NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 595 T 4.5999 8.1744 117.3314 63.2139 69.8982 173.1386 596 F 4.2379 9.9753 130.5726 57.3756 40.1368 169.0290 597 V 4.2402 7.5593 126.1322 60.4500 33.9228 174.5163 598 D 4.1918 8.3801 127.7520 52.3127 39.8445 174.4198 599 P 4.2486 0.0000 0.0000 62.6782 32.3757 176.3035 *609 V 4.2618 8.1009 116.6885 62.3688 32.8242 177.3441 610 H 4.7473 7.8880 114.3425 56.5169 29.0046 176.0356 611 E 3.7460 8.0438 120.0263 58.2288 29.5477 177.0401 612 F 4.8943 7.8988 113.6325 56.6866 40.6590 174.0243 613 A 4.8275 7.9085 123.8997 49.8724 21.8521 175.7395 614 K 4.2175 8.4675 122.0946 56.1671 33.6099 175.8711 615 E 4.7115 8.7141 126.1561 55.8160 29.9492 175.7787 616 L 4.4969 8.9117 128.0380 53.7313 43.4480 176.3031 617 D 4.4772 8.5542 121.6729 53.3079 41.7922 177.0856 618 A 3.9960 8.7183 130.1036 55.2215 18.6743 178.9988 619 T 3.8603 8.0833 110.0858 65.1913 67.5786 174.5420 620 N 4.6380 8.4291 117.0871 53.7712 38.9768 173.9537 621 I 5.0902 7.4538 120.3692 59.4086 39.1942 175.3025 622 S 4.8247 9.0707 120.9931 56.5397 66.5277 172.7450 623 I 4.6971 8.3561 122.2250 60.2646 38.1114 174.8027 624 D 4.7631 9.0964 127.0976 55.4246 42.7514 177.3072 625 K 4.5644 7.6454 118.8961 54.8690 35.8266 175.0463 626 V 4.2004 8.4554 127.6332 62.6427 31.9955 175.3535 627 V 3.8265 8.9717 129.5551 63.4353 31.6184 176.7307 628 G 3.9575 7.2500 107.0760 46.2619 0.0000 170.7625 629 A 4.6141 8.6217 124.1427 51.2594 19.8930 177.2481 630 G 4.3214 8.8681 112.1111 43.3896 0.0000 172.6751 631 E 3.8561 8.9297 118.8991 58.7031 29.7056 177.8450 632 F 4.7851 8.7754 114.4956 56.3266 40.9052 176.1456 633 G 4.3023 7.0975 107.6062 46.1254 0.0000 171.6133 634 E 4.7904 7.7521 122.4718 55.7787 31.6779 175.9090 635 V 5.0098 8.8330 121.8841 61.5287 34.8320 174.3915 636 C 5.3660 9.3178 121.8572 57.4538 33.6583 172.2258 637 S 5.0795 9.1745 112.8695 56.8508 66.4591 173.5205 638 G 4.1522 7.9635 107.5026 46.1291 0.0000 172.3573 639 R 5.0796 8.2459 120.1832 54.2538 34.8281 174.3117 640 L 5.0799 8.9096 124.2162 53.1158 45.1572 175.0221 641 K 4.6562 9.0319 128.7957 55.4877 32.7168 176.6503 642 L 4.4095 9.1959 128.3499 53.3027 42.6043 176.4008 643 P 4.2466 0.0000 0.0000 65.6827 31.2516 178.0078 644 S 4.2611 7.8855 110.0434 58.6977 63.1841 175.0242 645 K 4.1315 8.2836 120.6685 56.2376 30.9975 176.9388 646 K 4.0566 7.5029 118.7329 56.6685 32.5378 175.2725 647 E 5.2694 8.6187 121.6674 54.5439 31.8571 175.3566 648 I 4.7293 8.5746 117.0491 58.8795 41.3994 174.9918 649 S 4.7600 8.5607 119.2367 58.8738 63.6571 173.9981 650 V 4.8371 8.7032 115.2153 59.8252 36.5527 174.0362 651 A 5.0739 9.0930 125.1399 51.2941 20.7357 176.5151 652 I 5.0887 8.9760 122.0462 59.4483 41.1516 174.7188 653 K 5.3108 9.2575 125.8572 54.8028 35.6066 175.3134 654 T 5.1260 8.7945 113.8763 59.7814 72.0393 172.7084 655 L 4.0905 8.0772 126.0124 53.4251 42.9416 176.6160 656 K 4.0910 9.0750 126.1701 56.9506 33.6772 176.6763 657 V 3.7617 8.3747 121.9630 64.3083 32.0085 175.8406 658 G 3.7775 8.7678 113.9934 46.3474 0.0000 173.3333 659 Y 4.4608 7.2229 115.9180 56.8568 38.6474 176.6662 660 T 4.3597 8.8813 112.6972 61.1794 71.4967 175.9003 661 E 4.1546 8.7007 121.2518 59.3842 29.3726 179.6149 662 K 4.0027 8.0864 119.4200 59.6039 32.3016 178.7107 663 Q 4.2858 8.1998 118.2427 59.0322 28.6123 178.8028 664 R 3.7143 8.2446 119.6624 59.3741 30.0566 178.7468 665 R 3.8893 8.1540 117.8570 59.5128 29.8906 178.8859 666 D 4.3164 8.1517 117.5708 57.0716 40.6187 178.3006 667 F 3.5146 7.7240 121.2939 61.2475 39.3876 177.3374 668 L 3.9160 8.1330 118.5039 57.1606 41.3392 179.4823 669 G 3.7050 8.1528 106.2915 47.7836 0.0000 175.2162 670 E 4.1110 7.7516 119.9832 59.2022 29.5736 178.8282 671 A 3.8996 7.6177 120.2383 55.2231 18.2637 179.5476 672 S 4.0619 8.0358 113.6906 61.5732 62.8293 177.0682 673 I 3.6600 7.4622 122.0147 64.3815 37.1459 177.7743 674 M 3.3973 8.0495 119.4454 58.5583 31.7972 178.3074 675 G 3.9008 7.7011 105.1025 46.3214 0.0000 174.9381 676 Q 3.5782 7.0020 118.9871 56.1176 29.0545 175.7279 677 F 5.1934 6.8106 118.7873 55.7167 40.9229 175.3404 678 D 4.6340 8.6982 123.2066 52.9405 42.2065 173.4139 679 H 4.6212 8.1371 123.9630 53.6302 32.8363 172.7187 680 P 4.3288 0.0000 0.0000 65.0056 31.4298 176.7025 681 N 4.9671 8.3653 115.7632 52.7466 39.0208 173.1420 682 I 5.0178 7.5305 118.9356 59.0918 39.9771 175.7252 683 I 3.8966 8.5997 127.8247 62.1777 37.7550 175.6812 684 R 4.1970 9.1019 127.8521 55.7912 31.4237 174.8324 685 L 4.5633 8.4027 128.6727 54.4910 42.0735 176.0250 686 E 4.1291 9.2784 127.6697 57.0655 30.4139 177.5876 687 G 3.9278 6.8794 105.1455 45.4902 0.0000 170.9300 688 V 4.8247 8.0908 111.7942 59.3897 35.4423 175.0437 689 V 4.7949 8.6245 121.5056 61.5442 32.8277 176.0883 690 T 4.4357 9.3541 116.7876 61.6463 70.3602 175.0044 691 K 4.3170 8.3820 119.3914 56.9242 32.5032 176.1561 692 S 4.7833 7.6228 112.2505 56.4703 66.1864 173.1024 693 K 4.7930 8.2684 119.7739 53.6500 34.8556 174.7003 694 P 4.4631 0.0000 0.0000 62.2845 32.2870 176.3683 695 V 4.0244 8.1196 120.4784 63.6613 32.8087 174.5201 696 M 5.5592 9.2280 125.4313 53.7178 36.6623 174.1704 697 I 4.6614 8.9468 122.4215 59.4559 40.5410 174.5990 698 V 4.9030 8.8444 127.4612 61.3666 33.8692 174.4738 699 T 5.2648 8.9698 117.5427 59.0928 72.9488 172.5882 700 E 4.2041 8.7128 122.6924 57.1672 29.9082 175.8680 701 Y 4.3413 8.7169 128.2437 57.7522 40.1291 174.8728 702 M 4.3092 7.6984 125.0979 52.9127 33.6735 175.4011 703 E 3.4492 8.3267 125.3912 58.6671 29.9233 177.4059 704 N 4.6193 7.7513 113.3244 52.2548 39.4870 177.2018 705 G 3.7745 7.6933 107.6441 45.9978 0.0000 173.4993 706 S 4.6593 8.3242 116.4488 58.2769 64.8683 174.8608 707 L 4.0839 8.7880 127.8013 58.1219 42.0372 179.2796 708 D 4.4353 8.1106 119.0348 56.6575 39.2322 178.6432 709 S 4.2172 8.0598 114.4082 60.7406 63.3712 175.6560 710 F 4.4321 8.3910 124.2996 61.3303 39.2157 177.2151 711 L 4.2317 8.4313 118.6227 57.8869 41.1665 179.7436 712 R 4.1369 7.9748 117.3067 58.8962 30.0467 178.6123 713 K 4.1649 7.6823 116.3296 57.8050 32.3266 176.9832 714 H 4.9126 7.8418 116.3892 53.6078 29.8397 172.6188 715 D 3.6866 8.2212 118.3113 55.8083 41.0166 175.7600 716 A 3.1450 5.8000 127.0117 53.0620 15.9393 177.4815 717 Q 4.2171 7.5784 116.6174 57.0253 29.5779 175.5936 718 F 5.1634 7.8265 116.9644 55.7434 41.5483 176.1851 719 T 4.3368 8.9343 113.7567 61.3193 70.8057 175.9962 720 V 3.6169 8.3541 121.3852 66.3728 31.4985 178.1602 721 I 3.7026 7.7532 117.8236 64.0154 37.8887 177.7214 722 Q 3.9624 8.1762 119.0563 58.9611 28.5841 178.7809 723 L 3.8823 7.9296 119.9722 57.7941 41.5688 179.7839 724 V 3.7139 8.2634 118.7428 65.8096 31.4078 178.2714 725 G 3.6111 8.2943 105.6770 47.9553 0.0000 175.4967 726 M 3.9953 7.9047 121.0016 58.2923 32.0028 178.9276 727 L 4.0782 8.0046 118.9924 57.7224 41.6755 179.6247 728 R 4.0265 8.5483 119.3375 59.1933 30.0483 178.6719 729 G 3.6655 8.0741 105.5957 47.9828 0.0000 175.5768 730 I 3.7288 7.7964 122.4000 64.0375 37.0910 178.3571 731 A 3.7506 8.3241 121.5797 55.1278 18.1853 179.6759 732 S 4.0929 8.4022 111.9356 61.3992 62.4601 176.5740 733 G 3.4563 8.1090 108.4351 48.1490 0.0000 175.6297 734 M 3.6322 7.8890 121.1745 57.4588 31.6072 178.7096 735 K 3.8738 7.9575 120.3107 59.6006 32.3604 178.2761 736 Y 4.0981 7.7628 119.5903 60.5939 38.7374 177.6421 737 L 3.4251 7.7439 120.2368 57.7833 41.6758 179.8167 738 S 4.1727 8.1971 114.3479 61.5297 62.7637 176.0867 739 D 4.3600 8.0907 121.8671 57.2698 40.6483 177.9648 740 M 4.3214 7.8443 117.3155 55.2948 31.8849 177.6349 741 G 3.9741 7.9823 107.4951 45.9485 0.0000 172.3667 742 Y 4.3111 7.9371 121.2975 55.4634 39.8050 174.5268 743 V 4.4183 7.5106 127.3223 61.3604 32.8449 175.8590 744 H 3.7573 9.6859 128.2261 58.8039 29.8363 177.7334 745 R 4.2206 8.4336 114.7085 56.6078 29.0286 175.7894 746 D 4.7975 7.7368 117.2036 53.4622 41.7759 175.0731 747 L 3.9222 8.2589 120.0356 54.4225 42.4580 175.3566 748 A 4.5244 7.9562 126.7975 50.7192 21.9763 176.5282 749 A 4.0112 9.3761 124.3614 55.1432 18.6179 180.6415 750 R 4.5191 7.7933 110.4788 58.2579 29.8568 176.8991 751 N 4.8150 8.2393 115.6524 52.8840 39.9685 173.9667 752 I 4.8387 7.6058 121.0444 59.5973 39.6543 174.8438 753 L 5.1167 8.6686 126.3041 53.0735 44.9675 175.2449 754 I 4.8710 8.2837 121.2481 59.3913 41.4748 174.9091 755 N 5.0418 8.5236 127.3975 51.2837 39.6460 175.8521 756 S 4.2144 8.7059 112.3891 61.1432 62.9880 174.6541 757 N 4.6700 8.1996 116.2650 52.6739 38.3763 175.0253 758 L 3.4810 7.7936 116.1965 55.1906 39.9107 174.3974 759 V 3.8162 7.9030 120.2972 62.9586 32.4342 174.5997 760 C 5.2609 8.5678 125.2488 58.2481 30.1461 173.3197 761 K 4.7719 8.8321 121.6137 54.4627 36.4828 175.8900 762 V 3.9027 8.8448 125.1360 63.1768 32.7029 174.9372 763 S 4.9876 8.0738 121.6867 57.2927 65.8952 172.1461 764 D 4.3658 8.6415 117.9548 55.0359 38.5739 173.8224 765 F 4.6306 8.3607 127.0956 56.1288 38.7874 176.2928 766 G 3.9784 7.8768 108.7481 46.6057 0.0000 173.8804 767 L 4.4695 7.6693 117.2300 54.1456 41.8681 176.3489 768 A 4.5171 7.7210 121.2203 52.0182 19.2311 178.1311 769 R 4.7605 7.3064 119.8590 54.6688 34.3790 176.7212 770 V 3.9463 8.7307 118.5564 63.1777 31.5322 176.5565 *786 I 3.9548 7.4201 118.8739 60.6648 38.6230 175.9987 787 P 4.7933 0.0000 0.0000 61.2944 31.0299 176.7680 788 I 3.7142 8.3541 127.9501 65.1478 37.4043 178.9522 789 R 3.6690 8.1384 117.3666 58.1784 30.1670 177.2730 790 W 4.7340 8.6343 116.0449 56.6914 29.9813 175.5141 791 T 4.7302 7.5222 116.1547 61.6557 69.7097 175.5522 792 S 2.7900 7.9918 120.1745 57.0442 64.9680 173.6699 793 P 3.8716 0.0000 0.0000 65.6183 31.0709 178.8847 794 E 3.8999 7.7218 115.6869 59.1517 29.6170 178.9139 795 A 3.3067 7.2834 121.5769 54.5633 17.9932 179.7236 796 I 3.5093 7.2826 117.3415 64.3109 37.2371 178.2536 797 A 4.2550 7.8758 120.9701 54.7378 17.2017 179.1405 798 Y 4.7357 8.0131 115.3492 56.4967 38.3399 175.1212 799 R 3.5896 7.5769 116.2017 58.1467 28.1516 177.6840 800 K 3.8361 6.3030 118.1743 55.1230 30.5685 174.1438 801 F 4.6368 8.1986 122.4582 55.5073 40.6968 175.5014 802 T 4.7728 8.7965 115.0099 59.1262 72.2214 174.8671 803 S 4.2849 8.6994 116.3150 61.5958 62.6348 176.7272 804 A 4.0623 7.9084 123.9513 54.7629 18.0613 179.7298 805 S 4.2689 8.0561 112.8754 61.5894 63.1154 176.4727 806 D 4.6223 8.1996 122.2477 57.1907 40.6405 178.5899 807 V 3.3764 7.9752 118.9932 65.4240 31.5529 177.6487 808 W 4.5877 8.2113 129.4480 60.2190 30.4859 178.0021 809 S 4.7618 8.5265 116.2048 61.3985 62.2957 176.0451 810 Y 4.2029 8.9112 122.7340 60.7710 38.5341 178.4220 811 G 3.3580 8.3665 106.5878 47.7931 0.0000 175.7197 812 I 4.0342 7.9670 121.6619 64.2562 37.1007 178.5672 813 V 3.9114 8.2095 119.3569 65.9795 31.3022 177.6333 814 L 3.7436 7.9613 120.3862 57.9387 41.8658 178.8250 815 W 4.1043 8.3241 128.1314 60.4837 30.6909 177.6426 816 E 4.0291 8.8533 119.0269 59.4839 28.9706 179.6361 817 V 3.4207 8.0724 118.3916 66.3486 31.4871 178.0257 818 M 4.0211 7.7847 116.2152 57.3215 32.1081 177.7921 819 S 4.2878 7.5262 114.3071 57.1772 63.4027 173.4177 820 Y 3.6247 8.5011 118.5886 59.2348 35.5536 171.0549 821 G 3.9930 8.7244 104.2092 45.8389 0.0000 174.1435 822 E 4.1764 7.3282 117.6913 55.9770 30.1499 176.9092 823 R 4.2517 8.6542 122.4078 55.1701 30.8177 174.1786 824 P 3.1822 0.0000 0.0000 63.9062 31.7866 175.4740 825 Y 2.6400 6.5104 117.9493 57.4095 36.4826 170.8661 826 W 3.4575 6.4845 121.8097 58.5770 28.7498 175.6945 827 E 4.8300 8.9033 121.0029 56.7031 29.5378 175.8990 828 M 4.1591 7.9935 118.0226 55.3956 32.9571 177.4182 829 S 4.1239 8.6697 115.9130 58.9387 64.0147 174.9821 830 N 4.2226 8.8941 125.8879 56.8822 38.3666 177.4707 831 Q 3.9660 7.9983 118.6236 59.0564 28.7681 178.4795 832 D 4.3256 7.8406 119.4991 56.9188 41.0480 178.6933 833 V 3.2199 7.7046 118.8738 65.8813 31.4644 178.1479 834 I 3.4954 7.5973 119.3851 64.2239 36.9363 178.4530 835 K 3.8764 8.0590 120.1446 59.2743 32.0726 178.6967 836 A 3.9920 8.2637 121.5000 55.2311 18.3549 179.6977 837 V 4.0077 7.5235 117.8767 65.7579 31.3573 177.6410 838 D 4.3506 7.7899 116.4861 57.3791 41.1673 177.5745 839 E 4.2691 8.2560 116.8144 57.0978 29.7852 177.6173 840 G 4.0758 8.1577 107.9113 44.9546 0.0000 173.1391 841 Y 4.6986 8.2787 118.2717 58.0310 39.1581 175.0646 842 R 4.6557 9.3030 121.0399 53.8389 35.1159 174.6687 843 L 4.0203 7.5881 120.7217 54.4146 41.9022 175.8250 844 P 4.7424 0.0000 0.0000 61.2232 32.4304 174.2182 845 P 3.8650 0.0000 0.0000 61.8779 31.7957 174.7654 846 P 4.2946 0.0000 0.0000 62.1599 31.9502 175.3289 847 M 4.1568 8.4156 119.9225 57.4134 32.4041 175.5660 848 D 4.4129 8.7687 123.6599 55.2551 38.9009 173.0421 849 C 4.2642 7.7866 119.6512 58.1932 32.2189 171.1908 850 P 4.6147 0.0000 0.0000 62.9669 32.5185 176.9404 851 A 4.4009 9.2678 125.6981 54.8157 18.2961 180.0573 852 A 3.9256 7.9837 118.5085 55.3093 18.5084 179.6944 853 L 3.9904 7.8325 117.0295 57.8310 41.8383 178.8027 854 Y 4.1723 8.1523 119.6682 60.6083 38.6539 177.6141 855 Q 3.7339 8.3517 120.8168 59.0484 29.0442 178.0863 856 L 3.7642 7.7547 121.2398 58.2438 42.0594 178.7465 857 M 3.0287 7.5728 118.4191 58.1534 31.5598 178.7199 858 L 3.7793 6.9001 117.3228 57.7719 41.8372 179.1580 859 D 4.3769 7.9738 118.9660 57.5641 40.6442 178.6207 860 C 4.0934 7.9419 117.1779 61.6504 27.6627 175.0286 861 W 3.9604 6.8672 118.8450 55.1841 29.6268 176.2935 862 Q 4.1865 7.3311 118.7595 55.8711 28.8007 176.6443 863 K 4.0588 9.0196 124.0676 59.5045 32.5034 176.4316 864 D 4.5913 8.0738 120.6846 53.1972 41.0552 176.6273 865 R 4.0081 8.7022 124.5550 59.2383 29.5557 178.5426 866 N 4.4341 8.5181 115.2259 55.4529 38.5564 175.4099 867 N 4.6848 8.0068 114.0425 53.3773 39.2028 175.7146 868 R 4.3325 7.4548 118.3383 54.8374 30.8298 174.8309 869 P 4.4901 0.0000 0.0000 62.5310 32.2602 176.8987 870 K 4.1638 8.9341 119.7653 55.7337 34.1581 178.4536 871 F 4.0655 8.4465 119.7058 60.8029 38.7904 177.5817 872 E 3.9501 8.2486 118.4715 59.4164 29.3619 178.8101 873 Q 4.0015 7.8810 117.6635 58.8139 28.8643 178.4766 874 I 3.6055 7.7184 120.9165 64.2786 37.0496 178.5312 875 V 3.5872 7.9637 119.2024 66.2479 31.3440 178.2447 876 S 4.1277 8.0889 114.7753 61.5783 62.7512 176.7513 877 I 3.6916 8.0085 122.7296 64.4703 36.8016 178.5677 878 L 4.0509 8.0382 119.7628 57.7719 41.4135 179.1516 879 D 4.3609 8.4753 119.3127 57.3941 40.7202 179.0815 880 K 3.9870 8.1212 118.9128 59.4429 31.6892 179.4344 881 L 4.0109 7.8776 118.9874 57.8183 41.2871 179.6345 882 I 3.8049 7.7949 119.1016 64.4899 37.1163 178.4722 883 R 4.1756 8.1034 117.9431 57.5024 31.4808 176.4996 884 N 5.0168 8.1203 117.0152 50.3255 38.7973 172.7129 885 P 4.5721 0.0000 0.0000 64.8593 31.7623 178.6384 886 G 3.7427 8.2228 105.2837 47.9859 0.0000 175.4424 887 S 4.1999 8.2909 117.1579 61.4786 62.5999 176.3153 888 L 4.2703 7.6617 119.8654 56.4521 41.4904 178.8517 889 K 4.3569 7.8770 118.0628 57.4350 32.2949 176.9681 890 I 3.9585 7.2619 119.9537 61.0588 36.8594 174.7289 891 I 4.4853 7.9641 126.3827 61.4508 39.0099 175.1945 892 T 3.8671 9.0417 123.1884 64.9674 68.4755 173.7403 *898 P 4.4173 0.0000 0.0000 62.7714 33.8979 177.2694 899 S 2.9507 8.1421 114.5495 57.7115 63.3679 173.6662 900 N 4.9629 7.8452 117.5676 51.5486 41.3523 173.6273 901 L 4.7587 8.5365 124.5313 54.5696 43.2943 175.8753 902 L 4.9011 8.9319 122.1290 52.8718 44.2246 175.5728 903 L 3.8541 8.5318 126.1953 54.7617 42.7270 176.2241 904 D 4.6219 8.7631 125.9106 54.4518 41.0572 175.8312 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 595 T 8.17 4.60 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 1.32 0.00 0.00 596 F 9.98 4.24 0.00 3.13 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 597 V 7.56 4.24 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 0.76 0.00 0.00 0.87 0.00 0.00 598 D 8.38 4.19 0.00 2.88 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 0.00 599 P 0.00 4.25 0.00 2.07 2.06 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 *609 V 8.10 4.26 2.00 0.00 0.00 0.00 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 0.81 0.00 0.00 610 H 7.89 4.75 0.00 3.12 3.30 0.00 5.76 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 611 E 8.04 3.75 0.00 1.56 1.27 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 1.47 1.80 0.00 612 F 7.90 4.89 0.00 2.99 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 0.00 613 A 7.91 4.83 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 K 8.47 4.22 0.00 1.72 1.73 0.00 1.87 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.43 7.81 615 E 8.71 4.71 0.00 1.91 1.82 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 2.25 2.40 0.00 616 L 8.91 4.50 0.00 1.52 1.57 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 617 D 8.55 4.48 0.00 2.67 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 0.00 618 A 8.72 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 0.00 619 T 8.08 3.86 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 1.34 0.00 0.00 620 N 8.43 4.64 0.00 2.95 2.97 0.00 0.00 6.76 7.83 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 0.00 621 I 7.45 5.09 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 1.29 0.58 0.92 0.00 0.00 622 S 9.07 4.82 0.00 3.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 623 I 8.36 4.70 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 1.36 0.65 0.93 0.00 0.00 624 D 9.10 4.76 0.00 2.49 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 0.00 625 K 7.65 4.56 0.00 1.79 1.62 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.46 7.81 626 V 8.46 4.20 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 0.83 0.00 0.00 0.95 0.00 0.00 627 V 8.97 3.83 2.27 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 0.82 0.00 0.00 1.00 0.00 0.00 628 G 7.25 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 629 A 8.62 4.61 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 630 G 8.87 4.32 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 0.00 631 E 8.93 3.86 0.00 1.81 1.82 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 1.47 1.93 0.00 632 F 8.78 4.79 0.00 3.05 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 0.00 633 G 7.10 4.30 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 0.00 634 E 7.75 4.79 0.00 1.91 1.90 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 2.32 2.26 0.00 635 V 8.83 5.01 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 1.15 0.00 0.00 1.01 0.00 0.00 636 C 9.32 5.37 0.00 3.20 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 0.00 637 S 9.17 5.08 0.00 3.94 4.13 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 0.00 638 G 7.96 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 639 R 8.25 5.08 0.00 1.66 1.74 0.00 3.11 0.00 0.00 2.99 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 640 L 8.91 5.08 0.00 1.69 1.47 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 641 K 9.03 4.66 0.00 1.74 1.85 0.00 1.86 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.45 7.81 642 L 9.20 4.41 0.00 1.77 1.57 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 643 P 0.00 4.25 0.00 2.03 2.11 0.00 3.67 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 2.02 2.07 0.00 644 S 7.89 4.26 0.00 3.97 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 0.00 645 K 8.28 4.13 0.00 1.91 2.12 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.53 7.81 646 K 7.50 4.06 0.00 1.82 1.73 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.42 7.81 647 E 8.62 5.27 0.00 1.80 1.82 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 2.19 2.42 0.00 648 I 8.57 4.73 1.88 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 1.33 1.34 0.91 0.00 0.00 649 S 8.56 4.76 0.00 3.67 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 0.00 650 V 8.70 4.84 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 0.76 0.00 0.00 0.94 0.00 0.00 651 A 9.09 5.07 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 0.00 652 I 8.98 5.09 1.92 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 1.26 0.72 0.96 0.00 0.00 653 K 9.26 5.31 0.00 1.88 1.99 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.44 7.81 654 T 8.79 5.13 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 1.25 0.00 0.00 655 L 8.08 4.09 0.00 0.63 1.16 0.50 -0.57 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 0.00 656 K 9.07 4.09 0.00 1.84 2.01 0.00 1.39 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.62 1.51 7.81 657 V 8.37 3.76 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 0.80 0.00 0.00 0.96 0.00 0.00 658 G 8.77 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 0.00 659 Y 7.22 4.46 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 0.00 660 T 8.88 4.36 4.30 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 1.24 0.00 0.00 661 E 8.70 4.15 0.00 2.05 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 2.45 2.36 0.00 662 K 8.09 4.00 0.00 1.88 1.88 0.00 1.77 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.60 7.81 663 Q 8.20 4.29 0.00 2.56 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.54 0.00 664 R 8.24 3.71 0.00 1.77 2.13 0.00 3.07 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.45 0.00 665 R 8.15 3.89 0.00 2.15 1.98 0.00 3.19 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 666 D 8.15 4.32 0.00 2.73 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 0.00 667 F 7.72 3.51 0.00 2.16 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 0.00 668 L 8.13 3.92 0.00 1.72 1.59 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 669 G 8.15 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 0.00 670 E 7.75 4.11 0.00 2.07 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 2.26 2.41 0.00 671 A 7.62 3.90 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 0.00 672 S 8.04 4.06 0.00 4.03 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 0.00 673 I 7.46 3.66 2.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.10 0.73 0.00 0.00 674 M 8.05 3.40 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 675 G 7.70 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 676 Q 7.00 3.58 0.00 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.56 0.00 0.00 0.00 0.00 0.00 1.16 1.47 0.00 677 F 6.81 5.19 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 678 D 8.70 4.63 0.00 2.60 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 0.00 679 H 8.14 4.62 0.00 2.81 3.02 0.00 5.73 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 680 P 0.00 4.33 0.00 2.14 2.08 0.00 2.99 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 681 N 8.37 4.97 0.00 2.88 2.90 0.00 0.00 6.93 7.21 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 0.00 682 I 7.53 5.02 1.97 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 1.25 0.90 1.03 0.00 0.00 683 I 8.60 3.90 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.78 0.96 0.00 0.00 684 R 9.10 4.20 0.00 1.92 1.88 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 685 L 8.40 4.56 0.00 1.62 1.52 0.96 0.98 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 0.00 686 E 9.28 4.13 0.00 2.04 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 2.36 2.43 0.00 687 G 6.88 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 0.00 0.00 0.00 688 V 8.09 4.82 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 0.61 0.00 0.00 0.98 0.00 0.00 689 V 8.62 4.79 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.00 0.00 0.00 690 T 9.35 4.44 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 1.18 0.00 0.00 691 K 8.38 4.32 0.00 1.78 1.90 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.59 7.81 692 S 7.62 4.78 0.00 3.92 3.79 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 0.00 0.00 0.00 693 K 8.27 4.79 0.00 1.78 1.81 0.00 1.84 0.00 0.00 2.00 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.44 7.81 694 P 0.00 4.46 0.00 2.17 2.06 0.00 3.79 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 2.00 1.96 0.00 695 V 8.12 4.02 1.90 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 1.22 0.00 0.00 0.83 0.00 0.00 696 M 9.23 5.56 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.55 0.00 697 I 8.95 4.66 1.69 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.26 0.78 0.00 0.00 698 V 8.84 4.90 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 1.09 0.00 0.00 0.95 0.00 0.00 699 T 8.97 5.26 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 700 E 8.71 4.20 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 701 Y 8.72 4.34 0.00 3.07 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 702 M 7.70 4.31 0.00 1.97 1.75 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 703 E 8.33 3.45 0.00 1.96 1.90 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 2.32 2.48 0.00 704 N 7.75 4.62 0.00 2.41 1.87 0.00 0.00 7.05 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 705 G 7.69 3.77 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 0.00 0.00 0.00 706 S 8.32 4.66 0.00 3.91 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 707 L 8.79 4.08 0.00 1.82 1.88 0.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 708 D 8.11 4.44 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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0.87 0.84 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 0.00 815 W 8.32 4.10 0.00 3.72 3.47 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 0.00 816 E 8.85 4.03 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.86 0.00 817 V 8.07 3.42 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 0.88 0.00 0.00 0.92 0.00 0.00 818 M 7.78 4.02 0.00 1.94 1.96 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 2.59 2.82 0.00 819 S 7.53 4.29 0.00 3.18 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 0.00 820 Y 8.50 3.62 0.00 3.17 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 0.00 821 G 8.72 3.99 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 0.00 0.00 0.00 822 E 7.33 4.18 0.00 1.92 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 823 R 8.65 4.25 0.00 1.99 1.93 0.00 3.33 0.00 0.00 3.49 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 824 P 0.00 3.18 0.00 1.25 1.10 0.00 3.73 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.99 0.00 825 Y 6.51 2.64 0.00 2.84 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 0.00 826 W 6.48 3.46 0.00 3.64 2.56 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 0.00 0.00 0.00 0.00 827 E 8.90 4.83 0.00 2.02 2.00 0.00 0.00 0.00 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 2.41 0.00 828 M 7.99 4.16 0.00 2.05 2.16 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 3.08 2.63 0.00 829 S 8.67 4.12 0.00 3.88 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 0.00 830 N 8.89 4.22 0.00 2.82 2.83 0.00 0.00 7.15 7.83 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 0.00 831 Q 8.00 3.97 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 832 D 7.84 4.33 0.00 2.81 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 0.00 833 V 7.70 3.22 1.93 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 0.06 0.00 0.00 0.67 0.00 0.00 834 I 7.60 3.50 1.92 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 1.27 0.59 0.82 0.00 0.00 835 K 8.06 3.88 0.00 1.95 1.74 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.58 7.81 836 A 8.26 3.99 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 0.00 837 V 7.52 4.01 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 1.40 0.00 0.00 0.86 0.00 0.00 838 D 7.79 4.35 0.00 2.75 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 0.00 839 E 8.26 4.27 0.00 2.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 840 G 8.16 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 Y 8.28 4.70 0.00 3.06 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 0.00 842 R 9.30 4.66 0.00 1.91 1.77 0.00 3.17 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.91 0.00 843 L 7.59 4.02 0.00 0.66 0.35 -0.93 -1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 844 P 0.00 4.74 0.00 2.34 2.39 0.00 3.95 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 845 P 0.00 3.87 0.00 1.87 0.98 0.00 3.68 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.60 0.00 846 P 0.00 4.29 0.00 2.05 1.68 0.00 3.61 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.29 0.00 847 M 8.42 4.16 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 848 D 8.77 4.41 0.00 2.86 2.73 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 0.00 0.00 0.00 849 C 7.79 4.26 0.00 3.11 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 0.00 850 P 0.00 4.61 0.00 2.21 2.11 0.00 3.68 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 851 A 9.27 4.40 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 0.00 852 A 7.98 3.93 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 0.00 853 L 7.83 3.99 0.00 1.86 1.72 0.92 0.79 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 0.00 854 Y 8.15 4.17 0.00 3.05 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 0.00 855 Q 8.35 3.73 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 856 L 7.75 3.76 0.00 1.84 1.73 0.84 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 857 M 7.57 3.03 0.00 0.51 1.52 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 2.56 2.35 0.00 858 L 6.90 3.78 0.00 1.48 1.56 0.74 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 859 D 7.97 4.38 0.00 2.67 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 0.00 860 C 7.94 4.09 0.00 2.45 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 0.00 861 W 6.87 3.96 0.00 3.01 2.24 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 0.00 862 Q 7.33 4.19 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 863 K 9.02 4.06 0.00 1.80 1.91 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 864 D 8.07 4.59 0.00 2.74 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 865 R 8.70 4.01 0.00 2.05 2.21 0.00 2.99 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 866 N 8.52 4.43 0.00 2.88 2.93 0.00 0.00 6.99 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 0.00 867 N 8.01 4.68 0.00 2.85 2.85 0.00 0.00 7.01 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 868 R 7.45 4.33 0.00 1.84 1.81 0.00 3.37 0.00 0.00 3.64 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.64 0.00 869 P 0.00 4.49 0.00 2.04 1.96 0.00 3.70 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 870 K 8.93 4.16 0.00 1.73 1.74 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.60 7.81 871 F 8.45 4.07 0.00 3.04 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 0.00 872 E 8.25 3.95 0.00 2.07 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 2.39 2.42 0.00 873 Q 7.88 4.00 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 874 I 7.72 3.61 1.87 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.88 0.64 0.00 0.00 875 V 7.96 3.59 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 1.12 0.00 0.00 0.98 0.00 0.00 876 S 8.09 4.13 0.00 4.06 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 0.00 877 I 8.01 3.69 2.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.23 0.89 0.00 0.00 878 L 8.04 4.05 0.00 1.85 1.73 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 879 D 8.48 4.36 0.00 2.86 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 0.00 880 K 8.12 3.99 0.00 1.99 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.68 7.81 881 L 7.88 4.01 0.00 1.89 1.72 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 882 I 7.79 3.80 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.59 0.91 0.00 0.00 883 R 8.10 4.18 0.00 2.01 1.99 0.00 3.10 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 884 N 8.12 5.02 0.00 2.75 2.76 0.00 0.00 6.82 7.25 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 0.00 885 P 0.00 4.57 0.00 2.31 2.31 0.00 3.98 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.90 0.00 886 G 8.22 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 0.00 887 S 8.29 4.20 0.00 4.02 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 0.00 888 L 7.66 4.27 0.00 1.78 1.73 0.93 0.99 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 0.00 889 K 7.88 4.36 0.00 1.84 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.56 7.81 890 I 7.26 3.96 1.88 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 1.30 0.54 0.92 0.00 0.00 891 I 7.96 4.49 1.87 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 1.49 0.81 0.91 0.00 0.00 892 T 9.04 3.87 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 1.19 0.00 0.00 *898 P 0.00 4.42 0.00 2.02 2.02 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.13 0.00 899 S 8.14 2.95 0.00 3.25 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 900 N 7.85 4.96 0.00 2.57 2.63 0.00 0.00 7.23 7.78 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 0.00 901 L 8.54 4.76 0.00 1.72 1.94 1.04 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 902 L 8.93 4.90 0.00 1.76 1.69 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 903 L 8.53 3.85 0.00 0.76 1.34 0.50 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 904 D 8.76 4.62 0.00 2.55 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.