NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 826 E 4.2451 8.4401 121.4764 55.4790 30.8240 175.0374 827 A 4.3929 8.3529 123.9761 50.3710 19.2001 175.3767 828 I 4.6999 9.4417 114.1129 58.1581 41.7250 171.8622 829 P 4.7225 0.0000 0.0000 62.6577 32.2093 177.4032 830 V 3.6224 8.5628 121.9528 66.3480 31.1780 178.5062 831 K 3.9174 8.0502 118.5461 59.6703 32.0259 178.3394 832 Q 3.9880 8.0959 119.2990 59.0685 29.0200 177.7430 833 F 4.2428 8.5663 121.9240 61.2869 39.5937 177.1964 834 V 3.3676 8.1380 118.0223 66.0468 31.3544 178.2004 835 K 4.0383 7.8167 118.2470 59.6379 31.8158 178.7291 836 H 4.1441 8.5184 118.8767 59.3423 29.6763 177.3292 837 I 3.5450 7.5710 121.7914 64.1693 36.6653 178.5972 838 G 3.6514 7.3209 104.5938 47.7061 0.0000 175.0668 839 E 4.0482 8.0736 121.6727 59.0706 29.5393 178.9221 840 L 3.5228 7.8798 119.3918 57.7376 41.3594 179.1224 841 Y 4.2446 7.9672 116.9240 59.6888 37.7595 176.4134 842 S 4.4466 7.1095 113.0642 58.7400 63.9842 172.7187 843 N 4.0389 9.1094 115.7698 55.3462 36.7571 173.2048 844 N 4.3560 8.9825 108.1349 54.9723 38.0046 173.5260 845 Q 4.2412 8.2698 110.3530 56.9276 27.3907 175.4789 846 H 4.2159 8.2203 120.3152 59.6771 29.6215 177.2983 847 G 3.5053 7.9961 106.7564 47.6828 0.0000 175.5345 848 F 4.4179 7.8946 119.6238 60.5537 39.0188 177.6729 849 S 4.5379 8.0442 115.8621 61.0876 62.6461 176.6607 850 E 3.9267 8.1363 121.1030 59.5099 29.2419 179.0335 851 D 4.3581 8.2633 118.9598 57.5150 40.8602 178.8260 852 F 3.7557 8.3856 121.3088 61.0218 39.3386 176.6827 853 E 3.7600 8.3193 119.0669 59.1373 29.1662 178.3815 854 E 3.8370 7.8664 118.3806 59.1712 30.0118 178.6280 855 V 3.5979 7.5760 118.1543 66.2134 31.3476 178.0550 856 Q 3.8134 7.5872 116.5107 58.3082 28.8396 177.5695 857 R 4.3436 7.6735 117.1172 56.2600 30.6272 177.5126 858 C 4.3552 7.7409 113.2198 59.8306 30.0546 174.2670 859 T 4.4618 7.6167 109.2846 61.0886 69.0732 175.2873 860 A 3.9368 7.8683 126.7466 55.2115 18.3500 178.7319 861 D 4.8263 7.8951 112.2609 54.5574 41.2545 176.8787 862 M 4.1324 7.9383 119.1558 55.1925 32.5542 175.7659 863 N 4.1065 7.9741 114.8280 54.0616 36.1723 174.6287 864 I 3.7110 7.5216 118.2481 61.1842 38.0242 176.4850 865 T 4.4240 8.2128 115.0903 60.8011 71.2654 174.2938 866 A 4.9566 8.0119 123.0431 50.3866 19.2180 177.2104 867 E 4.0006 9.4282 124.0390 59.4237 30.3435 179.1682 868 H 4.2195 8.3849 115.7505 59.0060 28.6104 177.8607 869 S 3.8179 8.0403 116.4405 60.8519 62.7951 175.7919 870 N 4.5504 7.6659 115.7655 53.3186 39.0905 174.9981 871 H 4.1905 7.5986 122.3902 54.9956 30.6384 174.0617 872 P 4.2767 0.0000 0.0000 65.9674 30.8568 178.3413 873 E 4.0473 8.3083 116.4464 58.3952 29.9381 177.3223 874 N 4.6103 8.2144 115.2856 52.8154 39.0702 176.4790 875 K 3.7946 7.6275 123.0006 59.7875 32.1064 177.8989 876 H 4.3961 8.1641 111.3769 57.3133 28.6081 175.7209 877 K 4.2535 8.0500 119.1888 56.6405 32.4115 175.9206 878 N 5.0058 7.7117 117.5123 51.1542 40.2306 175.0777 879 R 3.8238 9.0896 124.2911 58.5674 30.6365 176.4319 880 Y 4.7490 7.5614 114.7530 55.7067 41.2555 175.9523 881 I 3.7292 8.7787 125.1733 63.8103 38.2102 176.0547 882 N 4.6363 8.1832 114.5818 52.9872 37.7574 174.6942 883 I 4.3933 7.6388 120.8172 60.0448 37.4662 175.0635 884 L 4.5265 8.6999 125.2969 53.0247 43.4345 176.4868 885 A 4.7794 8.2945 122.6629 49.4470 19.8068 176.4075 886 Y 4.7381 8.1052 120.5744 58.9532 38.6706 177.6564 887 D 4.5378 9.4665 125.0540 57.8564 41.0941 178.7916 888 H 4.3209 8.3849 112.7911 57.3890 28.9313 175.7828 889 S 4.7723 7.4394 113.3417 57.4501 63.7319 174.1548 890 R 4.3459 7.5641 118.0919 56.2265 29.8170 176.1384 891 V 3.5575 7.8124 120.8395 62.3607 32.1117 175.2430 892 K 4.7107 8.5363 127.1704 54.9256 33.4733 176.1349 893 L 4.5313 8.5746 124.8751 53.7349 43.2692 176.8742 894 R 4.0516 8.9877 122.1483 56.1761 30.6034 175.3006 895 P 4.4660 0.0000 0.0000 62.4242 32.1977 175.7064 896 L 4.5645 8.7733 122.3016 52.6349 42.9206 175.1805 897 P 4.4497 0.0000 0.0000 63.3202 32.5359 176.8698 898 G 3.8421 8.4788 104.3773 44.1096 0.0000 172.8170 899 K 4.0905 8.3463 118.7496 57.8327 31.3958 176.1238 900 D 4.5161 8.9730 120.2938 55.2050 38.8111 175.9764 901 S 4.4446 7.7649 116.3077 60.7068 63.1047 176.2421 902 K 3.6717 8.1920 121.0041 59.7507 31.7830 176.7548 903 H 4.8016 7.5850 111.5380 55.7926 28.6485 177.0049 904 S 4.4251 7.9026 114.7222 59.8374 62.9319 174.4774 905 D 4.8114 8.0008 119.8859 53.0607 39.6956 174.7632 906 Y 4.7528 7.7315 122.9410 56.2042 40.0656 174.0771 907 I 4.0798 6.9414 125.3707 58.8836 40.9577 174.6933 908 N 4.4965 8.0617 124.7171 52.7145 38.2662 172.7248 909 A 4.7024 7.5076 123.2842 50.5959 22.8356 174.5080 910 N 5.3158 8.8757 117.6537 51.2834 43.1754 173.7704 911 Y 4.6101 8.6027 120.5428 58.3193 38.8885 175.7347 912 V 4.7859 9.0807 122.7228 61.1271 35.2118 174.6585 913 D 5.0927 9.6820 127.6280 54.7039 41.6993 176.2139 914 G 4.5291 8.7176 110.7864 43.7798 0.0000 171.7843 915 Y 3.9367 8.5578 120.9150 58.4811 38.7359 175.7144 916 N 3.7792 8.2505 126.9447 53.4073 37.6266 174.2341 917 K 4.0638 7.4209 115.0371 55.1311 34.4576 173.9745 918 A 4.4856 8.5458 130.2671 53.1816 18.9819 176.6884 919 K 3.9223 9.0793 120.0444 57.4708 30.3621 177.0748 920 A 4.0342 8.0158 121.5225 54.3503 19.5561 177.8788 921 Y 5.3559 8.4669 111.9849 56.3795 42.9874 174.7644 922 I 4.8481 8.8305 121.9271 59.6622 39.9215 174.5155 923 A 5.0363 8.9432 130.2022 50.9320 20.7592 175.8395 924 T 5.0858 8.6670 116.6306 60.3465 71.7437 172.9115 925 Q 4.6515 8.2141 122.0581 55.2540 29.9707 176.1474 926 G 3.7413 8.7224 109.0013 45.7060 0.0000 172.0156 927 P 4.4909 0.0000 0.0000 62.8862 32.7533 175.8104 928 L 5.2532 8.3849 120.7510 52.6773 43.4402 177.9321 929 K 2.0000 8.4625 120.5859 59.3523 31.6720 179.4772 930 S 4.2735 7.8356 111.9540 60.1610 63.2153 175.1355 931 T 4.5885 7.7880 112.7883 61.3420 69.0312 175.5868 932 F 4.5095 7.9456 122.6826 61.2661 38.9964 177.1924 933 E 4.3095 8.5723 117.5361 59.7542 29.3164 178.9362 934 D 4.4331 8.2942 118.3505 57.3079 40.9321 178.5398 935 F 3.9006 8.6625 121.3861 61.2531 39.3558 177.3712 936 W 4.1872 8.4803 118.5205 59.4767 28.7979 178.6457 937 R 4.0351 8.4518 119.1126 59.4978 29.4506 178.0954 938 M 3.9231 8.3474 118.4211 58.7862 32.1932 178.0719 939 I 3.4971 7.4555 119.7429 64.1033 37.3581 178.1568 940 W 3.9530 8.5880 129.1118 60.7506 30.4665 178.0030 941 E 4.1282 8.8283 117.3629 58.9665 29.2692 178.4543 942 Q 4.2839 8.4337 116.4385 54.7397 29.3058 175.2948 943 N 4.2817 7.9204 118.0004 54.5361 38.0093 173.7371 944 T 4.3473 7.7800 113.1392 63.2547 69.2766 174.9890 945 G 4.1870 8.6830 111.2117 46.0240 0.0000 172.5756 946 I 5.3942 7.7108 121.0981 59.5237 41.3472 174.2178 947 I 4.9684 9.0930 127.3620 59.4827 40.2521 174.5826 948 V 4.8192 9.2476 127.5113 61.4465 33.5829 173.7818 949 M 4.8241 9.4817 128.7499 53.0703 34.4570 175.7954 950 I 4.8046 7.7982 127.6199 59.7752 36.4771 174.7531 951 T 4.5681 7.6381 113.7091 61.4441 70.4606 171.9326 952 N 5.0640 9.0598 123.8329 51.7361 40.5089 175.9138 953 L 4.3277 8.6800 119.6107 57.3491 41.9347 177.8467 954 V 4.7934 7.6407 115.9121 60.8631 34.3749 174.1624 955 E 4.5226 9.0063 125.9424 55.4126 32.3754 175.9659 956 K 3.9540 9.9171 127.0557 57.4784 30.5457 175.4182 957 G 3.9519 8.2428 103.7972 45.5822 0.0000 173.1321 958 R 4.5145 7.7113 119.9169 53.9236 31.5811 175.6815 959 R 4.3591 8.6260 123.8575 56.4656 30.2521 175.7224 960 K 4.6355 9.2865 124.4615 57.4838 34.8486 175.6235 961 C 4.7404 7.8766 116.4594 58.5793 34.5674 172.9492 962 D 4.9249 8.5590 124.0826 52.9015 43.0626 176.1751 963 Q 3.3903 8.6381 122.9692 55.8192 28.1974 174.8027 964 Y 2.9618 7.4405 122.9673 55.6159 38.3814 175.2259 965 W 5.1447 6.5364 116.3560 53.7285 31.2964 172.9865 966 P 4.4378 0.0000 0.0000 62.8814 31.4423 176.5679 967 T 4.1010 8.5672 120.1694 66.4197 68.6107 173.8080 968 E 4.7674 7.9887 115.4748 55.7344 33.2785 176.6417 969 N 3.8723 8.5192 116.5501 55.0994 37.2243 174.5985 970 S 5.4591 8.5415 120.7884 57.7876 66.2863 172.6708 971 E 4.5135 8.8809 122.0585 54.3971 33.3487 173.5132 972 E 4.6612 8.2786 125.8808 54.7298 31.5995 175.0884 973 Y 4.6393 8.9525 125.1704 56.6409 39.8625 177.1718 974 G 3.8533 8.1379 117.7832 47.1576 0.0000 172.2578 975 N 4.6456 8.8667 123.0475 52.7335 38.7216 173.3066 976 I 4.7246 7.7733 121.1518 59.6436 39.5551 174.5055 977 I 4.6450 8.8238 128.8866 59.6114 39.3107 174.7746 978 V 4.5913 8.5938 127.6617 61.2992 33.8161 174.2276 979 T 5.1592 8.9943 124.9366 61.4832 71.2606 173.1923 980 L 4.3330 8.8948 129.6593 55.3445 42.0474 176.2428 981 K 4.5727 8.8974 126.4251 57.9161 33.8886 176.7994 982 S 4.6632 7.3713 111.6460 57.6053 66.3244 173.7774 983 T 4.9097 8.2507 116.8987 61.9212 72.0950 173.3273 984 K 4.5054 9.1270 125.9920 54.5604 35.2702 175.0260 985 I 4.5089 8.2562 125.8188 59.9649 38.5348 174.9548 986 H 4.6932 8.6262 123.6255 53.2163 31.6823 175.2130 987 A 4.0875 8.5875 122.8907 55.1572 18.2395 178.3549 988 C 4.4747 7.8910 110.8092 59.7912 29.8285 172.4422 989 Y 5.1687 7.0576 117.5027 56.3303 41.6252 173.6193 990 T 5.0109 9.4504 116.2339 61.7114 72.8574 173.2891 991 V 4.5877 8.8011 125.0838 61.1450 34.2799 174.2979 992 R 4.7664 8.8420 127.3377 54.2513 32.9460 174.6371 993 R 4.7908 8.4570 124.7967 54.7256 32.1067 174.9284 994 F 5.4514 9.4771 124.5269 55.7880 43.1763 173.8351 995 S 5.3706 9.0946 116.8034 56.7184 64.4292 172.8004 996 I 5.1202 9.1424 120.7554 59.1089 40.7129 174.2920 997 R 5.0245 8.9369 124.8663 54.5895 33.4015 173.4532 998 N 4.7869 7.9946 125.3226 52.2712 39.2400 175.7852 999 T 3.9684 8.9865 117.8254 63.4078 68.9830 175.1104 1000 K 4.4828 8.0278 120.5765 56.3000 33.7338 176.6010 1001 V 4.1897 6.8573 117.8941 63.0784 30.8912 175.8296 *1014 N 5.0441 8.9306 114.8711 52.9588 40.4339 172.0006 1015 E 5.4803 8.3379 115.4970 54.7370 33.1605 175.1611 1016 R 4.8212 9.5701 121.0773 54.5502 35.2123 174.1696 1017 V 4.6340 8.4031 121.0890 62.1942 32.9705 175.3001 1018 V 4.8046 9.0341 127.0778 61.2816 34.7858 173.8678 1019 I 4.9552 8.8438 128.4924 59.6300 39.8889 174.1338 1020 Q 5.0998 9.3389 128.8202 54.7577 31.2594 173.7179 1021 Y 4.7595 9.4282 125.6428 57.1115 39.6833 174.3593 1022 H 5.4704 9.9014 126.6011 54.5731 31.8320 172.4506 1023 Y 4.4853 9.1906 129.1914 57.1732 38.9160 175.0817 1024 T 4.4164 8.1613 115.8342 61.1600 70.0743 174.6879 1025 Q 4.5433 6.9369 119.8375 55.2912 29.5247 175.0408 1026 W 4.1431 8.4874 129.0592 56.3640 31.2205 174.2226 1027 P 4.5243 0.0000 0.0000 62.7011 31.3642 176.2809 1028 D 4.5969 8.7216 119.6316 56.8758 41.0877 176.8463 1029 M 4.7616 7.5259 116.8971 54.2709 35.7518 177.1096 1030 G 3.8223 8.6701 110.3333 45.1998 0.0000 172.8788 1031 V 4.0838 7.7769 111.8018 58.2495 34.3421 173.7739 1032 P 3.9394 0.0000 0.0000 62.5306 31.6123 176.7007 1033 E 3.8400 8.6834 122.7430 58.3885 29.8430 176.6421 1034 Y 4.6777 7.6396 115.0346 55.7975 40.4461 176.2062 1035 A 4.3336 8.7250 126.3515 54.5207 18.5299 179.0729 1036 L 3.9410 8.2062 119.2876 58.2276 42.0616 177.4535 1037 P 4.4548 0.0000 0.0000 65.8377 31.1950 178.5136 1038 V 3.5774 7.9279 117.6275 65.8083 31.6240 177.5663 1039 L 3.9860 8.3256 119.1715 58.3101 41.4129 179.7305 1040 T 3.8831 8.1805 115.3643 66.5847 68.3921 176.3356 1041 F 3.7271 8.3921 122.4272 61.2053 39.3404 177.1267 1042 V 3.4109 8.4402 118.0285 66.1108 31.2425 178.0971 1043 R 3.8068 8.3199 117.8971 59.4149 29.3997 179.4032 1044 R 3.8718 8.0663 118.1958 59.1296 29.8844 179.2813 1045 S 2.7900 7.3055 113.1474 60.6862 63.2199 176.2208 1046 S 4.1445 8.1258 116.8535 61.1376 61.9822 176.0291 1047 A 4.0229 7.8450 121.7357 54.5806 18.1351 178.7997 1048 A 4.2645 7.2778 117.0670 52.6188 18.7155 177.6438 1049 R 3.8801 7.3447 118.4774 56.6136 30.3679 175.8230 1050 M 4.5575 8.2639 124.8258 53.0279 33.9161 174.3522 1051 P 4.3465 0.0000 0.0000 63.4723 32.2598 175.7752 1052 E 3.7341 8.6329 117.2352 58.1785 26.8036 173.7547 1053 T 4.5752 7.5952 106.1885 59.2569 72.1243 172.9113 1054 G 4.3646 8.4964 109.6034 44.0056 0.0000 171.7562 1055 P 4.6329 0.0000 0.0000 62.6974 32.1884 176.3804 1056 V 3.8673 8.3058 122.1971 62.7281 32.9030 174.4709 1057 L 4.7801 8.7115 130.4810 54.1495 43.6025 175.1636 1058 V 4.8666 9.0736 126.8505 61.3161 34.3052 173.9118 1059 H 5.5745 9.3256 122.6531 53.3292 32.4838 173.7716 1060 C 4.5812 8.5820 114.9377 58.9235 30.6624 174.7738 1061 S 4.7923 9.4650 111.6029 59.5183 61.6585 174.1369 1062 A 4.4003 8.1077 123.1314 52.7268 18.8683 177.6200 1063 G 4.2207 8.1031 102.4825 46.2497 0.0000 174.8595 1064 V 4.1696 7.8034 112.1196 62.1378 33.7540 177.6899 1065 G 3.7768 7.2454 106.6458 47.1313 0.0000 175.7124 1066 R 3.5533 7.4201 118.7334 58.2551 30.0799 179.1724 1067 T 3.8893 7.8185 115.2713 66.7578 68.4667 176.4779 1068 G 3.7143 7.9646 106.8241 48.1104 0.0000 175.4609 1069 T 4.0013 8.1353 118.1052 66.5954 68.4699 175.8337 1070 Y 4.0317 8.3149 121.4925 60.8865 38.8052 178.1602 1071 I 3.3325 7.9191 120.5284 64.3819 37.1409 178.6402 1072 V 3.8506 8.2722 119.2686 66.0483 31.3189 178.0975 1073 I 3.5759 7.8253 119.5079 64.3729 36.9794 177.8064 1074 D 4.0980 7.9730 119.0615 57.5148 40.9481 178.5838 1075 S 4.0699 8.1161 115.5551 61.8998 62.7747 176.6784 1076 M 3.7593 8.1839 121.7542 57.9751 31.6178 178.7672 1077 L 3.8474 7.9502 119.5269 57.8345 41.7083 179.5703 1078 Q 3.8281 7.8213 117.9067 58.8270 28.5463 178.6321 1079 Q 2.5200 7.3542 120.5037 58.6979 28.9948 178.2857 1080 I 3.4863 7.7441 121.1796 64.1589 36.8762 178.3426 1081 K 3.8412 7.6357 119.2278 59.5499 32.1258 178.1095 1082 D 4.4918 7.9022 117.2101 56.4536 39.9888 176.6981 1083 K 4.4928 8.0268 115.3383 54.7541 34.4269 176.3516 1084 S 3.8498 8.1958 114.8148 59.5583 61.0105 171.7744 1085 T 5.0154 7.0961 105.7010 59.8710 71.9918 172.9708 1086 V 4.1812 8.4280 120.5331 61.4898 35.2262 174.8097 1087 N 4.9849 7.9639 121.8020 51.6547 39.3789 175.0963 1088 V 3.6577 7.8009 123.1461 66.1513 32.2643 176.6720 1089 L 4.3397 8.1720 119.7496 58.2072 42.1428 178.9090 1090 G 3.6745 8.1882 105.2793 47.8136 0.0000 175.3064 1091 F 4.3541 8.6208 123.4478 60.9238 39.4563 177.0172 1092 L 3.8695 8.5022 120.3811 58.1227 41.7122 179.0188 1093 K 3.9423 8.1202 117.5327 59.6199 32.3754 178.5180 1094 H 4.3088 8.2746 118.6887 59.2982 29.8451 177.4444 1095 I 3.6159 7.6119 114.5680 63.4469 37.1838 178.0892 1096 R 4.1272 7.8267 119.7176 59.3438 29.8750 178.5346 1097 T 4.0515 7.6968 108.2072 64.0208 68.8379 175.7705 1098 Q 4.5338 8.1637 120.0566 55.9643 30.0005 175.9132 1099 R 4.1657 7.2876 118.4523 54.1158 33.5350 174.0202 1100 N 3.8918 7.5340 122.4002 54.4099 37.2941 174.9536 1101 Y 3.8108 8.2922 116.6034 58.3798 35.5972 169.0995 1102 L 4.2961 7.2846 119.3829 56.2000 41.8817 175.3960 1103 V 3.3003 8.3646 127.1054 63.2344 29.3841 170.9955 1104 Q 4.5717 9.8482 126.3964 56.5254 29.8063 176.5370 1105 T 4.6016 7.6162 107.2115 58.9003 72.8844 174.1506 1106 E 2.8596 7.8513 122.3495 59.2366 29.4706 179.1003 1107 E 3.9440 7.8557 118.1152 59.3621 29.5567 179.1915 1108 Q 4.1129 8.0476 118.1258 59.0667 28.7469 177.9776 1109 Y 4.1796 7.9717 120.5468 60.8559 38.7466 178.3476 1110 I 2.9420 7.9368 120.9983 64.0582 37.0929 178.0539 1111 F 3.9914 8.4491 121.8013 61.3140 39.0108 177.0530 1112 I 3.6142 7.9208 119.3306 64.8578 36.8677 178.1301 1113 H 4.2422 7.7611 115.3623 58.8364 28.5444 177.4637 1114 D 4.3483 8.2090 120.6449 57.3703 40.6876 178.9141 1115 A 3.7199 7.8484 121.3048 55.1304 18.2862 179.7122 1116 L 3.9269 8.0703 117.8289 57.7024 41.5708 179.4622 1117 L 4.0067 8.3738 120.7358 58.3660 42.1537 178.9676 1118 E 3.9391 8.2604 118.2350 59.2004 29.1084 179.2540 1119 A 3.9725 7.8502 120.0240 55.2358 18.5555 179.4449 1120 I 3.8083 7.8255 117.3939 64.5548 37.3141 178.4052 1121 L 4.3017 8.1783 118.4315 56.6345 41.6157 177.8875 1122 G 3.8667 7.6920 109.9043 44.9423 0.0000 173.2031 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 826 E 8.44 4.25 0.00 1.94 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 2.20 2.39 0.00 827 A 8.35 4.39 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 0.00 828 I 9.44 4.70 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.25 1.01 0.00 0.00 829 P 0.00 4.72 0.00 2.12 2.02 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 830 V 8.56 3.62 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 1.13 0.00 0.00 0.90 0.00 0.00 831 K 8.05 3.92 0.00 1.88 1.81 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.52 7.81 832 Q 8.10 3.99 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 833 F 8.57 4.24 0.00 3.14 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 0.00 834 V 8.14 3.37 2.32 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 0.96 0.00 0.00 1.03 0.00 0.00 835 K 7.82 4.04 0.00 1.79 1.83 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.59 7.81 836 H 8.52 4.14 0.00 3.33 3.43 0.00 5.79 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 0.00 837 I 7.57 3.55 1.89 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 1.17 0.19 1.17 0.00 0.00 838 G 7.32 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 0.00 839 E 8.07 4.05 0.00 2.03 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 2.24 2.29 0.00 840 L 7.88 3.52 0.00 0.59 0.13 0.42 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 841 Y 7.97 4.24 0.00 3.28 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 S 7.11 4.45 0.00 4.01 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 0.00 843 N 9.11 4.04 0.00 2.98 2.88 0.00 0.00 6.55 6.71 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 0.00 844 N 8.98 4.36 0.00 2.88 2.88 0.00 0.00 7.31 7.08 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 0.00 845 Q 8.27 4.24 0.00 2.45 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.52 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 846 H 8.22 4.22 0.00 3.34 3.34 0.00 5.78 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 8.00 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 7.89 4.42 0.00 3.27 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 0.00 849 S 8.04 4.54 0.00 4.08 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 0.00 850 E 8.14 3.93 0.00 2.09 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 2.27 2.37 0.00 851 D 8.26 4.36 0.00 3.04 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 0.00 852 F 8.39 3.76 0.00 2.87 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 0.00 853 E 8.32 3.76 0.00 2.20 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 2.29 2.32 0.00 854 E 7.87 3.84 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 855 V 7.58 3.60 1.67 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 0.81 0.00 0.00 0.89 0.00 0.00 856 Q 7.59 3.81 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 1.36 2.16 0.00 857 R 7.67 4.34 0.00 1.82 1.90 0.00 3.08 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 858 C 7.74 4.36 0.00 3.07 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 859 T 7.62 4.46 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 1.17 0.00 0.00 860 A 7.87 3.94 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 0.00 861 D 7.90 4.83 0.00 2.62 2.65 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 0.00 862 M 7.94 4.13 0.00 1.89 2.11 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 2.53 2.43 0.00 863 N 7.97 4.11 0.00 2.79 2.83 0.00 0.00 6.99 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 0.00 864 I 7.52 3.71 1.09 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 1.15 0.18 0.01 0.00 0.00 865 T 8.21 4.42 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 1.24 0.00 0.00 866 A 8.01 4.96 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 9.43 4.00 0.00 1.82 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 2.52 2.49 0.00 868 H 8.38 4.22 0.00 3.35 3.40 0.00 5.63 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 0.00 869 S 8.04 3.82 0.00 4.05 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 0.00 870 N 7.67 4.55 0.00 2.94 2.83 0.00 0.00 7.01 7.44 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 0.00 871 H 7.60 4.19 0.00 3.01 2.90 0.00 5.61 0.00 0.00 0.00 0.00 6.75 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 4.28 0.00 2.11 2.04 0.00 2.96 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 1.95 2.05 0.00 873 E 8.31 4.05 0.00 2.03 1.89 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 2.36 2.45 0.00 874 N 8.21 4.61 0.00 2.49 2.07 0.00 0.00 6.45 7.49 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 0.00 875 K 7.63 3.79 0.00 1.73 1.92 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 876 H 8.16 4.40 0.00 3.29 3.40 0.00 5.57 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 877 K 8.05 4.25 0.00 2.05 2.01 0.00 2.03 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.28 1.06 7.81 878 N 7.71 5.01 0.00 2.75 2.79 0.00 0.00 6.87 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 0.00 879 R 9.09 3.82 0.00 1.62 1.87 0.00 3.37 0.00 0.00 3.07 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 880 Y 7.56 4.75 0.00 3.03 2.96 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 0.00 881 I 8.78 3.73 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 1.50 0.77 0.96 0.00 0.00 882 N 8.18 4.64 0.00 2.89 2.94 0.00 0.00 5.88 7.81 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 0.00 883 I 7.64 4.39 2.03 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 1.32 0.85 1.05 0.00 0.00 884 L 8.70 4.53 0.00 1.72 1.66 1.02 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 885 A 8.29 4.78 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 0.00 886 Y 8.11 4.74 0.00 3.00 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 0.00 887 D 9.47 4.54 0.00 2.78 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 8.38 4.32 0.00 3.30 3.45 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 7.44 4.77 0.00 3.96 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 0.00 890 R 7.56 4.35 0.00 1.88 2.23 0.00 3.18 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.56 0.00 891 V 7.81 3.56 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 -0.00 0.00 0.00 892 K 8.54 4.71 0.00 1.71 1.72 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.49 7.81 893 L 8.57 4.53 0.00 1.72 1.59 0.98 1.10 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 0.00 894 R 8.99 4.05 0.00 1.97 1.93 0.00 3.22 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 895 P 0.00 4.47 0.00 2.05 1.99 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 8.77 4.56 0.00 1.68 1.59 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 897 P 0.00 4.45 0.00 2.18 2.06 0.00 3.75 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 2.00 1.97 0.00 898 G 8.48 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 0.00 899 K 8.35 4.09 0.00 1.77 1.77 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 900 D 8.97 4.52 0.00 2.88 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 0.00 901 S 7.76 4.44 0.00 3.95 4.35 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 0.00 902 K 8.19 3.67 0.00 1.64 1.76 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.05 1.27 7.81 903 H 7.58 4.80 0.00 3.22 3.48 0.00 5.67 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 904 S 7.90 4.43 0.00 4.04 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 0.00 905 D 8.00 4.81 0.00 2.97 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 0.00 906 Y 7.73 4.75 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 0.00 907 I 6.94 4.08 1.68 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 1.10 0.91 0.68 0.00 0.00 908 N 8.06 4.50 0.00 2.99 2.75 0.00 0.00 6.76 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 7.51 4.70 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 8.88 5.32 0.00 2.59 2.69 0.00 0.00 7.02 8.30 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 0.00 911 Y 8.60 4.61 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 9.08 4.79 2.28 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 1.11 0.00 0.00 0.97 0.00 0.00 913 D 9.68 5.09 0.00 2.81 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 0.00 914 G 8.72 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 915 Y 8.56 3.94 0.00 2.88 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 8.25 3.78 0.00 1.44 2.33 0.00 0.00 6.98 6.68 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 0.00 917 K 7.42 4.06 0.00 1.68 1.52 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.30 1.32 7.81 918 A 8.55 4.49 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 0.00 919 K 9.08 3.92 0.00 1.75 1.72 0.00 1.32 0.00 0.00 0.61 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.24 7.81 920 A 8.02 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 921 Y 8.47 5.36 0.00 2.95 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 8.83 4.85 1.80 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 0.89 0.71 0.72 0.00 0.00 923 A 8.94 5.04 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 0.00 924 T 8.67 5.09 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 0.00 925 Q 8.21 4.65 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 926 G 8.72 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 927 P 0.00 4.49 0.00 2.09 1.71 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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*1014 N 8.93 5.04 0.00 3.01 2.93 0.00 0.00 6.67 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 1015 E 8.34 5.48 0.00 1.93 1.89 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 2.27 2.37 0.00 1016 R 9.57 4.82 0.00 1.76 1.75 0.00 2.45 0.00 0.00 2.78 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 1017 V 8.40 4.63 2.14 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 0.82 0.00 0.00 0.98 0.00 0.00 1018 V 9.03 4.80 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.20 0.00 0.00 1019 I 8.84 4.96 2.04 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 1.14 0.71 0.78 0.00 0.00 1020 Q 9.34 5.10 0.00 2.36 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 1021 Y 9.43 4.76 0.00 2.93 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 1022 H 9.90 5.47 0.00 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0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.69 0.00 0.00 1039 L 8.33 3.99 0.00 1.91 1.72 0.94 0.62 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 1040 T 8.18 3.88 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 1041 F 8.39 3.73 0.00 3.28 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 8.44 3.41 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 0.69 0.00 0.00 0.86 0.00 0.00 1043 R 8.32 3.81 0.00 1.98 1.92 0.00 3.28 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 1044 R 8.07 3.87 0.00 1.77 2.03 0.00 3.35 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 1045 S 7.31 2.79 0.00 3.29 2.76 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 0.00 0.00 0.00 0.00 1046 S 8.13 4.14 0.00 3.94 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1047 A 7.85 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1048 A 7.28 4.26 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.34 3.88 0.00 1.79 1.91 0.00 3.19 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 1050 M 8.26 4.56 0.00 2.04 1.97 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 2.55 2.66 0.00 1051 P 0.00 4.35 0.00 2.02 1.96 0.00 3.82 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 1052 E 8.63 3.73 0.00 2.07 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 2.19 2.25 0.00 1053 T 7.60 4.58 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 8.50 4.36 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 0.00 1055 P 0.00 4.63 0.00 2.16 2.35 0.00 3.94 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 2.07 2.15 0.00 1056 V 8.31 3.87 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 1.07 0.00 0.00 0.93 0.00 0.00 1057 L 8.71 4.78 0.00 1.66 1.44 0.28 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 1058 V 9.07 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 0.69 0.00 0.00 0.87 0.00 0.00 1059 H 9.33 5.57 0.00 3.38 3.32 0.00 5.45 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1060 C 8.58 4.58 0.00 2.79 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1061 S 9.47 4.79 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1062 A 8.11 4.40 1.06 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 1063 G 8.10 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 1064 V 7.80 4.17 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 0.90 0.00 0.00 0.92 0.00 0.00 1065 G 7.25 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 7.42 3.55 0.00 1.38 1.12 0.00 2.62 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.02 0.00 1067 T 7.82 3.89 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1068 G 7.96 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1069 T 8.14 4.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 1070 Y 8.31 4.03 0.00 3.07 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1071 I 7.92 3.33 1.95 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.25 0.93 0.00 0.00 1072 V 8.27 3.85 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 1.25 0.00 0.00 1.21 0.00 0.00 1073 I 7.83 3.58 1.77 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.65 0.80 0.00 0.00 1074 D 7.97 4.10 0.00 2.18 2.54 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 1075 S 8.12 4.07 0.00 3.43 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 1076 M 8.18 3.76 0.00 1.72 1.97 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.71 0.00 1077 L 7.95 3.85 0.00 1.71 1.59 0.80 1.13 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 1078 Q 7.82 3.83 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 1079 Q 7.35 2.52 0.00 1.32 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.23 1.98 0.00 1080 I 7.74 3.49 1.84 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.48 0.82 0.00 0.00 1081 K 7.64 3.84 0.00 1.75 1.87 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.39 7.81 1082 D 7.90 4.49 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1083 K 8.03 4.49 0.00 1.81 1.73 0.00 1.90 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.59 7.81 1084 S 8.20 3.85 0.00 3.99 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 1085 T 7.10 5.02 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1086 V 8.43 4.18 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 0.13 0.00 0.00 0.44 0.00 0.00 1087 N 7.96 4.98 0.00 2.75 2.67 0.00 0.00 6.73 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 7.80 3.66 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 1.10 0.00 0.00 0.80 0.00 0.00 1089 L 8.17 4.34 0.00 2.10 1.82 1.03 1.12 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 1090 G 8.19 3.67 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 0.00 0.00 0.00 1091 F 8.62 4.35 0.00 3.13 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1092 L 8.50 3.87 0.00 2.08 2.04 1.08 1.14 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 1093 K 8.12 3.94 0.00 1.92 1.87 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.64 7.81 1094 H 8.27 4.31 0.00 3.26 3.41 0.00 5.78 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 1095 I 7.61 3.62 1.69 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 0.27 0.00 0.00 1096 R 7.83 4.13 0.00 1.97 2.03 0.00 3.27 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 1097 T 7.70 4.05 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 1.21 0.00 0.00 1098 Q 8.16 4.53 0.00 2.15 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 1099 R 7.29 4.17 0.00 1.62 1.65 0.00 3.26 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.48 0.00 1100 N 7.53 3.89 0.00 1.72 2.32 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 8.29 3.81 0.00 3.23 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 7.28 4.30 0.00 1.70 1.65 0.90 0.88 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 1103 V 8.36 3.30 2.35 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 0.98 0.00 0.00 1.10 0.00 0.00 1104 Q 9.85 4.57 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.45 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 1105 T 7.62 4.60 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 1.19 0.00 0.00 1106 E 7.85 2.86 0.00 1.71 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 1107 E 7.86 3.94 0.00 2.03 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 2.35 2.39 0.00 1108 Q 8.05 4.11 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 1109 Y 7.97 4.18 0.00 3.02 2.99 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 1110 I 7.94 2.94 1.66 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 -0.30 0.08 0.34 0.00 0.00 1111 F 8.45 3.99 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 7.92 3.61 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.89 0.83 0.00 0.00 1113 H 7.76 4.24 0.00 3.44 3.43 0.00 5.83 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 1114 D 8.21 4.35 0.00 2.58 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 1115 A 7.85 3.72 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1116 L 8.07 3.93 0.00 1.87 1.81 0.76 0.66 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 8.37 4.01 0.00 1.80 1.83 0.91 0.83 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 1118 E 8.26 3.94 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 1119 A 7.85 3.97 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 1120 I 7.83 3.81 2.06 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.67 0.95 0.00 0.00 1121 L 8.18 4.30 0.00 1.60 1.72 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 1122 G 7.69 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.