NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 752 F 3.9757 8.3249 119.2777 57.2909 40.2290 173.3719 753 F 4.8894 7.4614 120.2185 55.9219 43.4065 172.1586 754 D 4.9895 8.4043 122.1588 53.1517 44.0523 175.2796 755 E 4.6803 8.5554 118.2417 55.7169 30.4500 176.5220 756 L 4.1520 8.3535 125.9966 55.8698 42.7650 176.2639 757 K 4.5363 8.8901 126.6697 54.8670 35.9225 174.6401 758 I 4.5562 8.2607 128.2277 60.0606 38.1433 175.0213 759 D 4.3382 8.6427 128.2777 53.9617 41.1513 175.3643 760 N 4.3042 9.1525 124.9112 56.8549 39.0106 175.2461 761 K 4.3749 8.3614 116.5981 56.3776 32.3741 176.8917 762 V 4.4567 9.1755 123.8659 61.1153 35.7913 174.1439 763 D 4.9508 8.4970 124.8209 52.8067 41.9097 175.2858 764 I 4.2264 8.0391 128.5447 61.2446 37.4383 177.6605 765 I 3.7147 8.4902 128.6297 64.1743 37.0774 178.2204 766 G 4.3245 8.8329 110.1598 47.6060 0.0000 173.8992 767 N 4.8057 7.5884 112.4317 50.9584 38.4817 172.8671 768 N 4.1177 8.0272 117.6845 53.9062 35.8520 172.5907 769 V 4.2497 7.5151 120.2968 61.1109 35.2666 174.0639 770 R 4.7803 8.0553 129.8527 54.3045 28.2625 174.5719 771 G 4.2775 7.4345 109.2461 44.1797 0.0000 169.1952 772 E 4.6171 8.6731 118.4911 55.0469 30.4606 176.4402 773 L 3.7348 8.3586 122.6796 54.9609 41.9129 175.0344 774 P 4.6407 0.0000 0.0000 61.6204 32.8520 176.5847 775 N 4.4214 8.8757 119.0248 55.7467 39.1559 174.2803 776 I 4.4827 7.0647 107.8894 58.5459 39.5397 175.4084 777 W 4.8047 8.1299 125.0914 54.8887 32.5493 175.0415 778 L 4.3937 6.9045 125.1442 53.1126 42.0978 174.7957 779 Q 3.6586 8.0618 126.1148 57.8561 29.2155 177.1103 780 Y 4.1056 8.4718 121.3504 58.0575 36.2268 169.3239 781 G 3.1409 7.6032 108.3382 45.8782 0.0000 172.9397 782 Q 6.0400 9.5288 117.2001 54.1236 33.7836 174.1742 783 F 5.2146 8.3889 115.1757 55.6486 41.7904 173.1142 784 K 5.1579 8.8405 121.2621 55.3786 33.5074 175.6787 785 L 4.7393 7.9027 124.9335 53.1849 43.2343 175.8895 786 K 4.5237 8.7157 126.0940 55.2762 33.4292 174.6811 787 A 5.2753 8.9036 129.8690 50.2661 21.1835 175.7166 788 S 4.6009 9.3163 118.6886 57.2720 66.5843 174.5674 789 G 3.9442 9.2095 109.5296 45.4163 0.0000 173.3055 790 G 3.8498 8.2513 107.6290 44.5172 0.0000 173.9579 791 D 3.4810 9.0893 117.8630 53.6409 39.2502 175.5536 792 G 3.9039 8.0587 109.5318 45.4745 0.0000 173.9427 793 T 3.9185 7.7043 111.3860 60.6994 69.6830 173.9748 794 Y 5.0986 7.8862 123.3946 55.9242 41.8199 174.9221 795 S 4.9793 8.5962 114.6046 56.5293 66.8633 172.7496 796 W 5.4500 8.7707 119.1660 55.6478 32.8628 173.7613 797 Y 4.9725 8.5587 119.9782 57.3219 42.3382 173.0542 798 S 4.7465 6.8210 116.3789 56.8044 65.1605 173.3929 799 E 4.0541 8.8316 127.5017 59.0428 29.5297 176.6591 800 N 4.8753 7.8866 117.4983 52.0111 40.9709 175.1229 801 T 3.9531 8.6365 122.8323 66.6674 69.0427 176.8608 802 S 4.2256 8.1997 114.1728 61.5912 63.0514 175.7374 803 I 4.1864 7.7614 119.7377 63.3103 37.8869 176.1614 804 A 4.8976 7.5610 119.4500 51.3875 22.4563 175.6914 805 T 4.7286 9.1988 118.7034 62.1113 72.0175 173.6725 806 V 5.2074 8.1694 120.5754 60.8518 34.3205 173.2134 807 D 5.0415 7.7700 120.5529 52.1678 42.4065 177.8484 808 A 4.1576 7.5773 122.3993 54.3006 19.4768 178.1182 809 S 4.7139 8.5546 108.4868 57.6776 64.2820 174.2002 810 G 2.1155 6.7904 108.2498 45.7316 0.0000 173.6355 811 K 4.6069 7.0221 119.9362 54.3113 35.3642 175.3276 812 V 4.5116 8.1761 128.2626 61.2861 33.9364 174.3138 813 T 5.2097 8.6406 124.3843 61.6300 71.4857 173.4947 814 L 4.4963 8.6269 127.1101 54.9130 42.5428 177.2375 815 N 5.2204 9.3585 119.3547 52.8198 40.6335 174.1057 816 G 3.8686 7.8477 105.5626 45.0292 0.0000 172.8349 817 K 4.3446 8.4106 121.1034 55.5202 32.3026 175.3291 818 G 4.0482 7.8120 115.0952 45.6333 0.0000 170.4239 819 S 5.5699 8.7069 114.9356 57.0836 65.6064 174.2760 820 V 4.5481 8.7795 121.6759 60.5837 35.3422 173.0204 821 V 4.7196 8.3808 121.7907 61.5231 33.7247 174.1573 822 I 4.8865 8.7480 129.0111 59.6594 39.1460 174.5842 823 K 5.0405 8.9572 126.8468 54.9468 33.9650 175.2411 824 A 4.5997 8.8615 127.8851 50.7015 21.3766 175.9180 825 T 5.0175 8.0540 117.7480 61.9443 72.8890 174.1631 826 S 4.9400 8.7599 121.7250 57.2069 64.2801 174.9327 827 G 3.6456 8.5189 109.4238 48.0205 0.0000 173.9449 828 D 4.6659 8.1074 120.9733 54.8011 39.1561 176.1816 829 K 3.8651 7.6606 110.4163 58.5189 30.5369 175.0022 830 Q 4.6785 7.5874 115.1623 54.4299 31.7177 175.4455 831 T 4.8244 8.5104 119.7122 61.9966 71.0367 173.4316 832 V 4.3784 8.3169 126.7860 61.4313 34.1497 174.6267 833 S 5.4178 8.5187 119.1429 56.9147 66.7950 172.9054 834 Y 5.1236 8.9077 122.6114 56.2760 41.8179 174.0638 835 T 4.6165 8.6036 116.8243 60.7051 70.9495 174.6621 836 I 4.1038 8.6358 126.3779 59.2910 38.3317 174.6186 837 K 4.4795 8.5572 126.4784 55.6786 32.7048 176.9607 838 A 4.5732 10.1436 126.8277 51.1478 18.6517 175.9330 839 P 4.5729 0.0000 0.0000 61.4474 32.1225 176.8253 840 S 4.1377 7.4502 115.0876 61.3867 63.1280 174.1433 841 Y 4.7758 6.6982 115.8238 55.9597 40.7558 173.1749 842 M 4.9882 8.4776 120.5127 53.8550 36.2260 173.6264 843 I 4.6793 8.7368 126.0629 59.7430 39.9237 174.3136 844 K 4.7895 8.7081 128.8984 54.5208 35.1624 175.4515 845 V 4.3660 8.2806 123.2697 61.7106 33.0210 174.4163 846 D 5.0752 8.4880 132.7260 53.8032 43.7891 175.4293 847 K 4.5339 8.5216 119.7917 57.6058 35.4178 175.6344 848 Q 4.6698 8.2273 118.0751 55.2993 29.8252 175.3634 849 A 4.2268 8.3049 122.0102 51.4399 23.1108 176.0785 850 Y 4.9351 7.8751 117.1950 58.1461 38.9582 176.6121 851 Y 2.3900 8.4744 123.4155 60.5338 38.4808 178.6091 852 A 3.6954 7.9010 120.5211 55.4569 18.6555 178.9208 853 D 4.3267 7.7064 113.7639 56.4396 41.2029 177.9095 854 A 4.1625 7.6947 121.3655 55.6851 18.4579 178.2209 855 M 3.7557 7.3936 116.9595 58.1909 31.8902 178.0603 856 S 4.0257 7.8447 115.9009 62.0366 63.0929 176.4558 857 I 3.8163 7.1748 120.8174 63.8628 37.1710 176.8217 858 C 4.5220 8.0792 114.6992 55.5971 40.9334 173.4945 859 K 3.4721 8.7671 119.4361 57.6904 29.4221 176.0679 860 N 4.5085 8.1147 112.9094 53.6112 36.1926 174.9350 861 L 4.3904 7.4272 118.7360 54.9543 41.9926 176.8647 862 L 3.7802 7.7408 117.9859 53.0926 42.7294 174.8130 863 P 4.0387 0.0000 0.0000 62.9849 30.8774 176.5719 864 S 4.0591 8.7276 119.0712 61.2464 62.6660 174.1599 865 T 4.6337 7.3086 108.3991 58.7392 71.9419 174.0257 866 Q 3.8094 8.7537 121.0393 59.7965 28.9044 177.8608 867 T 4.1276 7.8999 117.4679 66.0499 66.7726 176.0100 868 V 3.6042 7.4885 119.9044 65.9148 31.2591 178.0318 869 L 4.0672 8.0609 118.8934 57.3733 41.9674 178.8341 870 S 4.3242 7.3235 114.9603 61.2151 62.4663 175.8948 871 D 4.4820 8.1093 122.9896 57.0301 40.5196 179.3891 872 I 3.9025 7.3565 118.6178 64.6785 36.5883 177.7934 873 Y 4.3068 8.4993 120.6823 60.8917 38.4077 177.7029 874 D 4.3577 9.3630 118.8489 57.6430 41.0550 178.9409 875 S 4.1416 8.2831 114.2587 60.8166 63.2163 175.9136 876 W 4.7241 9.3921 121.0117 56.2226 30.1690 177.0315 877 G 4.0049 9.4027 106.5577 43.9442 0.0000 172.5849 878 A 4.4887 9.1602 119.9453 51.7281 19.0690 178.4667 879 A 4.1868 8.9492 126.3053 55.4007 18.5194 179.4521 880 N 4.7911 8.2451 110.3915 54.6316 37.1305 175.7834 881 K 4.1591 7.9561 117.5380 57.8897 32.7692 176.3356 882 Y 4.7028 8.8585 118.5431 55.8895 40.4287 176.4075 883 S 4.1625 8.4820 118.2392 61.6308 63.0968 177.0235 884 H 3.8025 8.0812 117.8505 58.4630 29.8081 175.3224 885 Y 4.8833 7.7021 115.4960 57.8631 38.5079 177.7706 886 S 4.3750 8.0709 119.7350 61.4634 62.9893 176.6465 887 S 4.3969 8.0259 113.2512 59.8507 63.4592 173.8516 888 M 4.5095 7.8275 120.9556 54.1609 32.9547 175.7951 889 N 4.6148 8.6985 120.2934 54.9782 39.5028 175.2427 890 S 4.5760 7.5771 110.1958 56.9810 65.5594 173.8116 891 I 4.5067 7.9724 125.9832 60.5011 39.8724 172.8713 892 T 4.6697 8.4664 123.4213 62.5581 70.0485 173.6743 893 A 5.2724 8.9123 127.4475 48.8132 22.7958 175.1466 894 W 5.1321 8.7546 118.7128 56.3288 30.5471 176.0364 895 I 4.7406 8.2054 122.6957 59.0036 39.4083 175.6499 896 K 4.3402 8.6746 126.3263 57.1261 32.7613 175.9568 897 Q 4.5383 8.6066 122.3759 54.8501 30.4177 176.1776 898 T 4.3213 8.5916 111.8228 60.8477 71.2027 176.0526 899 S 4.0881 8.5229 117.2419 61.6590 63.0105 176.6214 900 S 4.1993 7.9096 117.1623 61.2328 62.9957 175.7558 901 E 3.8538 7.7678 123.2328 59.0096 29.2896 178.9919 902 Q 3.8324 8.1225 119.4618 59.3378 28.7438 179.0022 903 R 3.9133 7.6841 117.6547 59.3061 30.1383 178.4078 904 S 4.6171 7.9402 109.8466 58.0460 63.7149 173.9417 905 G 3.9027 8.1544 106.9040 47.2591 0.0000 173.6647 906 V 4.9756 7.2498 110.0364 60.5447 36.5457 174.2043 907 S 4.5440 8.9278 114.6149 57.8950 66.1941 173.8700 908 S 5.3668 8.1409 118.1199 57.5256 65.6237 172.8967 909 T 5.1109 8.8359 109.2816 60.3611 71.9868 172.0995 910 Y 5.0703 8.8277 123.7506 55.8701 42.4866 173.4037 911 N 5.0574 6.9893 120.8154 51.9068 40.6027 175.6653 912 L 3.9164 8.9517 126.3633 57.1026 42.3837 179.0412 913 I 4.0270 8.7181 119.3830 62.7317 38.2797 176.8397 914 T 4.0529 7.7426 108.1438 60.8935 69.5027 176.9600 915 Q 2.5200 7.4074 118.8690 56.1427 27.9675 171.2933 916 N 4.2568 7.6346 118.2199 52.4624 39.3682 172.3041 917 P 4.8441 0.0000 0.0000 62.9114 32.9325 175.9154 918 L 4.5059 8.6165 122.7843 53.6856 45.6008 173.5482 919 P 4.6565 0.0000 0.0000 62.2773 33.3336 177.4234 920 G 3.7950 8.0937 101.3456 46.3192 0.0000 171.4946 921 V 4.4449 8.3409 125.2956 61.0147 34.6260 174.2918 922 N 4.7642 8.8768 125.4264 53.7593 38.9881 175.7522 923 V 3.5057 8.4097 118.0406 63.9897 32.8762 177.6486 924 N 4.1813 7.7994 115.3244 53.4493 38.9622 175.2909 925 T 4.3442 7.9205 114.1817 62.3622 69.8077 173.1600 926 P 4.8914 0.0000 0.0000 62.0878 33.4970 174.9802 927 N 4.1541 8.6786 112.9103 54.3784 35.6082 174.1751 928 V 4.2908 7.2829 117.4728 61.1456 34.3045 173.6894 929 Y 4.9259 9.0046 126.0037 57.1012 39.7067 174.6605 930 A 4.6733 9.1124 126.7592 51.8717 19.4563 176.4739 931 V 4.5581 8.4403 122.8325 62.0739 33.1176 175.9832 932 C 4.5763 8.7519 126.8312 56.8302 41.3601 173.5210 933 V 4.1496 9.6976 125.4867 61.7006 30.5752 175.6669 934 E 4.2452 8.8594 125.8303 56.2122 29.0138 176.6212 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 752 F 8.32 3.98 0.00 2.91 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 0.00 753 F 7.46 4.89 0.00 3.13 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 0.00 754 D 8.40 4.99 0.00 2.67 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 0.00 755 E 8.56 4.68 0.00 1.99 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 2.28 2.30 0.00 756 L 8.35 4.15 0.00 1.49 1.71 0.55 0.33 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 0.00 757 K 8.89 4.54 0.00 1.77 1.53 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.37 7.81 758 I 8.26 4.56 1.81 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 1.13 0.98 0.67 0.00 0.00 759 D 8.64 4.34 0.00 2.67 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 0.00 760 N 9.15 4.30 0.00 2.71 2.86 0.00 0.00 7.17 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 0.00 761 K 8.36 4.37 0.00 1.76 1.70 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.59 1.32 7.81 762 V 9.18 4.46 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 1.30 0.00 0.00 0.99 0.00 0.00 763 D 8.50 4.95 0.00 2.82 2.57 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 0.00 764 I 8.04 4.23 1.73 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.90 0.79 0.00 0.00 765 I 8.49 3.71 1.78 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 1.52 0.81 0.78 0.00 0.00 766 G 8.83 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 0.00 767 N 7.59 4.81 0.00 2.73 2.79 0.00 0.00 6.07 8.04 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 0.00 768 N 8.03 4.12 0.00 2.83 2.87 0.00 0.00 6.58 8.97 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 0.00 769 V 7.52 4.25 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 0.88 0.00 0.00 0.85 0.00 0.00 770 R 8.06 4.78 0.00 1.83 1.81 0.00 3.04 0.00 0.00 2.47 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.44 0.00 771 G 7.43 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 0.00 0.00 0.00 0.00 772 E 8.67 4.62 0.00 1.96 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 0.00 2.40 2.28 0.00 773 L 8.36 3.73 0.00 1.46 1.61 -0.05 0.97 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 0.00 774 P 0.00 4.64 0.00 2.33 1.96 0.00 3.34 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.05 0.00 775 N 8.88 4.42 0.00 2.79 2.80 0.00 0.00 6.63 7.96 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 0.00 776 I 7.06 4.48 1.30 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.50 -0.45 0.00 0.00 777 W 8.13 4.80 0.00 3.20 2.62 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 0.00 778 L 6.90 4.39 0.00 1.36 0.50 0.70 0.34 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 0.00 779 Q 8.06 3.66 0.00 1.80 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 5.68 0.00 0.00 0.00 0.00 0.00 1.16 1.62 0.00 780 Y 8.47 4.11 0.00 3.05 2.87 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 0.00 781 G 7.60 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 0.00 0.00 0.00 782 Q 9.53 6.04 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.65 0.00 783 F 8.39 5.21 0.00 3.22 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 0.00 784 K 8.84 5.16 0.00 1.69 1.69 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.36 7.81 785 L 7.90 4.74 0.00 1.23 1.81 1.27 0.83 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 0.00 786 K 8.72 4.52 0.00 1.91 1.71 0.00 1.60 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.55 7.81 787 A 8.90 5.28 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 788 S 9.32 4.60 0.00 3.88 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 0.00 789 G 9.21 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 790 G 8.25 3.85 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 0.00 0.00 0.00 791 D 9.09 3.48 0.00 2.34 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 0.00 0.00 0.00 792 G 8.06 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 0.00 793 T 7.70 3.92 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 794 Y 7.89 5.10 0.00 2.45 2.36 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 0.00 795 S 8.60 4.98 0.00 3.92 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 0.00 796 W 8.77 5.45 0.00 3.17 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 0.00 797 Y 8.56 4.97 0.00 3.10 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 0.00 798 S 6.82 4.75 0.00 3.77 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 799 E 8.83 4.05 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.44 0.00 800 N 7.89 4.88 0.00 2.69 2.65 0.00 0.00 7.09 7.22 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 0.00 801 T 8.64 3.95 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 1.20 0.00 0.00 802 S 8.20 4.23 0.00 3.99 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 803 I 7.76 4.19 1.91 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 1.23 0.84 1.03 0.00 0.00 804 A 7.56 4.90 1.15 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 0.00 805 T 9.20 4.73 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 1.17 0.00 0.00 806 V 8.17 5.21 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 0.97 0.00 0.00 0.65 0.00 0.00 807 D 7.77 5.04 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 808 A 7.58 4.16 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 0.00 809 S 8.55 4.71 0.00 3.88 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 0.00 810 G 6.79 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 811 K 7.02 4.61 0.00 1.82 1.68 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.23 7.81 812 V 8.18 4.51 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 0.00 0.00 0.81 0.00 0.00 0.54 0.00 0.00 813 T 8.64 5.21 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 1.29 0.00 0.00 814 L 8.63 4.50 0.00 1.52 1.52 0.40 -0.18 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 0.00 815 N 9.36 5.22 0.00 2.76 2.91 0.00 0.00 6.80 6.77 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 0.00 816 G 7.85 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 0.00 817 K 8.41 4.34 0.00 1.69 1.72 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.16 1.21 7.81 818 G 7.81 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 0.00 0.00 0.00 819 S 8.71 5.57 0.00 3.76 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 0.00 820 V 8.78 4.55 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.94 0.00 0.00 821 V 8.38 4.72 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 1.13 0.00 0.00 0.96 0.00 0.00 822 I 8.75 4.89 2.05 0.00 0.00 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 1.44 0.76 1.25 0.00 0.00 823 K 8.96 5.04 0.00 1.97 1.81 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.51 7.81 824 A 8.86 4.60 0.72 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 0.00 0.00 825 T 8.05 5.02 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 0.00 826 S 8.76 4.94 0.00 3.98 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 0.00 827 G 8.52 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 0.00 828 D 8.11 4.67 0.00 3.00 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 0.00 829 K 7.66 3.87 0.00 1.87 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.39 7.81 830 Q 7.59 4.68 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.46 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.68 0.00 831 T 8.51 4.82 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 1.23 0.00 0.00 832 V 8.32 4.38 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 1.04 0.00 0.00 0.94 0.00 0.00 833 S 8.52 5.42 0.00 3.80 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 0.00 834 Y 8.91 5.12 0.00 2.98 2.87 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 0.00 835 T 8.60 4.62 4.19 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 0.00 0.00 0.00 1.22 0.00 0.00 836 I 8.64 4.10 1.89 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 1.01 0.79 0.72 0.00 0.00 837 K 8.56 4.48 0.00 1.71 1.78 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.46 7.81 838 A 10.14 4.57 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 839 P 0.00 4.57 0.00 1.42 0.49 0.00 2.70 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.00 840 S 7.45 4.14 0.00 3.96 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 0.00 841 Y 6.70 4.78 0.00 2.88 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 842 M 8.48 4.99 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.47 0.00 843 I 8.74 4.68 1.93 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 1.25 1.11 0.85 0.00 0.00 844 K 8.71 4.79 0.00 1.71 1.61 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.27 7.81 845 V 8.28 4.37 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 0.80 0.00 0.00 0.88 0.00 0.00 846 D 8.49 5.08 0.00 2.87 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 0.00 847 K 8.52 4.53 0.00 1.84 2.03 0.00 1.46 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.48 7.81 848 Q 8.23 4.67 0.00 1.73 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.92 0.00 0.00 0.00 0.00 0.00 1.22 1.31 0.00 849 A 8.30 4.23 1.15 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 0.00 850 Y 7.88 4.94 0.00 3.07 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 859 K 8.77 3.47 0.00 1.85 1.84 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.37 7.81 860 N 8.11 4.51 0.00 2.87 2.99 0.00 0.00 7.23 7.85 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 0.00 861 L 7.43 4.39 0.00 1.85 1.85 0.89 0.61 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 0.00 862 L 7.74 3.78 0.00 1.67 1.68 0.75 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 863 P 0.00 4.04 0.00 2.20 2.21 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.04 0.00 864 S 8.73 4.06 0.00 3.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 865 T 7.31 4.63 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 1.20 0.00 0.00 866 Q 8.75 3.81 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.84 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 867 T 7.90 4.13 4.23 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 1.22 0.00 0.00 868 V 7.49 3.60 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 0.56 0.00 0.00 0.85 0.00 0.00 869 L 8.06 4.07 0.00 1.46 1.84 1.06 0.71 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 0.00 870 S 7.32 4.32 0.00 4.11 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 0.00 871 D 8.11 4.48 0.00 3.00 2.87 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 0.00 872 I 7.36 3.90 2.21 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 1.69 1.42 1.08 0.00 0.00 873 Y 8.50 4.31 0.00 3.22 3.37 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 0.00 874 D 9.36 4.36 0.00 2.82 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 875 S 8.28 4.14 0.00 4.14 3.74 0.00 0.00 0.00 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0.57 0.00 0.00 892 T 8.47 4.67 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 1.04 0.00 0.00 893 A 8.91 5.27 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 894 W 8.75 5.13 0.00 3.32 3.33 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 0.00 895 I 8.21 4.74 1.99 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.57 0.96 0.00 0.00 896 K 8.67 4.34 0.00 1.82 1.92 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.51 7.81 897 Q 8.61 4.54 0.00 1.83 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 898 T 8.59 4.32 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 1.23 0.00 0.00 899 S 8.52 4.09 0.00 4.03 4.04 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 0.00 900 S 7.91 4.20 0.00 4.05 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 901 E 7.77 3.85 0.00 2.02 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 0.00 2.30 2.30 0.00 902 Q 8.12 3.83 0.00 2.11 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 903 R 7.68 3.91 0.00 2.05 1.98 0.00 3.19 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 904 S 7.94 4.62 0.00 3.97 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 0.00 905 G 8.15 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 0.00 906 V 7.25 4.98 2.21 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 0.69 0.00 0.00 0.90 0.00 0.00 907 S 8.93 4.54 0.00 3.12 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 908 S 8.14 5.37 0.00 4.15 4.01 0.00 0.00 0.00 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