 Q 8.02 4.28 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 1084 D 8.13 4.63 0.00 2.85 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 1085 R 7.29 4.35 0.00 1.90 1.86 0.00 3.32 0.00 0.00 3.67 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.68 0.00 1086 P 0.00 4.48 0.00 2.08 1.97 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 1087 S 8.15 4.32 0.00 4.08 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 1088 F 8.51 3.98 0.00 3.06 3.13 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 1089 S 8.16 4.14 0.00 4.05 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 1090 A 7.61 4.23 1.32 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 0.00 0.00 1091 L 8.05 4.18 0.00 1.81 1.71 0.64 0.65 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 1092 G 8.42 3.82 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 0.00 0.00 0.00 1093 P 0.00 4.27 0.00 2.29 2.35 0.00 3.77 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 2.23 2.08 0.00 1094 Q 7.50 3.99 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 1095 L 8.11 4.10 0.00 1.95 1.77 1.13 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 1096 D 8.45 4.64 0.00 2.97 2.84 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 0.00 0.00 0.00 1097 M 8.03 4.09 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.60 0.00 1098 L 7.57 4.03 0.00 1.85 1.79 0.89 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 1099 W 8.75 4.33 0.00 3.41 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1100 S 8.39 3.89 0.00 3.93 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 1101 G 7.69 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 1102 S 7.69 4.41 0.00 3.90 3.84 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 0.00 0.00 0.00 1103 R 7.48 4.03 0.00 2.02 1.86 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.18 0.00 * Residues marked with a * may have inaccurate shift predictions.