NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 828 Q 4.6952 8.1876 119.6374 55.7022 30.9174 174.8033 829 S 4.3908 8.7426 118.0829 57.5107 64.1969 173.9487 830 M 4.1122 8.8654 119.8563 58.4876 32.5190 180.0544 831 K 3.9274 8.0566 119.1611 59.6286 32.3222 178.5719 832 Q 4.0010 8.0353 117.9819 58.9683 28.7019 178.5123 833 F 4.4881 8.6285 122.0116 61.3878 39.3938 177.3222 834 V 3.2824 8.1588 117.9955 65.9063 31.5060 177.8237 835 K 3.9157 8.1058 118.3354 60.1030 31.9552 178.6867 836 H 4.4913 8.3663 119.7084 58.5654 29.6977 177.3557 837 I 3.5527 7.6152 121.9305 64.2571 36.8677 178.5136 838 G 3.6956 7.6144 105.0378 47.8978 0.0000 175.5207 839 E 3.9681 8.0093 120.5668 59.2233 29.6024 179.5003 840 L 3.5561 7.6239 118.9334 57.6919 41.4035 179.1471 841 Y 4.2965 7.9495 116.8650 59.6538 37.7365 176.4779 842 S 4.4876 7.2495 115.9028 59.1599 64.3325 173.7917 843 N 4.1039 9.2652 115.1932 54.4374 34.6425 174.6882 844 N 4.5555 8.8610 109.9176 55.1288 36.8184 175.0484 845 Q 4.3322 8.3919 109.7247 56.8793 27.5424 176.0544 846 H 4.1745 8.2702 119.0063 59.7287 29.6533 176.7451 847 G 3.5117 8.0594 106.6004 47.7690 0.0000 175.3557 848 F 4.4332 7.8765 119.6221 60.5975 39.0144 177.7654 849 S 4.3803 8.1840 114.6437 61.6918 62.6147 176.6451 850 E 3.9480 8.4141 121.4824 59.4710 29.1644 179.1405 851 D 4.3360 8.4497 119.2507 57.4720 40.8575 178.7448 852 F 3.8037 8.4664 121.3891 60.9097 39.3765 176.7897 853 E 3.7792 8.3664 119.2490 59.0990 29.1781 178.3642 854 E 3.8515 7.8334 118.4709 59.2128 30.0542 178.7068 855 V 3.5862 7.5742 118.2626 66.1211 31.3544 178.1323 856 Q 3.8465 7.6694 116.6469 58.0495 28.7764 177.8723 857 R 4.4195 7.6307 117.2175 56.1748 30.4224 177.5762 858 C 4.3635 7.7695 114.8632 60.0001 30.0586 174.1500 859 T 4.3914 7.4327 110.2487 61.1497 68.8761 175.7658 860 A 3.9975 7.8513 126.9185 54.9234 18.4032 178.5078 861 D 4.8568 7.9318 113.5774 53.0620 39.8210 175.4498 862 M 4.5170 7.7422 118.7498 54.1161 34.5847 174.3291 863 N 4.5395 8.6489 124.7542 52.6341 39.0878 174.0219 864 I 4.3270 7.9739 126.5567 59.5224 40.2011 175.3796 865 T 4.4801 8.2118 114.8203 60.5122 70.9063 174.2283 866 A 4.9745 7.9777 123.0220 51.4439 19.2999 177.4180 867 E 3.9161 9.5499 125.4911 59.5067 30.7475 180.2864 868 H 4.1085 8.6717 116.0558 58.9091 28.9508 177.9468 869 S 3.7584 7.5242 113.7118 60.3014 62.7059 174.9032 870 N 4.7738 7.5478 115.1383 52.8262 38.7874 174.3822 871 H 4.0702 7.7132 119.7515 55.3891 30.4859 174.2687 872 P 4.1353 0.0000 0.0000 66.1053 30.8735 178.3224 873 E 3.9416 8.3276 116.0923 58.3492 29.8915 177.3352 874 N 4.5958 8.1597 115.5040 53.6512 39.2883 176.9476 875 K 3.8499 7.4638 120.6508 59.6487 31.9706 178.4413 876 H 4.3736 8.1431 112.3615 57.5012 28.6795 175.9164 877 K 4.2158 7.8719 118.8025 56.7171 32.3261 175.9918 878 N 5.0932 7.7194 117.6241 51.3865 39.9162 175.3476 879 R 3.8876 9.2158 124.3580 58.3864 30.5611 176.2689 880 Y 4.7114 7.5954 114.8376 55.6004 41.0799 176.1285 881 I 3.7016 8.7406 124.5254 63.6909 38.2308 176.0535 882 N 4.7392 8.1745 114.3109 52.9502 38.9751 174.5309 883 I 4.3820 7.5982 120.3978 59.8533 37.3168 174.7820 884 L 4.7042 8.7248 124.8378 52.6132 44.4063 176.0796 885 A 4.7344 8.5289 122.0411 49.3610 20.1342 176.0547 886 Y 4.6953 8.2244 120.5077 58.9835 37.7728 177.8512 887 D 4.5091 9.4216 124.6542 57.7257 41.1248 178.6257 888 H 4.4895 8.3229 113.2717 57.3265 29.0536 175.8107 889 S 4.7731 7.4349 113.6131 57.3831 63.6888 174.1340 890 R 4.2786 7.6122 118.1142 56.3102 29.7449 176.1586 891 V 3.5893 7.7964 120.6612 62.3764 32.1503 175.2060 892 K 4.7424 8.5168 127.1010 54.7264 33.8455 176.1230 893 L 4.5290 8.5827 125.0898 53.8717 43.1922 176.9512 894 R 4.0221 8.8965 121.8045 55.9156 30.6305 175.3238 895 P 4.4076 0.0000 0.0000 62.5506 32.0080 176.3782 896 L 4.4329 8.3536 122.4333 53.5589 42.3839 176.8400 897 P 4.2549 0.0000 0.0000 62.4898 30.7291 176.2558 *901 S 4.2217 7.9043 112.0532 57.5671 63.4431 173.9621 902 K 3.7546 8.7364 122.6717 59.6928 31.8203 176.9999 903 H 4.8829 7.9736 113.6216 55.6206 28.7139 176.5713 904 S 4.4443 7.9729 114.9286 59.9432 63.0420 174.6215 905 D 4.8494 8.0188 119.8753 53.7782 39.5568 174.8689 906 Y 4.6296 7.8099 122.5784 56.4220 39.8941 173.9476 907 I 4.1645 6.8269 125.2544 59.1957 40.8910 174.6537 908 N 4.5372 8.1599 125.3989 52.3045 37.9133 172.6647 909 A 4.7511 7.4430 122.9588 50.3797 22.8879 174.6344 910 N 5.2746 8.8896 117.2231 51.3493 43.2690 173.8036 911 Y 4.6020 8.4183 120.1260 58.2845 39.0413 175.6799 912 V 4.7441 9.0490 122.4790 61.1492 35.0987 174.6982 913 D 5.1103 9.7585 128.0873 54.7398 40.9051 176.2730 914 G 4.4372 8.9077 110.9307 43.9930 0.0000 174.0703 915 Y 4.1832 8.5343 116.3712 59.4652 38.0125 176.0221 916 N 4.6182 6.6778 114.6642 51.9527 39.7931 173.8291 917 K 4.2150 7.7542 117.5219 54.2313 34.6457 174.7444 918 A 4.4359 8.5529 130.0237 53.4813 18.9811 176.8599 919 K 3.9738 9.0665 121.1985 57.5437 30.4073 176.7648 920 A 4.0380 7.9285 121.1121 54.2353 19.7084 178.0577 921 Y 5.4185 8.3519 111.9876 56.3524 42.7626 174.8903 922 I 4.8237 8.8558 122.1902 59.6805 39.8322 174.4973 923 A 5.0529 8.8050 129.9862 50.8732 20.5053 175.7716 924 T 5.0360 8.5903 116.6451 60.2263 71.5984 173.0762 925 Q 4.4364 8.2070 123.0050 55.5533 29.8915 176.0387 926 G 3.7471 8.8095 108.9391 45.4116 0.0000 172.1643 927 P 4.4986 0.0000 0.0000 62.8960 32.7277 175.9061 928 L 4.8359 8.3321 120.6499 52.5344 43.3218 177.9928 929 K 2.0000 8.4149 120.2710 59.2068 31.9208 179.5179 930 S 4.2036 7.7885 111.1723 60.2184 63.1850 174.5597 931 T 4.6094 7.9215 110.7020 61.1273 69.5299 175.6457 932 F 4.4591 8.1622 123.2374 61.3265 38.8888 177.2152 933 E 4.3010 8.5573 117.4667 59.7547 29.2809 179.0103 934 D 4.4248 8.2584 118.3524 57.2361 40.9449 178.4375 935 F 3.9106 8.5733 121.3225 61.2891 39.3957 177.3789 936 W 4.1424 8.3764 118.4194 59.4879 28.8214 178.6476 937 R 4.0524 8.4747 119.1841 59.4072 29.4242 178.1678 938 M 3.9424 8.2871 118.3438 58.7571 32.3694 178.1542 939 I 3.5163 7.5142 119.8322 64.0645 37.2925 178.2280 940 W 4.0128 8.5483 129.0611 60.7081 30.4850 177.9061 941 E 4.1016 8.7543 117.5926 59.1980 29.1247 178.5636 942 Q 4.2826 8.3742 115.9652 54.7667 29.2578 175.3570 943 N 4.0188 7.8569 118.1017 54.5626 37.9921 173.7257 944 T 4.4604 7.7237 112.9346 63.2688 69.1948 174.9852 945 G 4.1837 8.6939 111.5193 46.1118 0.0000 172.6415 946 I 5.3324 7.6627 121.1302 59.6066 41.4471 174.1038 947 I 4.9108 9.0088 127.7077 59.4765 40.0385 174.6830 948 V 4.8280 9.1716 127.1362 61.4488 33.6995 173.7490 949 M 4.7412 9.3262 129.1634 53.1324 34.2281 176.0421 950 I 4.7836 7.8624 129.2850 59.8717 36.4974 175.0514 951 T 4.5669 7.5532 113.3754 61.4374 70.3905 171.9963 952 N 5.0531 8.9364 123.7522 51.9625 40.3390 175.8861 953 L 4.3103 8.7381 119.8426 57.3314 41.9294 177.8257 954 V 4.7298 7.6745 116.2567 60.8880 34.1024 174.1721 955 E 4.4872 9.1542 127.2693 55.1036 30.3498 176.3260 956 K 3.6073 9.8074 126.3388 57.4216 29.5981 176.6783 957 G 3.9631 8.5249 105.4356 45.1483 0.0000 173.4302 958 R 4.4989 7.6154 119.8017 53.9988 31.5880 175.5632 959 R 4.3122 8.6238 123.8527 56.3765 30.6452 175.5895 960 K 4.6448 9.1758 124.7967 57.5781 35.0938 175.7626 961 C 4.8609 7.8506 116.6827 58.4464 34.4267 173.2581 962 D 4.8342 8.5574 125.1011 53.2790 42.7678 176.1745 963 Q 3.5779 8.6652 122.8573 55.7563 28.0702 174.8204 964 Y 3.1019 7.5378 122.7912 55.6800 38.4474 175.1953 965 W 5.1429 6.6617 116.5053 53.7364 31.3424 172.9927 966 P 4.4846 0.0000 0.0000 62.7665 31.5932 176.7186 967 T 4.1477 8.5546 119.2634 66.2938 68.6736 174.2025 968 E 4.8102 7.7115 115.8091 55.5986 33.6101 176.6876 969 N 3.9024 8.4867 117.1226 55.1864 37.4187 175.1670 970 S 5.4427 8.5795 121.1560 57.7994 66.0032 172.2690 971 E 4.5469 9.0047 122.1955 54.4401 33.4013 173.4630 972 E 4.6714 8.2902 125.5465 54.8023 31.7538 175.4274 973 Y 4.6613 9.0192 124.9287 56.5105 39.5664 177.0507 974 G 3.9341 8.0140 117.6788 47.1171 0.0000 172.4211 975 N 4.6279 8.7002 122.3682 52.3646 38.8785 173.5073 976 I 4.7239 7.6826 120.9284 59.6366 39.4972 174.5182 977 I 4.6402 8.6353 129.0697 59.6705 39.1507 174.8039 978 V 4.5582 8.6264 127.6133 61.2670 33.8963 174.3101 979 T 5.1255 8.9627 124.4983 61.5203 71.7254 172.9267 980 L 4.2565 8.9858 129.6425 55.2423 42.0501 176.2417 981 K 4.5468 8.8574 126.4947 58.0209 33.7951 176.8574 982 S 4.6515 7.3320 111.4199 57.7075 66.1145 173.9871 983 T 4.9978 8.2752 116.8944 61.7510 72.3263 173.0934 984 K 4.4887 9.1852 127.3654 54.5658 35.0922 174.4588 985 I 4.6088 8.2879 127.7958 59.8912 38.9181 174.8069 986 H 4.6998 8.6901 123.5172 53.2079 31.6570 175.1194 987 A 3.8822 8.6190 122.8759 55.1101 18.2022 178.2832 988 C 4.5756 7.8683 110.3101 59.5587 29.9434 172.5311 989 Y 5.1966 7.1928 116.9305 56.3154 41.5237 173.6293 990 T 5.0243 9.2712 116.9725 61.7515 72.6193 173.1516 991 V 4.7260 8.9905 125.1163 61.1168 34.3953 174.2825 992 R 4.7971 8.7468 126.9289 54.2281 33.1099 174.5631 993 R 4.8071 8.5601 124.6494 54.7094 32.1505 174.9917 994 F 5.4480 9.5614 124.7613 55.8391 42.8503 174.0739 995 S 5.5058 9.0836 115.8223 56.5780 64.8720 172.8141 996 I 5.1324 9.2219 120.2135 59.1169 40.7380 174.2428 997 R 5.0811 8.8284 124.3707 54.6181 33.6630 173.3416 998 N 4.7623 8.1169 125.5136 52.3840 39.7796 175.5745 999 T 4.1217 9.0533 117.4001 62.7756 69.4379 175.7821 1000 K 4.2938 8.1545 121.3128 55.7880 32.8101 175.8565 1001 V 2.9681 7.1573 113.0514 62.3914 31.5668 172.3438 *1014 N 5.0062 8.5030 120.2401 53.3056 40.9115 173.5948 1015 E 5.5554 8.3191 115.2722 54.7491 33.2759 175.2480 1016 R 4.8161 9.4461 120.9926 54.5749 35.1744 174.1694 1017 V 4.6669 8.4060 121.2210 62.1166 32.9868 175.3083 1018 V 4.7985 8.9295 126.9120 61.2914 34.8348 173.8508 1019 I 4.9211 8.9163 128.5835 59.6185 39.8645 174.1473 1020 Q 5.0326 9.3423 128.9124 54.7663 31.1402 173.8214 1021 Y 4.6862 9.4638 125.9282 57.1820 39.4740 174.5517 1022 H 5.4023 9.6918 126.9335 54.3865 31.6608 172.5165 1023 Y 4.4034 9.0613 129.2320 57.5996 38.7521 175.2104 1024 T 4.5470 8.2359 116.2500 61.1813 69.9385 174.7872 1025 Q 4.5853 7.0079 119.9503 55.3270 29.8525 174.9333 1026 W 4.2644 8.5644 128.7796 56.3367 31.3009 174.2055 1027 P 4.5373 0.0000 0.0000 62.4637 31.4774 176.2715 1028 D 4.5689 8.7562 119.7828 55.6490 39.7623 176.3851 1029 M 4.6862 7.8192 118.2963 54.1929 35.1576 177.3596 1030 G 4.2908 8.7104 109.7776 44.9905 0.0000 172.8075 1031 V 4.0165 7.7202 114.2949 58.0755 35.2222 173.5600 1032 P 3.8269 0.0000 0.0000 63.4276 31.4381 177.7331 1033 E 3.8361 8.4490 118.0760 57.7735 29.9698 174.8607 1034 Y 4.7905 7.4590 114.1268 55.9441 40.6515 176.1037 1035 A 4.3297 8.7873 127.0389 54.5576 18.4698 178.9436 1036 L 3.9564 8.1206 119.2391 58.0422 42.2081 177.3675 1037 P 4.4398 0.0000 0.0000 65.8585 31.1854 178.5400 1038 V 3.6590 7.9457 117.7636 65.7443 31.6035 177.6968 1039 L 4.0049 8.3621 119.1584 58.2647 41.4170 179.7021 1040 T 3.9321 8.2598 115.6456 66.5159 68.3897 176.4365 1041 F 3.7776 8.4215 122.5335 61.2147 39.4466 177.2742 1042 V 3.4873 8.4856 118.0803 66.0392 31.2641 178.1394 1043 R 3.8357 8.3723 118.0148 59.3770 29.8067 179.3864 1044 R 3.8620 8.1326 118.3220 59.2228 29.8749 179.3460 1045 S 2.7900 7.3030 113.1381 60.5875 63.2480 176.3486 1046 S 4.2124 7.9863 117.8365 61.1292 62.7326 176.3015 1047 A 3.9869 7.9241 123.2711 54.6218 18.1319 179.0794 1048 A 4.2241 7.4044 118.3400 53.2415 18.4942 177.6812 1049 R 3.9157 7.3277 118.2477 56.5324 30.2983 175.9657 1050 M 4.5232 8.2605 124.8686 52.9867 33.2212 174.2895 1051 P 4.2883 0.0000 0.0000 63.9629 32.0205 176.3123 1052 E 3.6665 8.7094 118.3158 58.0340 26.7031 174.2608 1053 T 4.5567 7.0252 103.6606 59.1801 71.6209 173.3069 1054 G 4.1022 8.0417 109.9084 44.4727 0.0000 171.6341 1055 P 4.6450 0.0000 0.0000 62.3785 32.2701 176.8699 1056 V 3.9551 8.3829 123.1079 62.7072 32.9099 174.6146 1057 L 4.7745 8.7827 130.7066 54.3272 43.4980 175.2293 1058 V 4.8718 9.1080 126.8346 61.3237 34.2434 173.9314 1059 H 5.5117 9.2869 122.6372 53.2160 32.4923 173.7181 1060 C 4.8083 8.5279 115.2569 58.8732 31.0266 174.9635 1061 S 4.7292 9.4086 110.8083 59.7453 61.6893 174.5276 1062 A 4.4498 8.0894 122.1061 52.7106 18.8572 177.6948 1063 G 4.1243 8.1393 102.4089 46.4619 0.0000 174.7053 1064 V 4.1598 7.7822 111.9163 62.1304 33.8494 177.7225 1065 G 3.7785 7.2952 106.5954 47.1202 0.0000 175.6951 1066 R 3.5623 7.4675 118.7575 58.3176 29.9623 179.1635 1067 T 3.8723 7.8232 115.2131 66.8122 68.4358 176.6195 1068 G 3.6489 7.9130 106.8235 47.9957 0.0000 175.6089 1069 T 4.0062 8.0958 118.0627 66.5947 68.4332 175.9884 1070 Y 4.0110 8.2523 121.4264 60.8763 38.8638 178.1418 1071 I 3.3911 7.9234 120.6786 64.2665 37.0518 178.7193 1072 V 3.8784 8.1563 119.1497 66.0848 31.3885 178.0853 1073 I 3.5878 7.8037 119.5571 64.3367 36.9499 177.7930 1074 D 4.0889 7.9913 118.9700 57.5632 41.0075 178.5454 1075 S 4.1039 8.1117 115.5352 61.8995 62.6708 176.7241 1076 M 3.7584 8.1505 121.6917 58.0488 31.6401 178.8130 1077 L 3.8415 7.9351 119.4224 57.8105 41.7124 179.5968 1078 Q 3.8396 7.9936 118.0576 58.7440 28.5657 178.4467 1079 Q 2.7216 7.3540 120.5807 58.6404 28.9440 178.4139 1080 I 3.5963 7.6260 120.9907 64.2747 36.9519 178.2643 1081 K 3.7915 7.5706 117.7133 59.6596 32.0055 178.5749 1082 D 4.5039 8.0251 118.8493 57.2761 40.9025 178.1720 1083 K 4.4573 8.2715 121.8034 55.1842 33.1956 177.9894 1084 S 3.9312 8.1520 112.7435 60.4730 61.0053 171.8943 1085 T 4.8975 7.0947 104.3735 60.0587 71.8837 173.0150 1086 V 4.2650 8.0080 119.9656 60.7629 34.7130 175.0671 1087 N 4.9432 7.9555 118.2183 51.6116 40.0209 174.6402 1088 V 3.6533 7.8934 123.1234 65.7855 32.1310 176.6759 1089 L 4.3117 8.1801 119.5795 58.2137 42.0865 178.9852 1090 G 3.6545 8.3652 105.2242 47.7878 0.0000 175.2870 1091 F 4.3290 8.4536 123.3440 60.8804 39.3654 176.9536 1092 L 3.8531 8.3872 120.1572 58.2091 41.7349 178.9767 1093 K 3.8761 8.1242 117.3561 59.6849 32.2418 178.5883 1094 H 4.3202 8.1573 118.6535 59.3173 29.8454 177.5283 1095 I 3.7451 7.6557 114.9099 63.6922 37.1067 178.1440 1096 R 4.0469 7.9392 119.6555 59.0850 29.8968 178.3472 1097 T 4.1297 7.7447 108.1210 63.5256 68.9809 175.0999 1098 Q 4.5429 8.1306 120.2765 56.7707 30.4391 176.1012 1099 R 4.1558 7.5742 116.2903 53.8518 33.5105 173.9784 1100 N 3.7174 7.4556 121.9898 54.6705 37.5370 174.8754 1101 Y 3.7273 8.2703 116.8311 58.3584 35.5274 168.9601 1102 L 3.9931 7.2392 119.5609 56.2607 41.8480 175.4167 1103 V 3.2990 8.3904 127.0847 63.2785 29.3383 170.9043 1104 Q 4.5626 9.6954 125.8152 56.3988 29.8266 176.4526 1105 T 4.6298 7.6789 107.2919 58.9744 73.0323 174.1991 1106 E 2.7240 7.7707 122.3081 58.9695 29.5818 178.7476 1107 E 3.7819 7.8557 118.9169 59.3892 29.7083 178.7376 1108 Q 4.1470 8.0803 118.0718 59.0229 28.7961 178.0170 1109 Y 4.2154 7.8340 120.6521 60.7768 38.7645 178.2598 1110 I 2.8969 7.8620 120.9664 64.0493 37.1334 178.1035 1111 F 3.9990 8.2708 121.4901 61.2416 39.0883 176.9422 1112 I 3.5625 7.9368 119.4251 64.9674 36.9038 178.1079 1113 H 4.2235 7.7415 115.2756 58.7316 28.4902 177.5236 1114 D 4.3336 8.2420 120.7532 57.3552 40.7098 178.7892 1115 A 3.7249 7.8338 121.3054 55.1042 18.2659 179.7080 1116 L 3.9340 7.9665 117.6101 57.6532 41.6704 179.3705 1117 L 3.9323 8.3137 120.7361 58.4408 41.8157 179.0033 1118 E 3.9561 8.1219 116.7960 59.2013 29.5756 178.9672 1119 A 4.1292 8.0958 120.8673 55.3088 18.2615 179.8151 1120 I 3.7149 7.7662 117.2494 64.3610 37.2851 178.2169 1121 L 4.3212 8.0519 118.1234 56.1659 41.7119 177.7956 1122 G 3.8774 7.5896 110.0278 44.8429 0.0000 173.3371 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 828 Q 8.19 4.70 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 829 S 8.74 4.39 0.00 4.01 4.03 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 0.00 830 M 8.87 4.11 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 831 K 8.06 3.93 0.00 1.83 1.82 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.55 7.81 832 Q 8.04 4.00 0.00 2.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 833 F 8.63 4.49 0.00 3.08 3.31 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 0.00 834 V 8.16 3.28 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 0.93 0.00 0.00 0.98 0.00 0.00 835 K 8.11 3.92 0.00 2.00 1.86 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.65 7.81 836 H 8.37 4.49 0.00 3.36 3.48 0.00 5.83 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 0.00 837 I 7.62 3.55 1.83 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.03 1.10 0.00 0.00 838 G 7.61 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 0.00 0.00 0.00 839 E 8.01 3.97 0.00 2.16 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 2.32 2.50 0.00 840 L 7.62 3.56 0.00 0.55 0.13 0.41 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 841 Y 7.95 4.30 0.00 3.36 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 0.00 842 S 7.25 4.49 0.00 3.97 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 0.00 843 N 9.27 4.10 0.00 2.79 2.84 0.00 0.00 6.68 6.91 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 0.00 844 N 8.86 4.56 0.00 2.88 2.94 0.00 0.00 7.24 7.69 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 0.00 845 Q 8.39 4.33 0.00 2.39 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.73 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 846 H 8.27 4.17 0.00 3.39 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 847 G 8.06 3.51 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 0.00 0.00 0.00 848 F 7.88 4.43 0.00 3.23 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 0.00 849 S 8.18 4.38 0.00 4.05 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 0.00 850 E 8.41 3.95 0.00 2.18 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 2.33 2.22 0.00 851 D 8.45 4.34 0.00 3.15 2.70 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 0.00 852 F 8.47 3.80 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 0.00 853 E 8.37 3.78 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 854 E 7.83 3.85 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 855 V 7.57 3.59 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.84 0.00 0.00 856 Q 7.67 3.85 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.56 0.00 0.00 0.00 0.00 0.00 2.06 1.55 0.00 857 R 7.63 4.42 0.00 1.91 1.89 0.00 3.24 0.00 0.00 3.22 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.48 0.00 858 C 7.77 4.36 0.00 3.13 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 0.00 859 T 7.43 4.39 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 860 A 7.85 4.00 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 0.00 861 D 7.93 4.86 0.00 2.75 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 0.00 862 M 7.74 4.52 0.00 1.85 1.86 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 863 N 8.65 4.54 0.00 2.67 2.67 0.00 0.00 6.93 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 0.00 864 I 7.97 4.33 1.30 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.71 -0.02 0.00 0.00 865 T 8.21 4.48 4.26 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 1.19 0.00 0.00 866 A 7.98 4.97 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 0.00 0.00 0.00 0.00 0.00 0.00 867 E 9.55 3.92 0.00 1.95 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 2.34 2.42 0.00 868 H 8.67 4.11 0.00 3.37 3.44 0.00 5.62 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 0.00 869 S 7.52 3.76 0.00 3.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 870 N 7.55 4.77 0.00 2.62 2.78 0.00 0.00 6.96 8.12 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 0.00 871 H 7.71 4.07 0.00 3.05 2.93 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 P 0.00 4.14 0.00 2.09 2.05 0.00 2.94 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 873 E 8.33 3.94 0.00 2.01 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 0.00 2.37 2.51 0.00 874 N 8.16 4.60 0.00 2.52 2.01 0.00 0.00 6.82 8.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 875 K 7.46 3.85 0.00 1.89 1.86 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.60 7.81 876 H 8.14 4.37 0.00 3.24 3.41 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 877 K 7.87 4.22 0.00 2.04 2.00 0.00 1.98 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.30 1.03 7.81 878 N 7.72 5.09 0.00 2.88 2.95 0.00 0.00 6.88 7.62 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 0.00 879 R 9.22 3.89 0.00 1.67 2.00 0.00 3.48 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.26 0.00 880 Y 7.60 4.71 0.00 3.00 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 0.00 881 I 8.74 3.70 1.90 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 1.44 0.77 0.96 0.00 0.00 882 N 8.17 4.74 0.00 2.75 2.87 0.00 0.00 6.79 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 883 I 7.60 4.38 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.70 1.03 0.00 0.00 884 L 8.72 4.70 0.00 1.75 1.66 1.00 0.61 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 0.00 885 A 8.53 4.73 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 886 Y 8.22 4.70 0.00 2.93 2.74 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 0.00 887 D 9.42 4.51 0.00 2.77 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 888 H 8.32 4.49 0.00 3.30 3.44 0.00 5.46 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 889 S 7.43 4.77 0.00 4.21 3.94 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 0.00 890 R 7.61 4.28 0.00 1.81 2.19 0.00 3.14 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.53 0.00 891 V 7.80 3.59 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 -0.04 0.00 0.00 892 K 8.52 4.74 0.00 1.69 1.71 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.47 7.81 893 L 8.58 4.53 0.00 1.74 1.60 0.97 0.89 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 0.00 894 R 8.90 4.02 0.00 1.99 1.92 0.00 3.24 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 895 P 0.00 4.41 0.00 2.05 2.00 0.00 3.69 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 2.04 2.12 0.00 896 L 8.35 4.43 0.00 1.65 1.61 0.96 1.29 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 0.00 897 P 0.00 4.25 0.00 2.05 2.09 0.00 3.72 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 2.09 0.00 *901 S 7.90 4.22 0.00 3.90 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 0.00 902 K 8.74 3.75 0.00 1.66 1.69 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.12 7.81 903 H 7.97 4.88 0.00 3.24 3.48 0.00 5.67 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 904 S 7.97 4.44 0.00 4.04 4.03 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 0.00 905 D 8.02 4.85 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 0.00 906 Y 7.81 4.63 0.00 3.09 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 0.00 907 I 6.83 4.16 1.70 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.80 0.71 0.00 0.00 908 N 8.16 4.54 0.00 2.99 2.67 0.00 0.00 6.79 8.15 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 0.00 909 A 7.44 4.75 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 910 N 8.89 5.27 0.00 2.58 2.67 0.00 0.00 7.06 7.76 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 0.00 911 Y 8.42 4.60 0.00 2.89 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 0.00 912 V 9.05 4.74 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 1.04 0.00 0.00 0.95 0.00 0.00 913 D 9.76 5.11 0.00 2.80 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 0.00 914 G 8.91 4.44 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 0.00 0.00 0.00 915 Y 8.53 4.18 0.00 2.85 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 0.00 916 N 6.68 4.62 0.00 1.44 1.60 0.00 0.00 6.92 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 917 K 7.75 4.22 0.00 1.62 1.47 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.30 1.34 7.81 918 A 8.55 4.44 1.20 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 0.00 0.00 919 K 9.07 3.97 0.00 1.74 1.73 0.00 1.34 0.00 0.00 0.66 0.00 0.00 2.62 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.22 1.23 7.81 920 A 7.93 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 921 Y 8.35 5.42 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 0.00 922 I 8.86 4.82 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.72 0.71 0.00 0.00 923 A 8.80 5.05 1.20 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 0.00 0.00 924 T 8.59 5.04 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 1.21 0.00 0.00 925 Q 8.21 4.44 0.00 2.37 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 926 G 8.81 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 0.00 927 P 0.00 4.50 0.00 2.10 1.72 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 928 L 8.33 4.84 0.00 1.65 1.48 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 929 K 8.41 2.00 0.00 1.51 1.50 0.00 1.56 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.17 1.18 7.81 930 S 7.79 4.20 0.00 4.01 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 0.00 931 T 7.92 4.61 4.28 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 1.22 0.00 0.00 932 F 8.16 4.46 0.00 3.22 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 0.00 933 E 8.56 4.30 0.00 2.16 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 2.61 2.62 0.00 934 D 8.26 4.42 0.00 2.94 2.74 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 0.00 935 F 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0.00 7.16 7.14 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 0.00 944 T 7.72 4.46 4.16 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 1.22 0.00 0.00 945 G 8.69 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 0.00 0.00 0.00 0.00 946 I 7.66 5.33 1.92 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.04 1.01 0.00 0.00 947 I 9.01 4.91 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.67 1.09 0.00 0.00 948 V 9.17 4.83 1.74 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 0.52 0.00 0.00 0.70 0.00 0.00 949 M 9.33 4.74 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 950 I 7.86 4.78 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.66 0.46 0.00 0.00 951 T 7.55 4.57 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 1022 H 9.69 5.40 0.00 3.08 3.35 0.00 5.60 0.00 0.00 0.00 0.00 6.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1023 Y 9.06 4.40 0.00 1.82 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 1024 T 8.24 4.55 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 1.00 0.00 0.00 1025 Q 7.01 4.59 0.00 1.70 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 1026 W 8.56 4.26 0.00 3.61 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 1027 P 0.00 4.54 0.00 2.37 1.96 0.00 2.88 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 1028 D 8.76 4.57 0.00 2.86 2.90 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 1029 M 7.82 4.69 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 1030 G 8.71 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 0.00 0.00 0.00 0.00 1031 V 7.72 4.02 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 0.76 0.00 0.00 0.81 0.00 0.00 1032 P 0.00 3.83 0.00 1.55 1.60 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 1033 E 8.45 3.84 0.00 1.99 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 2.23 1.90 0.00 1034 Y 7.46 4.79 0.00 3.01 2.90 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 1035 A 8.79 4.33 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 1036 L 8.12 3.96 0.00 1.82 1.76 0.97 0.96 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 1037 P 0.00 4.44 0.00 2.63 2.48 0.00 3.92 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 2.38 2.20 0.00 1038 V 7.95 3.66 2.42 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 1.14 0.00 0.00 0.73 0.00 0.00 1039 L 8.36 4.00 0.00 1.92 1.72 0.95 0.69 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 1040 T 8.26 3.93 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 1041 F 8.42 3.78 0.00 3.24 3.31 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 1042 V 8.49 3.49 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 0.64 0.00 0.00 0.90 0.00 0.00 1043 R 8.37 3.84 0.00 1.94 1.93 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 1044 R 8.13 3.86 0.00 1.77 2.04 0.00 3.33 0.00 0.00 3.43 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 1045 S 7.30 2.79 0.00 3.20 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 1046 S 7.99 4.21 0.00 4.08 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 0.00 1047 A 7.92 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1048 A 7.40 4.22 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 1049 R 7.33 3.92 0.00 1.80 1.96 0.00 3.19 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 1050 M 8.26 4.52 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.67 0.00 1051 P 0.00 4.29 0.00 2.15 1.95 0.00 3.73 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 2.10 2.09 0.00 1052 E 8.71 3.67 0.00 2.09 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 2.18 2.20 0.00 1053 T 7.03 4.56 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 1.27 0.00 0.00 1054 G 8.04 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 1055 P 0.00 4.64 0.00 2.00 2.23 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 1056 V 8.38 3.96 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 1.09 0.00 0.00 0.93 0.00 0.00 1057 L 8.78 4.77 0.00 1.64 1.43 0.21 0.56 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 1058 V 9.11 4.87 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 0.70 0.00 0.00 0.92 0.00 0.00 1059 H 9.29 5.51 0.00 3.35 3.31 0.00 5.45 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1060 C 8.53 4.81 0.00 2.80 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 0.00 0.00 0.00 1061 S 9.41 4.73 0.00 4.02 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1062 A 8.09 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1063 G 8.14 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 1064 V 7.78 4.16 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 0.85 0.00 0.00 0.90 0.00 0.00 1065 G 7.30 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 0.00 0.00 0.00 1066 R 7.47 3.56 0.00 1.39 1.01 0.00 2.69 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 1067 T 7.82 3.87 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 1.24 0.00 0.00 1068 G 7.91 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 1069 T 8.10 4.01 4.51 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 1.65 0.00 0.00 1070 Y 8.25 4.01 0.00 3.12 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 1071 I 7.92 3.39 1.91 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.33 0.83 0.00 0.00 1072 V 8.16 3.88 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.17 0.00 0.00 1073 I 7.80 3.59 1.77 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.63 0.82 0.00 0.00 1074 D 7.99 4.09 0.00 2.16 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 1075 S 8.11 4.10 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 1076 M 8.15 3.76 0.00 1.74 1.98 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 1077 L 7.94 3.84 0.00 1.70 1.60 0.83 0.90 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 1078 Q 7.99 3.84 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 1079 Q 7.35 2.72 0.00 1.37 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.03 0.00 1080 I 7.63 3.60 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.52 0.84 0.00 0.00 1081 K 7.57 3.79 0.00 1.81 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.52 7.81 1082 D 8.03 4.50 0.00 2.68 2.66 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 0.00 0.00 0.00 1083 K 8.27 4.46 0.00 1.74 1.74 0.00 2.01 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.26 1.30 7.81 1084 S 8.15 3.93 0.00 3.96 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1085 T 7.09 4.90 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1086 V 8.01 4.26 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.13 0.00 0.00 1087 N 7.96 4.94 0.00 2.76 2.70 0.00 0.00 6.68 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 1088 V 7.89 3.65 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 1.10 0.00 0.00 0.77 0.00 0.00 1089 L 8.18 4.31 0.00 2.07 1.81 1.04 1.15 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 1090 G 8.37 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 1091 F 8.45 4.33 0.00 3.21 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 1092 L 8.39 3.85 0.00 2.07 2.00 1.06 1.33 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 1093 K 8.12 3.88 0.00 1.93 1.88 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.59 7.81 1094 H 8.16 4.32 0.00 3.26 3.41 0.00 5.78 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 1095 I 7.66 3.75 1.68 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.27 0.00 0.00 1096 R 7.94 4.05 0.00 2.02 2.02 0.00 3.26 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 1097 T 7.74 4.13 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 1.22 0.00 0.00 1098 Q 8.13 4.54 0.00 2.16 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.21 0.00 1099 R 7.57 4.16 0.00 1.59 1.63 0.00 3.25 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.45 0.00 1100 N 7.46 3.72 0.00 1.72 2.26 0.00 0.00 6.32 7.57 0.00 0.00 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 Y 8.27 3.73 0.00 3.22 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 1102 L 7.24 3.99 0.00 1.72 1.64 0.90 0.84 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 1103 V 8.39 3.30 2.34 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 0.98 0.00 0.00 1.09 0.00 0.00 1104 Q 9.70 4.56 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.45 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 1105 T 7.68 4.63 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 1.19 0.00 0.00 1106 E 7.77 2.72 0.00 1.64 1.73 0.00 0.00 0.00 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 2.28 0.00 1107 E 7.86 3.78 0.00 1.98 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 2.32 2.34 0.00 1108 Q 8.08 4.15 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 1109 Y 7.83 4.22 0.00 3.03 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1110 I 7.86 2.90 1.66 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.14 0.25 0.00 0.00 1111 F 8.27 4.00 0.00 3.16 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 1112 I 7.94 3.56 1.95 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.71 0.82 0.00 0.00 1113 H 7.74 4.22 0.00 3.44 3.44 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1114 D 8.24 4.33 0.00 2.59 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 1115 A 7.83 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1116 L 7.97 3.93 0.00 1.85 1.91 0.84 0.30 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 1117 L 8.31 3.93 0.00 1.78 1.82 0.86 0.82 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 1118 E 8.12 3.96 0.00 2.07 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 2.33 2.49 0.00 1119 A 8.10 4.13 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 1120 I 7.77 3.71 2.03 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.74 0.95 0.00 0.00 1121 L 8.05 4.32 0.00 1.62 1.71 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 1122 G 7.59 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.