NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 695 S 4.4284 8.3231 117.1002 57.8716 63.3935 172.2751 696 G 3.5758 7.9064 111.3547 46.0458 0.0000 174.1793 697 E 4.3174 8.1413 128.0750 54.3583 33.3639 173.9172 698 A 4.8073 7.6151 119.9662 49.5948 21.2848 175.0106 699 P 4.2994 0.0000 0.0000 62.5189 31.9502 176.2631 700 N 4.5698 8.5699 122.0426 52.8918 37.6064 173.4079 701 Q 4.3858 8.3366 123.6833 55.6743 29.0080 176.5832 702 A 4.1385 7.7801 120.8662 52.1141 18.9206 177.8126 703 L 4.5878 8.2158 119.8714 52.6678 43.9888 176.1348 704 L 4.4489 8.3593 125.2013 53.1322 42.8186 175.1105 705 R 4.3121 8.2905 127.4027 55.7164 31.6980 174.9632 706 I 4.7623 8.3645 127.2285 60.1814 37.9375 175.3844 707 L 4.8115 8.4489 127.5761 53.6346 43.3623 176.6054 708 K 4.5401 8.8243 119.9800 54.6635 33.5282 176.9821 709 E 3.3594 8.6363 121.4716 59.5571 29.8378 178.1625 710 T 4.2035 7.3115 108.4554 61.1092 69.0403 174.6452 711 E 4.9379 7.3134 117.8055 56.9829 34.7184 176.3341 712 F 5.5822 7.3607 112.9378 54.5396 41.4552 174.0737 713 K 4.6667 8.7878 120.2530 54.4618 34.9977 175.5562 714 K 4.1507 8.7579 124.1418 56.4728 31.3175 177.0159 715 I 3.9419 8.5361 126.5882 63.3283 36.9485 176.6411 716 K 4.7114 7.6190 118.2769 55.6474 36.0716 174.1819 717 V 4.2777 8.4785 120.7692 61.2904 32.2957 175.7093 718 L 4.6597 9.1350 125.8516 54.3519 42.9609 174.6571 719 G 3.8205 7.5187 102.7738 43.4247 0.0000 174.0802 720 S 4.9536 7.6732 117.7533 55.6930 64.3704 173.9817 721 G 3.9665 7.9418 116.1571 45.1118 0.0000 171.9946 722 A 4.0625 8.8363 128.7158 55.2865 18.9567 182.1901 *723 F 4.2871 7.7203 116.4493 55.7911 37.7344 179.1766 724 G 3.6247 7.9264 112.9178 47.2200 0.0000 173.3512 725 T 4.5378 8.3038 119.5546 61.7076 71.1158 173.6291 726 V 4.2756 8.2229 127.5802 61.5128 33.2789 174.7328 727 Y 5.1756 9.1135 126.5160 56.5486 41.0687 174.2239 728 K 4.8324 9.3956 122.6364 55.1949 34.6220 175.3155 729 G 4.5240 8.7387 112.2031 46.0226 0.0000 171.5002 730 L 5.3295 8.4870 119.3227 53.0077 45.4447 175.9297 731 W 5.4945 9.0292 130.3073 56.7084 34.2271 173.3805 732 I 3.9218 8.3174 129.0986 58.6980 38.0669 173.9787 733 P 4.1373 0.0000 0.0000 61.0419 31.4279 176.3281 734 E 4.1558 8.6038 115.8579 58.8015 29.9020 177.7775 735 G 4.1765 7.6154 111.8157 44.0146 0.0000 172.6659 736 E 4.6620 7.7091 114.8904 54.7994 33.8039 178.3056 737 K 4.2057 8.4841 120.8776 56.6486 32.2914 178.9036 738 V 4.0245 7.5132 118.3462 61.6483 32.7244 176.2999 739 K 4.4309 8.2536 125.3197 53.6039 33.5644 175.7449 740 I 4.2974 8.2470 128.2423 59.0798 38.9021 174.0366 741 P 4.9654 0.0000 0.0000 63.1034 32.8797 175.7349 742 V 5.0830 9.5317 117.3638 59.4781 36.5349 174.1490 743 A 4.6426 8.7584 121.9978 50.8174 21.4687 175.2692 744 I 4.6421 8.4049 122.6845 61.3639 38.9091 175.3102 745 K 4.8381 9.0730 128.6425 54.5015 34.9332 174.5298 746 E 4.9539 8.6681 123.3718 54.8695 33.6889 174.3270 747 L 4.5145 8.4212 119.9323 54.2792 42.5846 177.3641 748 R 4.3859 8.2268 116.3483 56.4947 30.6048 176.6117 749 E 4.2170 7.8848 117.6956 55.2448 30.3829 176.1454 750 A 4.0072 8.3661 123.5875 52.3055 18.9052 177.5464 751 T 3.8076 8.3117 115.7112 63.1501 67.7706 173.6753 752 S 4.6155 8.4163 120.4918 55.6710 66.5451 173.9959 753 P 4.1981 0.0000 0.0000 66.0309 31.1576 178.3323 754 K 3.9628 8.1838 117.1357 59.7449 31.9686 177.9265 755 A 3.9847 7.7591 120.5383 55.5000 18.3461 179.2941 756 N 4.2468 8.4900 114.9834 56.3316 38.6258 177.0947 757 K 3.7564 8.7368 121.8863 60.0127 32.2047 178.2087 758 E 4.0933 8.2338 118.2564 59.7153 29.0387 179.4689 759 I 3.7909 7.8773 118.3383 63.8203 38.0202 177.8305 760 L 4.2043 8.0410 120.0201 57.2315 41.5816 178.9268 761 D 4.3877 8.0460 119.2077 57.4697 40.7210 178.3980 762 E 3.9979 8.2956 118.7112 59.6930 29.5413 179.5195 763 A 4.0100 7.7776 119.3344 55.0941 18.1734 178.9360 764 Y 3.8592 7.9332 117.4108 60.8011 39.1495 178.4494 765 V 3.8036 7.8648 118.6658 66.5421 31.8300 178.0657 766 M 4.0925 8.4281 118.3384 57.9737 31.5240 178.4674 767 A 4.0302 7.8550 120.0709 54.3833 18.6477 179.0633 768 S 4.3793 7.5250 112.4794 58.8538 63.2729 174.8078 769 V 3.7078 6.6965 121.3528 63.0400 31.2892 175.0093 770 D 4.4716 9.4968 127.3734 52.9566 42.4856 173.6987 771 N 4.3704 7.8717 122.4567 51.5745 41.6705 173.6262 772 P 4.1468 0.0000 0.0000 65.2026 31.7400 176.7618 773 H 5.0781 9.1523 113.3391 54.2639 29.4119 173.0754 774 V 4.7650 7.0557 119.8240 60.7938 33.5566 175.3484 775 C 4.3709 8.6641 125.4667 59.9663 28.8403 173.3150 776 R 4.5192 8.7081 118.3740 54.2075 32.2115 175.1661 777 L 4.3921 8.1262 122.4853 54.7412 42.5462 176.6532 778 L 4.0229 8.4889 127.2967 56.4759 42.4424 177.1281 779 G 3.9837 6.9727 103.4138 46.4551 0.0000 171.4574 780 I 5.2472 8.0388 112.1808 59.5076 41.8275 173.8092 781 C 4.9318 8.9419 122.5045 57.4472 34.5146 174.4441 782 L 4.7649 8.3146 129.4884 53.7116 39.9767 175.3871 783 T 4.3529 7.3041 110.1265 60.2170 71.4861 174.8639 784 S 4.1708 8.7785 115.3928 61.1807 62.1090 174.6827 785 T 4.5111 7.6053 109.4291 59.1425 69.9824 173.8102 786 V 3.8950 8.4952 126.6241 63.5822 32.3592 174.8245 787 Q 4.8904 9.0296 126.2849 54.1660 31.4906 174.5463 788 L 4.7899 9.1198 124.4976 53.7728 44.0000 175.7751 789 I 4.5030 8.5527 124.3104 59.8960 39.3430 174.3239 790 M 4.7677 8.5904 127.7541 53.3195 34.5500 175.3267 791 Q 4.4748 8.2946 122.3433 56.2928 29.5791 175.3004 792 L 4.8994 8.2248 120.0580 53.2011 45.1195 176.4185 793 M 4.3389 8.4453 120.8235 53.8929 33.1515 174.8837 794 P 4.2097 0.0000 0.0000 66.1910 31.1546 176.9801 795 F 4.6855 7.0224 116.1046 55.8820 40.2106 176.5713 796 G 3.1741 8.5702 108.4384 46.3033 0.0000 172.6638 797 C 4.7642 8.1056 117.4808 57.3073 31.6518 175.0866 798 L 3.7493 8.7011 120.6199 57.6217 41.4359 178.0665 799 L 4.0189 7.8805 119.9671 58.7221 42.0778 178.6984 800 D 4.4337 8.0750 117.8845 57.3927 40.5343 178.2556 801 Y 3.8968 7.5274 119.7348 60.5926 38.9350 177.7326 802 V 4.0216 8.7260 120.7213 64.8656 31.2357 178.6996 803 R 4.0192 7.9077 118.2609 59.1192 29.8390 178.2758 804 E 4.3601 7.5965 113.5605 57.5086 29.3202 177.3507 805 H 4.9294 7.8761 115.1287 56.3067 31.0366 175.9857 806 K 3.7857 7.0640 122.0643 58.7707 31.8174 176.8373 807 D 4.6332 8.1005 116.7980 54.2093 42.3019 176.5576 808 N 4.6222 8.0324 114.9729 52.8052 38.7044 174.6835 809 I 4.1573 7.5337 120.3244 59.7601 37.1641 175.7360 810 G 3.9195 7.8926 115.0293 44.0195 0.0000 173.3270 811 S 4.1216 8.7863 115.1641 61.7036 62.4954 176.3329 812 Q 3.9431 8.1614 122.4628 59.2838 28.8260 177.9866 813 Y 3.5202 7.7338 117.3126 61.0185 37.8285 178.9138 814 L 3.8047 7.5085 119.0411 57.7772 41.2941 179.5156 815 L 4.1574 7.8921 118.9006 57.6813 41.4421 179.3655 816 N 4.3138 8.0789 116.5071 55.9939 38.4875 177.0699 817 W 4.6000 7.4407 119.9888 60.4749 29.2522 178.0042 818 C 3.8605 7.9617 115.8374 63.0468 27.4407 176.6730 819 V 3.6170 7.4036 118.6022 66.0787 31.0404 178.0928 820 Q 3.7745 8.2042 117.8232 58.9672 28.5965 178.5148 821 I 3.6900 8.1929 120.9114 64.7353 37.2240 178.2853 822 A 3.8473 8.2758 121.1057 54.8632 18.0793 179.8465 823 K 3.9858 8.3187 117.5929 59.7812 32.2351 179.8348 824 G 3.6166 8.1708 105.8565 47.9099 0.0000 175.6507 825 M 3.7599 8.2016 121.3318 58.0492 31.7819 178.2016 826 N 4.2459 8.4378 117.5217 56.8278 38.9852 175.7444 827 Y 4.0638 8.0495 120.7536 61.0236 38.8042 178.0834 828 L 3.8635 8.1073 119.3758 58.0528 41.8127 179.2743 829 E 3.8091 8.1959 118.8213 59.4455 29.3143 178.5303 830 D 4.3714 7.9078 117.7079 56.4506 40.7533 177.9854 831 R 4.4246 6.8313 116.4652 54.9040 30.9221 175.9588 832 R 3.9088 7.8901 116.3008 57.2128 28.3805 175.5129 833 L 4.8208 7.8866 116.6010 52.9922 43.3397 176.3837 834 V 4.3712 7.9791 122.3906 61.2016 33.2419 174.5243 835 H 4.1037 9.2610 128.9303 58.1375 30.2332 174.6495 836 R 4.0185 8.9861 117.3985 55.7271 29.4952 176.2850 837 D 4.7303 7.5742 113.9251 52.0662 40.9074 173.8643 838 L 4.3131 7.6660 120.8379 53.3511 43.5082 174.8984 839 A 4.7385 8.1390 126.2849 51.6643 22.1477 176.4535 840 A 3.9869 9.3981 123.1202 55.1576 18.4713 180.4528 841 R 4.0262 7.8871 111.0724 58.4637 29.8514 176.7792 842 N 4.9422 8.2182 116.5700 52.7605 40.5065 173.9701 843 V 4.1497 7.7550 120.1259 61.1952 33.6901 174.5242 844 L 4.6177 8.7547 128.9624 53.7576 43.7882 176.5751 845 V 4.1160 8.0194 122.7086 61.3159 31.4126 175.6884 846 K 4.1463 8.5948 130.6771 59.2305 32.5247 176.7856 847 T 4.7108 7.3760 106.5582 59.5216 71.4026 172.4339 848 P 4.2770 0.0000 0.0000 64.9083 31.3695 176.7632 849 Q 4.4303 7.0395 117.0706 54.9876 29.0600 175.7239 850 H 4.9339 8.1060 117.8725 58.1046 32.9072 172.6427 851 V 4.8017 8.5879 119.2738 59.5203 35.2050 175.0690 852 K 4.8428 8.7809 121.7974 54.5915 36.4195 175.5992 853 I 4.5802 8.8266 119.3378 60.1241 39.1280 175.5141 854 T 4.1637 8.2999 117.1208 61.0767 69.1664 174.3331 855 D 4.8859 7.8874 122.4284 52.3519 39.1721 175.6703 856 F 5.0217 7.6362 118.1870 57.8445 41.1888 176.9009 857 G 4.5749 9.1753 111.0084 46.6312 0.0000 175.6763 858 L 4.2488 7.2061 119.6069 53.6157 40.3795 179.4853 859 A 4.1724 7.9597 117.7970 53.6554 18.9838 180.0403 860 K 4.0658 7.6171 129.7169 52.8647 30.4032 180.4546 861 L 3.8270 8.4830 129.6516 55.5988 41.0563 173.1887 862 L 4.7663 8.2342 125.2221 52.5893 43.3595 176.5479 863 G 3.7045 8.4636 110.1093 46.7145 0.0000 173.9585 864 A 4.6515 7.6464 134.7292 53.0944 20.0877 178.0045 865 E 4.3294 8.2500 110.6983 56.7519 30.4931 178.6055 866 E 4.2626 8.2036 114.7896 56.7613 29.8675 182.0654 867 K 4.6856 8.3856 121.0404 55.2356 33.5121 174.8763 868 E 4.8612 7.6878 116.3942 55.9461 33.5337 173.7605 869 Y 4.5947 8.1719 118.0278 57.2363 42.5980 172.8293 870 H 5.1719 8.5837 123.4326 53.3767 30.8914 173.8087 871 A 4.5238 8.4891 129.6940 52.4300 16.1087 178.1222 872 E 4.5405 8.1178 123.6867 55.8705 34.5173 177.5935 873 G 4.0757 7.7423 113.4847 45.2797 0.0000 172.2649 874 G 4.1287 8.3512 113.8811 42.8023 0.0000 170.6857 875 K 3.8860 8.6015 120.5111 56.8714 32.1858 176.2323 876 V 4.6230 8.0711 118.4170 59.1694 35.9603 174.4326 877 P 4.7965 0.0000 0.0000 60.8793 30.1753 176.0779 878 I 3.7276 8.0581 126.5600 65.3733 37.6800 178.8489 879 K 4.0629 8.3821 118.0041 58.5695 31.7264 177.5871 880 W 4.6616 9.0821 117.5195 56.8123 29.7057 175.6732 881 M 4.4736 7.6420 118.4288 53.5239 33.2181 176.0639 882 A 2.0000 7.9528 124.0881 50.8907 19.6628 178.4145 883 L 3.6340 7.4853 121.8040 58.3345 42.1044 179.5863 884 E 3.9789 7.9973 116.6660 59.4827 29.4175 179.0920 885 S 4.3546 7.6620 117.4699 60.7158 62.5824 176.6561 886 I 3.6825 7.2399 121.3750 62.4284 37.4011 177.2866 887 L 4.0870 8.1532 118.8381 55.7488 40.0018 178.2908 888 H 3.8866 9.3820 126.9106 58.3523 31.1455 172.9141 889 R 4.2849 8.3715 117.2922 57.9572 28.0213 174.4437 890 I 4.6012 7.0211 109.4486 59.1599 41.6302 174.5535 891 Y 5.2471 8.6449 119.2486 56.8621 42.0064 174.6341 892 T 4.9272 9.5005 117.2643 60.9346 71.0805 174.2123 893 H 4.4659 8.9642 121.6238 58.3217 29.2568 177.4495 894 Q 4.3578 7.9446 118.1302 57.5008 29.5993 178.1886 895 S 4.5177 8.3430 113.8383 61.3346 63.0825 176.1317 896 D 4.6213 8.3603 122.1382 57.3741 40.6024 178.6935 897 V 3.5196 7.6927 117.4788 65.5064 31.5432 177.6803 898 W 4.9748 8.0125 128.1520 60.3796 30.6279 177.8790 899 S 4.8156 8.4850 115.8383 61.3538 62.2592 176.0242 900 Y 4.3618 8.7455 122.3295 60.9761 38.5871 178.2677 901 G 3.6457 8.5673 106.4968 48.0829 0.0000 175.5926 902 V 3.9158 8.1449 119.7722 66.1730 31.0982 178.2749 903 T 4.3046 8.2004 115.5483 66.8384 68.3523 176.6274 904 V 3.5104 7.9327 120.5032 65.8912 31.2900 177.9062 905 W 4.1948 8.5513 127.9895 60.1939 30.4232 177.9797 906 E 3.9704 8.6245 119.0944 59.3188 28.9071 179.2135 907 L 3.9617 7.9411 118.9923 58.0935 41.5717 179.2695 908 M 3.9012 7.8531 116.4845 56.7734 31.9036 177.0557 909 T 3.9102 6.3253 107.3120 60.0595 69.6565 174.1091 910 F 3.7592 8.1388 119.7905 59.1281 36.7995 175.8900 911 G 3.9371 8.9403 103.5556 45.8557 0.0000 173.5281 912 S 4.2244 7.2604 113.3333 57.7009 62.8388 173.9348 913 K 4.4327 8.6067 126.6180 55.1671 32.4997 175.4091 914 P 3.7756 0.0000 0.0000 63.9890 32.1770 175.7486 915 Y 3.6768 7.4309 117.3493 58.7279 35.5736 171.6127 916 D 4.5428 7.9087 118.6828 55.8755 42.0045 175.9777 917 G 4.0116 9.2444 114.5499 45.0741 0.0000 172.7169 918 I 4.4364 7.1335 120.4829 58.3423 38.7406 174.0250 919 P 4.4180 0.0000 0.0000 62.4963 31.8279 177.4673 920 A 4.1739 8.4390 120.8867 52.8963 17.4992 178.2043 921 S 4.7064 7.9009 111.4940 59.5993 64.9190 174.5206 922 E 4.6007 7.9572 117.7964 55.7846 32.2831 177.2625 923 I 3.3285 7.7970 119.5731 65.0621 37.7682 177.6005 924 S 4.3662 7.7471 113.4400 56.8651 61.3380 173.0681 925 S 5.0325 7.4193 127.9418 59.0346 64.6544 178.7970 926 I 3.7237 7.1273 114.6938 63.8081 37.1181 178.0656 927 L 4.1359 8.2584 121.1295 57.8179 41.3053 179.3887 928 E 4.0112 8.0766 116.4086 59.1576 29.5077 178.6291 929 K 4.3252 7.8222 115.8193 56.7854 32.2008 177.7073 930 G 3.9683 8.1549 108.4091 45.1621 0.0000 173.3417 931 E 4.2096 8.0906 120.6346 55.7339 30.1713 176.1964 932 R 4.6260 8.1036 122.9350 53.8611 34.4523 174.8811 933 L 3.4086 7.2410 119.6315 54.1048 41.7868 175.8541 934 P 4.6373 0.0000 0.0000 62.0260 32.3369 175.4196 935 Q 3.2176 8.0508 120.0911 54.3945 29.2778 173.8870 936 P 4.3797 0.0000 0.0000 61.7383 32.1109 175.7211 937 P 4.2541 0.0000 0.0000 65.5437 31.6044 177.8205 938 I 4.1329 7.5927 109.9009 62.0965 38.2337 175.1039 939 C 4.6844 7.6786 120.5033 59.3356 28.6170 174.3321 940 T 4.3059 8.0969 114.9837 60.7493 70.8105 175.6750 941 I 3.8156 8.3094 120.6590 64.6429 37.6546 177.0771 942 D 4.3953 8.2589 117.6077 57.6410 40.9630 179.0060 943 V 3.5652 7.6981 117.6799 66.1508 31.8797 177.1038 944 Y 4.3287 8.1424 119.2281 61.0804 38.3967 178.2241 945 M 3.7755 8.0682 119.0493 58.4140 32.1444 177.9803 946 I 3.5074 7.0660 118.1768 64.7300 37.6297 177.6014 947 M 3.3641 7.7836 118.6868 58.4358 31.6707 178.7257 948 V 3.2023 6.7589 117.6000 66.0378 31.4538 178.2537 949 K 3.9182 7.7796 117.5914 59.0504 31.8518 178.5573 950 C 4.2308 7.4539 116.0910 60.4944 27.7420 174.5011 951 W 3.4029 7.0292 120.1580 55.9354 29.4746 175.5268 952 M 4.3268 7.8970 117.9938 55.2218 32.1564 176.6225 953 I 3.8789 8.6562 124.5511 64.5437 37.6610 176.1517 954 D 4.3526 8.1476 122.7261 54.0736 40.5797 175.9129 955 A 4.1294 9.0513 130.7433 55.7158 18.2724 179.1960 956 D 4.5227 8.1441 112.5837 56.7551 41.1098 177.9289 957 S 4.3312 7.8745 114.7408 60.5169 63.2240 175.2077 958 R 4.3598 7.2180 117.4157 54.5856 30.3105 174.6204 959 P 4.4114 0.0000 0.0000 63.2332 32.1741 176.3511 960 K 4.4617 7.9614 118.2117 54.4969 36.1183 177.7204 961 F 4.2022 8.3160 120.1700 60.3964 38.4712 177.8059 962 R 3.9699 8.2314 115.8438 59.7988 28.7880 178.5078 963 E 4.0436 8.1130 118.0327 58.0928 29.8521 178.4072 964 L 4.0872 7.8261 121.7487 58.1840 41.9656 178.6346 965 I 3.8401 7.8268 120.0036 64.0492 37.0082 178.0531 966 I 3.1890 7.6759 113.6314 64.1881 36.5073 177.7701 967 E 3.8244 7.9658 120.8447 59.1986 29.4555 178.4817 968 F 4.0634 8.1379 115.8990 59.8961 39.3472 177.9410 969 S 4.3151 9.1135 116.4711 61.3149 62.4955 176.2124 970 K 3.8527 7.7959 122.3306 60.0062 31.7675 178.3429 971 M 4.2181 7.5557 116.2541 57.0066 31.6582 177.9362 972 A 4.2032 7.7005 120.3642 54.1781 18.8520 179.2243 973 R 4.1717 7.7184 115.7559 57.7373 31.9248 176.3936 974 D 4.8027 7.7896 117.5984 50.7613 41.3237 173.1818 975 P 4.3527 0.0000 0.0000 66.3527 31.7661 178.2097 976 Q 4.4002 7.8761 115.7319 57.5287 28.7527 178.0938 977 R 3.8405 7.5997 118.9799 58.2070 29.9652 175.9758 978 Y 4.8663 8.2768 114.8171 56.9755 40.9203 175.6782 979 L 5.0683 7.8127 118.7957 52.9410 46.0764 175.5088 980 V 4.4041 8.6371 124.5455 61.3095 32.4113 174.8843 981 I 4.5635 8.0444 128.0514 59.1447 40.0971 175.8698 982 Q 4.1310 8.8939 125.0706 56.5122 26.9886 174.1916 983 G 4.2160 7.3899 115.0201 44.7635 0.0000 170.6823 984 D 4.6487 7.9966 120.7999 53.7155 41.6567 175.7999 985 E 3.8712 8.6890 119.1976 59.2336 29.8999 181.7854 986 R 2.5100 8.1365 113.5631 52.4316 32.1746 176.5213 987 M 2.5532 8.9419 126.4138 56.9868 33.4246 178.7448 *988 H 3.7965 8.9275 116.2160 55.7174 27.4123 180.6485 989 L 4.8756 7.8200 106.9490 53.3169 41.3719 171.5143 990 P 4.3313 0.0000 0.0000 65.5986 32.1246 178.8053 991 S 4.3272 8.4871 116.6025 60.7660 61.7206 178.7613 992 P 4.8316 0.0000 0.0000 62.0094 32.9044 178.0128 993 T 3.7495 8.0894 107.9664 61.6973 66.3083 174.5172 994 D 4.7523 7.3069 123.4059 56.1481 41.8278 178.3505 995 S 4.9946 8.7788 122.7073 58.3899 67.6579 175.6989 996 N 4.5387 9.4602 126.7555 56.9044 37.2337 175.9798 997 F 4.3212 8.4492 122.7518 62.7442 39.6745 177.3725 *998 Y 4.3087 8.3020 119.8093 61.9270 36.3335 180.3572 999 R 4.0721 8.1624 118.2531 59.4930 30.3399 177.8596 1000 A 4.1364 7.5371 121.2966 55.8795 18.4015 179.6504 1001 L 4.0037 7.1576 118.8894 59.6288 42.3433 181.3001 1002 M 4.8068 7.5946 121.3906 53.2343 29.1841 177.6570 1003 D 4.4794 7.3484 116.2270 53.2428 42.9697 178.0478 *1004 E 4.2236 8.2992 120.7997 55.8850 30.4233 176.7689 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 695 S 8.32 4.43 0.00 3.65 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 696 G 7.91 3.58 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 0.00 0.00 0.00 697 E 8.14 4.32 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 698 A 7.62 4.81 1.22 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 0.00 699 P 0.00 4.30 0.00 2.20 2.09 0.00 3.77 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 1.99 1.95 0.00 700 N 8.57 4.57 0.00 2.72 2.82 0.00 0.00 7.19 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 0.00 701 Q 8.34 4.39 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 702 A 7.78 4.14 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 0.00 703 L 8.22 4.59 0.00 1.59 1.56 0.92 0.89 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 0.00 704 L 8.36 4.45 0.00 1.53 1.57 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 705 R 8.29 4.31 0.00 1.94 1.94 0.00 3.30 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 706 I 8.36 4.76 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.01 0.95 0.00 0.00 707 L 8.45 4.81 0.00 1.85 2.04 0.24 0.96 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 0.00 708 K 8.82 4.54 0.00 1.67 1.66 0.00 1.86 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.45 7.81 709 E 8.64 3.36 0.00 1.90 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 2.34 2.30 0.00 710 T 7.31 4.20 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 711 E 7.31 4.94 0.00 2.22 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 2.47 2.35 0.00 712 F 7.36 5.58 0.00 3.14 3.30 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 0.00 0.00 0.00 0.00 713 K 8.79 4.67 0.00 1.72 1.75 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.40 7.81 714 K 8.76 4.15 0.00 1.39 1.43 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.58 1.45 7.81 715 I 8.54 3.94 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.75 0.91 0.00 0.00 716 K 7.62 4.71 0.00 1.84 1.90 0.00 1.55 0.00 0.00 1.90 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.49 7.81 717 V 8.48 4.28 2.29 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 0.73 0.00 0.00 0.91 0.00 0.00 718 L 9.13 4.66 0.00 1.66 1.76 1.00 1.10 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 0.00 719 G 7.52 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 0.00 720 S 7.67 4.95 0.00 3.64 3.66 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 0.00 721 G 7.94 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 722 A 8.84 4.06 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 *723 F 7.72 4.29 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 724 G 7.93 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 725 T 8.30 4.54 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 726 V 8.22 4.28 1.91 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 1.02 0.00 0.00 0.57 0.00 0.00 727 Y 9.11 5.18 0.00 2.94 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 0.00 728 K 9.40 4.83 0.00 1.89 1.87 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.73 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.49 7.81 729 G 8.74 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 0.00 0.00 0.00 0.00 730 L 8.49 5.33 0.00 1.68 1.66 0.93 0.67 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 0.00 731 W 9.03 5.49 0.00 3.46 3.14 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 0.00 732 I 8.32 3.92 1.75 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.55 0.78 0.00 0.00 733 P 0.00 4.14 0.00 1.71 1.74 0.00 3.32 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 734 E 8.60 4.16 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 2.27 2.26 0.00 735 G 7.62 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 0.00 736 E 7.71 4.66 0.00 1.95 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.87 0.00 737 K 8.48 4.21 0.00 1.77 1.75 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 0.99 7.81 738 V 7.51 4.02 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 0.75 0.00 0.00 0.89 0.00 0.00 739 K 8.25 4.43 0.00 1.53 1.64 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.25 1.00 7.81 740 I 8.25 4.30 2.20 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 1.33 0.72 1.08 0.00 0.00 741 P 0.00 4.97 0.00 2.26 2.25 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.06 0.00 742 V 9.53 5.08 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 0.87 0.00 0.00 0.96 0.00 0.00 743 A 8.76 4.64 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 0.00 744 I 8.40 4.64 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.38 0.98 0.00 0.00 745 K 9.07 4.84 0.00 0.79 0.87 0.00 0.67 0.00 0.00 1.19 0.00 0.00 2.71 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.99 0.86 7.81 746 E 8.67 4.95 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 747 L 8.42 4.51 0.00 1.65 1.61 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 748 R 8.23 4.39 0.00 1.89 2.00 0.00 3.01 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 749 E 7.88 4.22 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 750 A 8.37 4.01 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 751 T 8.31 3.81 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 1.22 0.00 0.00 752 S 8.42 4.62 0.00 4.03 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 753 P 0.00 4.20 0.00 2.17 2.16 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 754 K 8.18 3.96 0.00 1.81 1.82 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.53 7.81 755 A 7.76 3.98 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 0.00 756 N 8.49 4.25 0.00 2.98 2.89 0.00 0.00 6.71 6.60 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 0.00 757 K 8.74 3.76 0.00 1.90 2.00 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.51 7.81 758 E 8.23 4.09 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 759 I 7.88 3.79 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.24 0.99 0.00 0.00 760 L 8.04 4.20 0.00 1.90 1.73 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 761 D 8.05 4.39 0.00 2.92 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 0.00 762 E 8.30 4.00 0.00 2.26 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 2.37 2.50 0.00 763 A 7.78 4.01 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 0.00 764 Y 7.93 3.86 0.00 3.03 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 765 V 7.86 3.80 2.29 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 0.99 0.00 0.00 1.10 0.00 0.00 766 M 8.43 4.09 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 767 A 7.86 4.03 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 0.00 768 S 7.52 4.38 0.00 3.88 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 0.00 769 V 6.70 3.71 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.05 0.00 0.00 770 D 9.50 4.47 0.00 2.55 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 0.00 771 N 7.87 4.37 0.00 1.44 1.96 0.00 0.00 7.11 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 0.00 772 P 0.00 4.15 0.00 1.66 1.92 0.00 3.47 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 773 H 9.15 5.08 0.00 3.15 3.19 0.00 5.56 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 774 V 7.06 4.77 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 0.78 0.00 0.00 0.89 0.00 0.00 775 C 8.66 4.37 0.00 2.71 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 0.00 776 R 8.71 4.52 0.00 1.79 1.93 0.00 2.72 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.48 0.00 777 L 8.13 4.39 0.00 1.49 1.52 0.95 0.93 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 0.00 778 L 8.49 4.02 0.00 1.14 1.16 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 779 G 6.97 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 0.00 780 I 8.04 5.25 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.70 0.90 0.00 0.00 781 C 8.94 4.93 0.00 3.25 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 0.00 782 L 8.31 4.76 0.00 1.69 1.64 0.94 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 0.00 783 T 7.30 4.35 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 1.25 0.00 0.00 784 S 8.78 4.17 0.00 3.86 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 0.00 785 T 7.61 4.51 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 1.23 0.00 0.00 786 V 8.50 3.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.54 1.79 0.00 795 F 7.02 4.69 0.00 3.15 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 0.00 796 G 8.57 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 797 C 8.11 4.76 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 798 L 8.70 3.75 0.00 1.57 1.46 -0.29 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 799 L 7.88 4.02 0.00 1.70 1.66 1.10 1.32 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 0.00 800 D 8.08 4.43 0.00 2.82 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 0.00 801 Y 7.53 3.90 0.00 2.99 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 0.00 802 V 8.73 4.02 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 0.97 0.00 0.00 1.30 0.00 0.00 803 R 7.91 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0.00 0.00 0.00 0.00 828 L 8.11 3.86 0.00 1.90 1.72 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 829 E 8.20 3.81 0.00 2.07 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 2.14 1.99 0.00 830 D 7.91 4.37 0.00 2.68 2.59 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 0.00 831 R 6.83 4.42 0.00 1.82 1.80 0.00 2.56 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.25 0.00 832 R 7.89 3.91 0.00 1.99 2.02 0.00 3.28 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 833 L 7.89 4.82 0.00 1.70 1.56 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 834 V 7.98 4.37 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 0.84 0.00 0.00 0.79 0.00 0.00 835 H 9.26 4.10 0.00 3.15 3.43 0.00 5.79 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 836 R 8.99 4.02 0.00 1.76 2.02 0.00 2.95 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.17 0.00 837 D 7.57 4.73 0.00 2.53 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 0.00 838 L 7.67 4.31 0.00 1.50 1.67 0.83 1.33 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 0.00 839 A 8.14 4.74 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 840 A 9.40 3.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 R 7.89 4.03 0.00 1.85 1.96 0.00 2.77 0.00 0.00 3.06 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.53 0.00 842 N 8.22 4.94 0.00 2.73 2.76 0.00 0.00 6.22 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 0.00 843 V 7.76 4.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.89 0.00 0.00 844 L 8.75 4.62 0.00 1.48 1.39 0.82 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 845 V 8.02 4.12 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 0.31 0.00 0.00 0.46 0.00 0.00 846 K 8.59 4.15 0.00 1.66 1.91 0.00 1.79 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.38 7.81 847 T 7.38 4.71 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 1.34 0.00 0.00 848 P 0.00 4.28 0.00 2.46 2.47 0.00 3.69 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 849 Q 7.04 4.43 0.00 2.02 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 850 H 8.11 4.93 0.00 3.26 3.19 0.00 5.78 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 V 8.59 4.80 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 0.49 0.00 0.00 0.89 0.00 0.00 852 K 8.78 4.84 0.00 1.51 1.53 0.00 1.51 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.18 7.81 853 I 8.83 4.58 1.81 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 1.45 0.78 0.84 0.00 0.00 854 T 8.30 4.16 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 1.16 0.00 0.00 855 D 7.89 4.89 0.00 2.68 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 0.00 856 F 7.64 5.02 0.00 3.07 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 0.00 857 G 9.18 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 0.00 0.00 0.00 0.00 858 L 7.21 4.25 0.00 1.62 1.63 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 859 A 7.96 4.17 1.22 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 0.00 860 K 7.62 4.07 0.00 1.74 1.10 0.00 1.97 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 952 M 7.90 4.33 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 953 I 8.66 3.88 1.94 0.00 0.00 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 1.43 0.58 0.96 0.00 0.00 954 D 8.15 4.35 0.00 2.74 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 0.00 955 A 9.05 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 956 D 8.14 4.52 0.00 2.70 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 0.00 957 S 7.87 4.33 0.00 4.06 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 0.00 958 R 7.22 4.36 0.00 1.81 1.87 0.00 3.28 0.00 0.00 3.53 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 959 P 0.00 4.41 0.00 1.86 1.92 0.00 3.61 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 960 K 7.96 4.46 0.00 1.86 1.64 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.45 7.81 961 F 8.32 4.20 0.00 3.11 2.93 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 0.00 962 R 8.23 3.97 0.00 2.04 2.24 0.00 2.96 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 963 E 8.11 4.04 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.31 0.00 964 L 7.83 4.09 0.00 2.06 1.77 0.98 0.61 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 0.00 965 I 7.83 3.84 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.02 0.95 0.00 0.00 966 I 7.68 3.19 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.92 0.00 0.00 967 E 7.97 3.82 0.00 2.11 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 2.02 1.97 0.00 968 F 8.14 4.06 0.00 3.24 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 0.00 969 S 9.11 4.32 0.00 3.93 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 0.00 970 K 7.80 3.85 0.00 1.84 1.93 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.50 7.81 971 M 7.56 4.22 0.00 1.81 1.83 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.84 0.00 972 A 7.70 4.20 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 0.00 973 R 7.72 4.17 0.00 1.94 2.03 0.00 3.13 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 974 D 7.79 4.80 0.00 2.71 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 0.00 975 P 0.00 4.35 0.00 2.21 2.12 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 976 Q 7.88 4.40 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.13 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 977 R 7.60 3.84 0.00 1.66 1.54 0.00 3.07 0.00 0.00 2.87 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.27 0.00 978 Y 8.28 4.87 0.00 2.95 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 0.00 979 L 7.81 5.07 0.00 1.58 1.54 0.98 0.86 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 0.00 980 V 8.64 4.40 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 0.76 0.00 0.00 0.92 0.00 0.00 981 I 8.04 4.56 1.92 0.00 0.00 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 1.59 0.86 0.99 0.00 0.00 982 Q 8.89 4.13 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.12 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 983 G 7.39 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 0.00 984 D 8.00 4.65 0.00 2.71 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 0.00 985 E 8.69 3.87 0.00 2.04 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 2.23 2.35 0.00 986 R 8.14 2.51 0.00 1.76 2.10 0.00 3.38 0.00 0.00 2.97 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 987 M 8.94 2.55 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 *988 H 8.93 3.80 0.00 2.93 2.88 0.00 7.20 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 0.00 989 L 7.82 4.88 0.00 1.50 1.52 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 990 P 0.00 4.33 0.00 2.09 2.22 0.00 3.71 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 991 S 8.49 4.33 0.00 3.62 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 0.00 992 P 0.00 4.83 0.00 1.95 2.03 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.54 0.00 993 T 8.09 3.75 4.24 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 1.21 0.00 0.00 994 D 7.31 4.75 0.00 2.92 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 0.00 995 S 8.78 4.99 0.00 3.67 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 0.00 996 N 9.46 4.54 0.00 2.71 2.89 0.00 0.00 6.48 8.75 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 0.00 997 F 8.45 4.32 0.00 3.13 3.11 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 0.00 *998 Y 8.30 4.31 0.00 2.36 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 0.00 0.00 0.00 0.00 999 R 8.16 4.07 0.00 2.02 2.10 0.00 3.28 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 1000 A 7.54 4.14 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 1001 L 7.16 4.00 0.00 1.79 1.62 0.92 0.98 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 1002 M 7.59 4.81 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.75 0.00 1003 D 7.35 4.48 0.00 2.63 2.40 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 *1004 E 8.30 4.22 0.00 1.73 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.