NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 696 G 4.0397 8.1976 109.7376 44.9082 0.0000 174.4410 697 E 4.5445 7.9045 116.0059 56.1616 35.1074 174.1444 698 A 4.0606 7.8570 123.2364 51.0477 19.7912 176.3876 699 P 4.2161 0.0000 0.0000 62.7249 31.8341 176.0450 700 N 4.5434 8.6128 121.4578 53.0094 37.7728 173.5773 701 Q 4.4201 8.3536 122.9344 55.2780 29.1098 176.1844 702 A 3.9976 7.8199 120.7735 52.6754 18.7501 177.6249 703 L 4.4014 8.2304 120.8631 53.4113 42.8884 176.0568 704 L 4.3922 8.3585 125.4792 53.5675 43.4682 175.0377 705 R 4.5581 8.3291 126.1951 54.8502 32.0168 174.5537 706 I 4.7023 8.3993 127.5757 60.5298 38.1284 175.0288 707 L 4.8685 8.7803 127.8730 52.7168 43.6638 176.9021 708 K 4.1639 8.6359 122.3701 56.0169 32.7371 178.1174 709 E 3.2376 8.7916 124.2067 58.8443 29.6471 177.9460 710 T 4.0481 7.4821 106.1115 61.8884 69.4521 175.0107 711 E 4.3497 8.2158 122.8910 57.6479 30.1069 175.8521 712 F 5.7059 6.8931 113.0971 54.7955 41.2781 174.1776 713 K 4.7007 8.8496 120.1655 55.1186 34.9408 175.6781 714 K 4.5502 8.6685 122.5327 56.7831 32.6761 175.8520 715 I 4.3615 9.2340 122.5426 62.6156 39.0995 175.3139 716 K 4.8281 7.9950 121.8689 55.7398 33.8136 177.5105 717 V 4.3102 8.4616 123.7785 62.8045 34.1145 176.9956 718 L 3.4818 7.4267 120.2555 55.6211 42.7231 178.3691 719 G 4.0280 8.3490 124.3741 47.6215 0.0000 171.7935 720 S 5.2480 8.7730 117.5738 58.7338 65.5070 176.2556 721 G 3.7083 6.6732 113.7263 43.8221 0.0000 176.9372 722 A 4.3619 8.1862 122.6137 49.6966 15.5612 177.3023 723 F 5.8040 7.7456 128.3898 56.4992 37.7010 175.3062 724 G 4.5336 5.3800 111.1067 45.5458 0.0000 172.7335 725 T 4.8868 8.1615 120.9426 61.6469 72.8509 172.2676 726 V 4.7986 7.9957 125.3984 61.7129 32.9901 174.6086 727 Y 4.8055 9.3652 125.4191 56.0729 41.4293 174.6245 728 K 4.7718 8.5689 122.9804 56.1386 34.3563 175.9473 729 G 4.2626 8.2530 111.7310 46.0473 0.0000 171.4085 730 L 5.3763 8.8176 119.1622 52.6160 45.5804 175.8862 731 W 5.2818 9.2771 133.8015 56.3400 32.2718 174.8791 732 I 4.6890 8.9580 129.8690 57.2812 36.4575 173.7384 733 P 4.0636 0.0000 0.0000 63.7316 33.3031 179.0872 734 E 3.6549 7.9828 118.7483 56.9780 31.3506 178.6311 735 G 4.1611 8.6088 114.0717 45.1015 0.0000 171.9366 736 E 4.3066 8.2011 117.4964 55.6610 30.9420 178.0451 737 K 3.8142 8.1162 116.5731 57.1161 29.0537 175.4790 738 V 4.7357 6.9445 108.5571 59.4743 35.9263 174.9047 739 K 4.8681 8.4099 121.1786 54.7868 36.0662 175.2866 740 I 4.8632 8.3702 125.9731 57.8490 39.8174 173.4573 741 P 4.8306 0.0000 0.0000 62.8748 32.4253 176.0781 742 V 5.0706 9.0599 116.6601 59.5513 36.8116 174.0868 743 A 5.0590 9.1004 123.7980 50.3703 21.5413 175.4053 744 I 4.5346 8.6255 124.2789 59.6929 39.3077 174.6785 745 K 5.0146 8.8790 130.0865 54.6724 34.0573 174.8382 746 E 5.1600 8.7694 125.3648 54.6935 32.1008 177.4002 747 L 3.8295 8.1971 122.2322 58.7360 41.6144 177.1538 748 R 4.0602 9.4573 118.8243 55.6233 29.2081 174.0470 749 E 4.1153 8.3976 113.0783 55.3678 25.7085 178.6914 750 A 3.6821 7.4631 135.0000 53.0197 15.8399 177.4281 751 T 4.3206 8.2153 119.7442 63.0422 68.3503 174.9252 752 S 4.5705 8.4056 122.2899 56.6269 64.3955 173.8408 753 P 4.2405 0.0000 0.0000 65.2145 30.7797 178.3724 754 K 3.9223 7.9607 117.3308 59.7100 32.4913 177.9787 755 A 4.0646 8.3120 121.4583 55.2127 18.3296 178.9103 756 N 4.1648 8.2185 113.2707 56.5816 38.4283 177.2693 757 K 4.0199 7.8174 119.5162 58.5859 32.0795 177.9726 758 E 4.3207 8.2037 118.4688 58.4531 30.4726 178.0125 759 I 3.7797 7.6204 117.9287 63.8098 37.9888 177.7715 760 L 4.0493 7.8410 119.7584 57.5757 41.4147 178.9463 761 D 4.3770 7.6950 117.6707 57.2937 40.7789 178.3812 762 E 3.9519 8.6346 119.9840 59.3239 29.7558 178.6821 763 A 3.9911 8.2260 120.8817 55.1591 18.1619 178.8367 764 Y 3.9128 8.0709 117.5214 60.9024 39.1927 178.4425 765 V 3.4480 8.0563 119.2971 66.2069 31.4920 177.7450 766 M 3.6244 8.2063 116.3337 57.9866 32.0638 177.4853 767 A 4.1211 7.5278 119.7102 53.8140 18.7199 177.9990 768 S 4.4718 7.2729 112.0565 58.1545 63.0041 174.2187 769 V 4.5316 7.2521 113.1275 59.6576 34.1955 175.3668 770 D 4.3546 9.0474 123.4265 53.2565 42.5753 173.7674 771 N 4.5283 7.8178 123.1695 51.3104 41.6632 173.6014 772 P 4.3071 0.0000 0.0000 65.0025 31.7332 176.7838 773 H 4.9952 8.5123 115.1835 55.0639 29.4347 172.8870 774 V 4.9482 7.4010 118.2185 60.9381 34.3696 175.1158 775 C 4.2983 8.9180 125.4355 59.8743 28.9514 173.3344 776 R 4.0776 8.1588 124.4052 55.6935 30.8115 175.0613 777 L 4.4686 8.3487 129.1619 54.0213 42.7218 175.9938 778 L 4.0422 8.8322 127.6735 56.2911 42.3044 177.4404 779 G 3.9213 6.8276 104.5501 46.3102 0.0000 171.2079 780 I 4.9809 7.7144 112.8725 59.0308 40.9176 174.1494 781 C 5.1202 8.9685 124.3321 57.0609 33.7163 174.6220 782 L 4.6414 8.1587 130.0746 54.0012 40.4373 175.4825 783 T 4.3689 7.3369 109.4251 60.2746 71.0484 175.4473 784 S 4.1579 8.7007 117.2300 61.8553 62.6923 175.0634 785 T 4.3622 7.6608 114.4809 60.6711 68.0322 174.1145 786 V 3.9918 8.5131 129.6696 63.2244 33.0481 174.3064 787 Q 5.1395 8.9222 126.7425 53.9848 31.5840 174.3705 788 L 4.4723 8.7848 126.7870 54.5501 43.5757 175.1999 789 I 4.7762 8.7348 127.9439 59.7052 39.7104 174.9328 790 T 5.0654 8.6079 116.3148 59.2367 73.0240 172.8085 791 Q 4.2248 8.3678 123.4620 55.9924 29.5209 175.6098 792 L 3.8946 8.3145 128.8093 55.9660 42.8103 177.1797 793 M 4.4357 8.5474 127.4375 52.8472 31.0173 174.6036 794 P 4.1361 0.0000 0.0000 65.1877 31.8652 177.4489 795 F 4.4506 8.1357 114.5174 56.7956 39.0861 177.5865 796 G 3.9241 8.0492 112.2967 45.3737 0.0000 173.3139 797 C 4.7159 8.1717 113.3940 57.4739 32.2374 174.1352 798 L 3.6990 8.4896 124.0656 57.9409 41.5089 178.7811 799 L 3.9605 7.7037 120.0096 58.7403 41.9781 178.8959 800 D 4.4455 8.1202 117.8998 57.5767 40.6039 178.0956 801 Y 4.2313 8.0045 120.0114 60.6402 38.7816 178.3651 802 V 3.9351 8.5191 114.0390 64.3530 31.4722 178.4280 803 R 4.0051 7.6631 116.7389 59.6041 30.1664 178.5818 804 E 4.1465 8.5948 117.0824 58.3636 29.8384 176.7032 805 H 4.7441 7.3554 113.5180 56.2898 30.7856 176.7758 806 K 4.4449 8.2912 121.8244 59.3835 33.0397 176.7500 807 D 4.6420 7.7497 114.6784 55.0065 40.6472 176.4722 808 N 4.9020 8.6475 114.4030 52.5116 40.8154 174.0836 809 I 4.1704 7.7154 121.0466 60.1543 37.9680 175.9459 810 G 3.9512 7.9908 114.6686 43.9276 0.0000 174.0952 811 S 4.0634 8.7267 115.5292 61.7650 62.5971 176.5882 812 Q 3.9307 8.1652 122.4336 59.2976 28.6023 178.3569 813 Y 3.5548 7.8331 117.3321 60.7774 37.8443 178.0049 814 L 3.8416 7.4581 119.3050 57.9648 41.6749 179.5920 815 L 4.1225 8.0639 118.7913 57.6582 41.5317 179.2208 816 N 4.2976 7.9922 116.5526 56.0148 38.3619 177.2869 817 W 4.4801 8.2505 120.6345 60.1488 29.1640 178.2794 818 C 3.9150 8.0348 116.4427 62.6937 27.3995 176.3111 819 V 3.6240 8.0084 120.0081 66.1473 31.0500 177.9692 820 Q 3.7291 8.4172 118.0189 58.9764 28.4891 178.8855 821 I 3.6746 8.0620 120.6870 64.5224 37.1995 178.0482 822 A 3.8473 8.3062 121.4519 55.3657 18.0637 179.9431 823 K 4.0289 8.2946 116.9200 59.4073 32.1303 179.6060 824 G 3.7765 8.2148 106.2255 48.3432 0.0000 175.6105 825 M 3.7650 7.9802 121.6155 57.8034 31.7751 178.3658 826 N 4.1916 8.1909 117.5872 56.6750 39.0073 176.3381 827 Y 3.9384 8.1778 120.9994 60.6585 38.9203 177.5575 828 L 3.9054 8.4114 120.4146 58.0959 41.7693 179.2562 829 E 3.6409 8.6950 119.2829 59.2484 29.2781 178.5163 830 D 4.3287 7.6150 118.0861 57.2238 40.8760 178.0795 831 R 4.1136 7.1882 115.7323 54.9576 31.1185 176.7572 832 R 3.9359 7.7663 116.9963 57.6416 28.2375 175.7975 833 L 4.8737 8.1796 117.4386 53.0697 44.9745 175.3077 834 V 4.4735 8.2662 125.7319 61.2517 32.5523 175.6680 835 H 4.0738 9.8062 129.2173 57.9474 29.8348 176.8315 836 R 4.1560 8.3320 113.3850 57.0816 28.7817 175.7567 837 D 4.7697 8.0447 116.7845 52.9517 41.4794 175.1540 838 L 3.9292 8.1826 120.0742 54.7616 43.1077 175.2095 839 A 4.7754 8.2482 125.1526 52.0440 21.9446 176.7225 840 A 4.0512 9.2973 123.5439 55.0042 18.6219 180.7248 841 R 3.9975 7.9788 111.5571 58.7644 29.8824 176.6542 842 N 4.8693 8.0813 115.9923 53.0758 39.8676 174.6422 843 V 4.5855 7.6538 118.5602 61.1604 34.5403 174.3861 844 L 4.8365 8.9597 127.8003 53.1636 45.1765 175.6090 845 V 4.2572 8.3786 121.3102 61.3358 32.5071 176.4398 846 K 4.1434 8.8400 128.8667 58.9868 33.3499 177.0580 847 T 4.5914 7.2727 107.3568 58.6015 71.8501 172.5789 848 P 3.5575 0.0000 0.0000 65.0897 31.3134 177.4165 849 Q 3.9973 7.3442 112.8115 56.0492 29.1046 174.8355 850 H 4.9708 8.9015 119.9263 55.1090 32.4666 172.3698 851 V 4.7987 9.1366 119.4431 59.7142 34.2514 175.8580 852 K 4.8594 8.6536 121.1066 54.6925 36.6690 176.1404 853 I 4.1127 8.7880 125.4101 62.0218 38.4209 175.4151 854 T 4.5262 7.9508 119.0981 62.1959 70.6993 171.3792 855 D 4.1000 8.6170 120.6339 54.9481 38.6634 173.3138 856 F 4.6842 8.0494 124.6793 56.9655 39.6701 176.8093 857 G 4.2509 7.5210 107.5929 45.6153 0.0000 175.3559 858 L 4.4549 7.7042 117.2944 54.4275 47.8242 176.2827 859 A 4.3885 7.9164 120.0807 52.6825 18.9809 177.0609 860 K 4.3859 8.7055 120.4300 54.2722 35.8998 175.1353 861 L 4.6651 8.4229 126.8085 54.0424 43.2357 175.8517 862 L 4.1773 8.4255 127.0068 54.2918 41.9841 177.8467 863 G 3.8167 8.8083 114.5813 45.0373 0.0000 170.8382 864 A 4.0345 8.8673 121.7531 53.9224 18.5874 179.5337 865 E 3.6375 8.0588 121.2830 58.3370 25.8214 175.1449 866 E 4.5397 7.9145 123.1181 55.3900 31.6690 176.6253 867 K 4.4694 8.6631 117.8503 57.2188 34.2588 176.5191 868 E 5.0464 7.9605 113.6995 54.5253 32.9640 174.5008 869 Y 4.5747 8.8469 122.3354 56.5848 40.9135 174.5797 870 H 4.9303 8.2573 124.6553 54.2508 27.8093 174.7706 871 A 3.7828 8.1337 123.8177 51.5527 19.3001 178.3220 872 E 4.3146 8.3886 120.1928 56.0036 31.5058 176.1656 873 G 3.8084 8.2998 110.7966 46.4255 0.0000 173.6405 874 G 4.0399 8.7710 105.3564 45.3866 0.0000 173.5716 875 K 3.9574 8.3596 120.3431 56.7817 32.5868 176.7457 876 V 4.4206 7.9817 121.6646 60.3410 34.7215 172.9676 877 P 4.5790 0.0000 0.0000 62.1263 31.2115 176.9358 878 I 3.7563 8.5289 125.9341 64.3523 37.2095 178.2953 879 K 4.1831 8.3737 116.2499 57.2773 31.8550 177.1189 880 W 4.7522 8.5507 118.4791 56.4929 30.4166 174.8056 881 M 4.5195 7.7923 118.3259 53.1343 33.4207 176.5025 882 A 2.0000 7.8773 123.8815 51.5131 20.4234 178.7748 883 L 3.4629 6.7648 122.3750 58.2448 42.1763 179.2152 884 E 3.7892 7.9850 117.8745 59.4271 29.2848 179.6700 885 S 3.9158 7.2704 115.9948 60.6154 62.8065 176.3173 886 I 3.5784 6.9679 120.6401 64.3264 37.0134 178.0243 887 L 4.3700 7.6738 116.7169 56.1632 41.6552 177.2690 888 H 4.7756 7.8860 112.8109 54.5044 32.0176 173.5883 889 R 4.3755 7.9081 117.7885 56.9193 28.2684 175.3297 890 I 4.6170 6.9512 117.4703 60.9040 38.8271 174.8412 891 Y 4.8780 8.8214 123.5291 56.5555 41.4605 174.6732 892 T 5.0686 8.9576 117.6301 59.7551 71.6985 174.1151 893 H 4.4236 8.9715 119.8089 59.3718 28.6280 178.0219 894 Q 4.1138 8.5644 119.9281 58.6419 28.4273 178.7034 895 S 4.3963 8.0614 114.9017 61.1447 62.9974 176.2394 896 D 4.6860 8.2833 123.0188 57.0404 40.4876 178.5804 897 V 3.3930 7.8767 118.5201 65.7267 31.5772 177.2932 898 W 5.0371 8.0706 128.9406 60.5858 30.5472 178.1970 899 S 4.8963 8.5414 115.6425 61.1144 62.1811 176.0670 900 Y 4.3331 8.7720 123.0373 60.7025 38.5849 178.1550 901 G 3.5812 8.6773 107.0216 48.0560 0.0000 175.7069 902 V 3.9484 8.3369 120.9474 65.9068 31.4327 177.9907 903 T 4.2613 8.7560 115.9277 66.9916 68.3647 176.5859 904 V 3.4508 8.3050 120.2762 65.7345 31.3531 177.8456 905 W 4.1577 8.6253 128.1579 60.5232 30.4683 177.8240 906 E 4.1974 9.2310 119.0997 59.3394 28.9646 179.3655 907 L 3.9721 8.0309 119.1233 58.1259 41.5399 179.4485 908 M 3.8953 7.9087 117.3286 57.2073 31.8060 177.7569 909 T 4.2476 6.7279 108.6423 60.3065 69.6533 174.2612 910 F 3.6932 8.2798 117.4597 59.0808 37.2042 175.9392 911 G 4.0582 8.2810 104.8857 45.9800 0.0000 174.9792 912 S 4.4564 7.7667 115.0481 57.8974 63.5917 173.9774 913 K 4.6369 8.4562 121.5146 54.1301 32.8665 175.2671 914 P 3.4524 0.0000 0.0000 63.7102 31.4490 175.6897 915 Y 3.3934 7.1562 118.2546 59.6058 35.3686 171.9362 916 D 4.2695 8.4601 120.3755 57.6257 41.4151 177.8884 917 G 3.7278 7.8956 106.4947 47.6061 0.0000 173.2785 918 I 3.5373 7.2365 119.8914 60.2388 37.8182 174.1420 919 P 4.5929 0.0000 0.0000 61.6016 32.7803 176.7458 920 A 3.8952 8.6998 121.9664 55.7700 17.7626 180.4102 921 S 4.1783 7.9254 112.4616 61.7076 63.2454 176.0635 922 E 4.1049 8.5286 121.4680 58.8583 29.1261 178.7715 923 I 3.3611 7.1811 118.8012 64.6652 36.9294 177.7897 924 S 3.9607 7.9659 113.5615 62.1490 62.6671 176.2572 925 S 4.1466 8.2243 116.3174 60.7795 62.2041 175.8100 926 I 3.6083 7.6645 121.8138 64.8415 36.9259 178.0432 927 L 4.4736 8.1654 120.5137 56.5354 41.2275 178.9218 928 E 4.0556 8.5174 119.3486 58.6940 29.7421 178.1924 929 K 3.9806 8.0829 117.4596 57.9892 32.0679 177.6764 930 G 3.9348 7.7071 106.1364 45.2239 0.0000 172.8433 931 E 4.4449 7.6742 119.1366 55.2048 30.8109 176.0271 932 R 4.4068 7.9282 122.1618 55.0673 33.5899 174.6630 933 L 4.0126 7.5480 118.2103 53.7541 42.5179 175.0265 934 P 4.4977 0.0000 0.0000 62.4203 31.9836 175.9182 935 Q 3.2768 8.0626 121.0819 54.8025 29.1339 174.2417 936 P 4.2395 0.0000 0.0000 62.1267 32.1261 175.5678 937 P 4.1314 0.0000 0.0000 65.8476 31.4696 177.6227 938 I 4.0792 7.7262 108.8006 61.7029 37.7291 174.7256 939 C 4.8155 7.9186 120.7762 58.2075 28.6177 173.8348 940 T 4.0656 8.2430 115.5211 61.3865 69.1969 175.0145 941 I 3.7786 8.4914 122.2067 64.4228 37.5919 177.6069 942 D 4.3447 8.2054 118.4819 57.5097 41.0342 178.6428 943 V 3.5629 7.7878 117.6839 66.2342 31.6796 177.0304 944 Y 4.2149 8.1222 119.1640 61.1522 38.6220 177.6852 945 M 3.8032 8.6189 119.2139 58.7579 32.1249 178.4328 946 I 3.5437 7.5182 119.8058 64.4658 37.0697 177.7405 947 M 3.2109 7.6913 117.6300 58.2649 31.8973 178.1618 948 V 3.4620 6.8101 117.6362 66.2316 31.5753 178.2766 949 K 3.7894 7.5836 117.6296 59.6471 31.9323 178.8981 950 C 4.1800 7.6063 116.1255 61.1447 27.5794 174.9488 951 W 3.7848 7.1892 120.1499 56.0276 29.1140 175.6333 952 M 4.3800 7.7388 118.5906 54.8471 32.1981 176.4895 953 I 3.9319 8.8183 124.8287 64.7568 37.4219 176.7425 954 D 4.4755 8.0784 124.0351 53.4844 39.3148 175.6750 955 A 3.6973 8.7022 130.2433 55.3608 18.4538 179.1086 956 D 4.5856 8.1565 112.9898 56.1829 41.2835 177.5679 957 S 4.3198 8.7307 116.1955 60.5753 63.2221 175.0873 958 R 4.2475 7.3414 117.9250 55.1999 30.3653 174.4129 959 P 4.6390 0.0000 0.0000 61.8933 32.5566 175.8824 960 K 4.1166 9.0158 119.7494 55.6658 32.9953 178.3018 961 F 3.9326 8.5560 122.3732 61.0723 38.6161 178.4019 962 R 3.9769 8.1161 114.6436 58.8571 29.1836 178.5897 963 E 4.0293 9.1665 120.7224 58.8821 29.7057 178.3614 964 L 4.0633 7.9237 118.6288 58.1829 41.6674 179.3311 965 I 3.7798 7.9915 119.3730 64.6855 37.0463 178.3744 966 I 3.6995 7.4535 120.0308 64.4820 36.9697 178.4331 967 E 3.8089 8.7410 119.4198 59.6171 29.2786 179.6089 968 F 4.0774 8.3875 117.6989 60.3840 38.6609 177.7890 969 S 4.1599 8.0669 112.4491 60.9836 62.4009 175.8956 970 K 4.0648 8.2283 121.5090 59.9565 31.8847 179.2357 971 M 3.7705 7.8301 118.4280 57.9648 31.5567 178.1466 972 A 4.2851 8.0667 119.3281 53.7231 18.6833 178.8526 973 R 4.2697 7.7008 115.3896 57.0098 32.0212 176.5629 974 D 4.8339 8.0788 118.2354 52.2770 41.9870 173.7294 975 P 4.5160 0.0000 0.0000 65.4879 32.0746 178.6163 976 Q 4.4110 7.8843 114.5039 56.8430 29.0562 176.6076 977 R 3.8487 7.8358 117.8705 57.8828 30.5393 176.1113 978 Y 5.0120 7.6316 112.7075 56.5548 41.3333 175.0956 979 L 5.1346 8.0897 118.7551 52.8332 44.5155 176.6738 980 V 4.1772 9.0449 125.1612 61.3971 32.8285 174.0708 981 I 4.5592 7.9017 128.5363 58.7612 39.3458 174.8845 982 Q 3.9553 8.6527 126.7515 59.8688 28.7142 174.4749 983 G 4.0111 9.8007 116.3894 46.9385 0.0000 173.0242 984 D 3.9675 7.6248 118.1230 53.1869 38.4233 175.8295 *1007 M 4.2669 8.3837 123.5914 55.1565 33.2691 175.7383 1008 D 4.1583 8.6012 120.0278 56.6928 41.2096 177.4216 1009 D 4.7961 7.8446 116.5485 53.7528 41.2492 175.7917 1010 V 4.1064 7.0420 120.0027 63.3477 31.7781 175.6794 1011 V 4.5499 8.4774 126.1788 61.1646 35.3637 173.7824 1012 D 4.6473 8.7635 125.9835 53.6142 42.2552 176.6605 1013 A 4.1498 9.0210 127.0800 55.7515 18.4259 179.6120 1014 D 4.5014 8.2813 114.0120 56.5873 40.9039 176.9491 1015 E 4.4163 8.3512 117.2370 55.9548 29.9752 175.0308 1016 Y 4.6052 7.8546 121.2181 55.8580 39.0245 174.5782 1017 L 4.4948 7.7797 128.9491 53.3033 45.0322 177.6831 *1018 I 3.9715 8.2628 118.3904 60.2362 36.1087 174.8980 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 696 G 8.20 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 0.00 0.00 0.00 697 E 7.90 4.54 0.00 2.13 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 2.19 2.37 0.00 698 A 7.86 4.06 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 0.00 699 P 0.00 4.22 0.00 2.19 2.08 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 700 N 8.61 4.54 0.00 2.71 2.84 0.00 0.00 7.10 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 8.35 4.42 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 702 A 7.82 4.00 1.17 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 0.00 703 L 8.23 4.40 0.00 1.63 1.61 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 704 L 8.36 4.39 0.00 1.56 1.55 0.88 0.93 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 0.00 705 R 8.33 4.56 0.00 1.91 1.73 0.00 3.42 0.00 0.00 3.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 706 I 8.40 4.70 1.90 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 1.36 0.97 0.93 0.00 0.00 707 L 8.78 4.87 0.00 1.58 1.76 -0.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 708 K 8.64 4.16 0.00 1.90 1.72 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.43 7.81 709 E 8.79 3.24 0.00 1.89 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 2.10 2.05 0.00 710 T 7.48 4.05 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 1.12 0.00 0.00 711 E 8.22 4.35 0.00 2.55 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 2.42 2.35 0.00 712 F 6.89 5.71 0.00 3.27 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 0.00 713 K 8.85 4.70 0.00 1.86 1.96 0.00 1.32 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.43 7.81 714 K 8.67 4.55 0.00 1.60 1.69 0.00 0.91 0.00 0.00 0.68 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.36 7.81 715 I 9.23 4.36 1.92 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 1.28 0.93 0.94 0.00 0.00 716 K 8.00 4.83 0.00 1.73 1.65 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.40 7.81 717 V 8.46 4.31 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 0.67 0.00 0.00 0.79 0.00 0.00 718 L 7.43 3.48 0.00 1.87 1.08 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 719 G 8.35 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 0.00 0.00 0.00 720 S 8.77 5.25 0.00 3.77 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 721 G 6.67 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 0.00 722 A 8.19 4.36 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 0.00 723 F 7.75 5.80 0.00 3.19 3.25 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 0.00 724 G 5.38 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 725 T 8.16 4.89 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 726 V 8.00 4.80 2.06 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 0.72 0.00 0.00 0.83 0.00 0.00 727 Y 9.37 4.81 0.00 2.95 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 0.00 728 K 8.57 4.77 0.00 1.86 1.70 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.46 7.81 729 G 8.25 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 0.00 0.00 0.00 0.00 730 L 8.82 5.38 0.00 1.61 1.57 0.94 1.00 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 0.00 731 W 9.28 5.28 0.00 3.29 3.08 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 0.00 732 I 8.96 4.69 1.84 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 1.19 1.34 0.88 0.00 0.00 733 P 0.00 4.06 0.00 1.94 1.59 0.00 3.13 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.44 0.00 734 E 7.98 3.65 0.00 1.99 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 2.50 2.29 0.00 735 G 8.61 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 0.00 0.00 0.00 0.00 736 E 8.20 4.31 0.00 1.88 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 0.00 2.27 2.25 0.00 737 K 8.12 3.81 0.00 1.88 1.90 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.42 7.81 738 V 6.94 4.74 1.83 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 0.84 0.00 0.00 0.45 0.00 0.00 739 K 8.41 4.87 0.00 1.56 1.61 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.32 7.81 740 I 8.37 4.86 1.98 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.98 1.07 0.00 0.00 741 P 0.00 4.83 0.00 2.08 1.99 0.00 3.58 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 742 V 9.06 5.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.96 0.00 0.00 743 A 9.10 5.06 1.16 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 0.00 0.00 0.00 744 I 8.63 4.53 1.97 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 0.67 0.77 0.89 0.00 0.00 745 K 8.88 5.01 0.00 1.74 1.62 0.00 1.44 0.00 0.00 1.63 0.00 0.00 2.61 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.37 1.23 7.81 746 E 8.77 5.16 0.00 2.16 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 0.00 2.50 2.40 0.00 747 L 8.20 3.83 0.00 1.64 1.81 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 748 R 9.46 4.06 0.00 1.92 2.31 0.00 3.20 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 749 E 8.40 4.12 0.00 2.06 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 750 A 7.46 3.68 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 0.00 751 T 8.22 4.32 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 1.27 0.00 0.00 752 S 8.41 4.57 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 753 P 0.00 4.24 0.00 2.18 2.17 0.00 3.60 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 754 K 7.96 3.92 0.00 1.73 1.84 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.57 7.81 755 A 8.31 4.06 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 0.00 756 N 8.22 4.16 0.00 2.78 2.92 0.00 0.00 6.56 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 757 K 7.82 4.02 0.00 1.99 2.04 0.00 1.47 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.52 7.81 758 E 8.20 4.32 0.00 2.21 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 2.25 2.51 0.00 759 I 7.62 3.78 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 1.64 1.57 0.97 0.00 0.00 760 L 7.84 4.05 0.00 1.86 1.70 0.96 1.19 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 0.00 761 D 7.69 4.38 0.00 2.89 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 0.00 762 E 8.63 3.95 0.00 2.23 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 2.41 2.47 0.00 763 A 8.23 3.99 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 764 Y 8.07 3.91 0.00 2.99 3.18 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 0.00 765 V 8.06 3.45 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 1.07 0.00 0.00 766 M 8.21 3.62 0.00 1.89 2.18 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 767 A 7.53 4.12 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 0.00 768 S 7.27 4.47 0.00 3.61 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 0.00 769 V 7.25 4.53 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 0.64 0.00 0.00 0.71 0.00 0.00 770 D 9.05 4.35 0.00 2.48 2.52 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 0.00 771 N 7.82 4.53 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 4.31 0.00 1.76 1.96 0.00 3.50 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.01 0.00 773 H 8.51 5.00 0.00 3.24 3.23 0.00 5.56 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 774 V 7.40 4.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.01 0.00 0.00 775 C 8.92 4.30 0.00 3.02 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 776 R 8.16 4.08 0.00 1.93 1.80 0.00 3.06 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 777 L 8.35 4.47 0.00 1.55 1.62 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 778 L 8.83 4.04 0.00 1.33 1.23 0.91 1.35 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 0.00 779 G 6.83 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 0.00 0.00 0.00 780 I 7.71 4.98 1.85 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 1.07 1.00 0.87 0.00 0.00 781 C 8.97 5.12 0.00 3.16 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 0.00 782 L 8.16 4.64 0.00 1.69 1.64 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 783 T 7.34 4.37 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 0.00 784 S 8.70 4.16 0.00 3.89 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 785 T 7.66 4.36 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 1.29 0.00 0.00 786 V 8.51 3.99 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 0.92 0.00 0.00 0.94 0.00 0.00 787 Q 8.92 5.14 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 788 L 8.78 4.47 0.00 1.73 1.47 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 789 I 8.73 4.78 1.49 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.02 0.43 0.00 0.00 790 T 8.61 5.07 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 1.15 0.00 0.00 791 Q 8.37 4.22 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 1.66 1.52 0.00 833 L 8.18 4.87 0.00 1.65 1.63 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 834 V 8.27 4.47 2.06 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 1.10 0.00 0.00 0.90 0.00 0.00 835 H 9.81 4.07 0.00 3.26 3.42 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 836 R 8.33 4.16 0.00 1.90 1.86 0.00 2.77 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 837 D 8.04 4.77 0.00 2.54 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 838 L 8.18 3.93 0.00 1.64 1.73 0.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 839 A 8.25 4.78 0.69 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 0.00 0.00 840 A 9.30 4.05 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 850 H 8.90 4.97 0.00 3.12 3.11 0.00 5.57 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 V 9.14 4.80 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 0.11 0.00 0.00 0.93 0.00 0.00 852 K 8.65 4.86 0.00 1.59 1.60 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.48 1.29 7.81 853 I 8.79 4.11 1.99 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 1.07 0.58 0.78 0.00 0.00 854 T 7.95 4.53 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 1.11 0.00 0.00 855 D 8.62 4.10 0.00 2.71 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 4.68 0.00 3.07 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 0.00 857 G 7.52 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 957 S 8.73 4.32 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 958 R 7.34 4.25 0.00 1.82 1.82 0.00 3.28 0.00 0.00 3.61 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.63 0.00 959 P 0.00 4.64 0.00 2.04 1.95 0.00 3.36 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.98 0.00 960 K 9.02 4.12 0.00 1.98 1.74 0.00 1.58 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 961 F 8.56 3.93 0.00 3.04 3.15 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 0.00 962 R 8.12 3.98 0.00 2.05 2.36 0.00 2.97 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 963 E 9.17 4.03 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 964 L 7.92 4.06 0.00 1.79 1.78 0.41 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 965 I 7.99 3.78 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.87 0.95 0.00 0.00 966 I 7.45 3.70 2.01 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 1.53 0.80 0.89 0.00 0.00 967 E 8.74 3.81 0.00 1.75 1.70 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 2.42 2.36 0.00 968 F 8.39 4.08 0.00 3.21 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 969 S 8.07 4.16 0.00 3.92 4.20 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 0.00 970 K 8.23 4.06 0.00 1.91 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.56 7.81 971 M 7.83 3.77 0.00 1.82 1.94 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.81 0.00 972 A 8.07 4.29 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 0.00 973 R 7.70 4.27 0.00 1.96 2.03 0.00 3.16 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 974 D 8.08 4.83 0.00 2.74 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 0.00 975 P 0.00 4.52 0.00 2.24 2.17 0.00 3.66 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 2.22 2.30 0.00 976 Q 7.88 4.41 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.10 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 977 R 7.84 3.85 0.00 1.60 1.21 0.00 3.02 0.00 0.00 3.05 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.22 0.00 978 Y 7.63 5.01 0.00 3.05 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 0.00 979 L 8.09 5.13 0.00 1.54 1.58 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 980 V 9.04 4.18 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 0.95 0.00 0.00 0.91 0.00 0.00 981 I 7.90 4.56 2.07 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 1.49 1.09 0.97 0.00 0.00 982 Q 8.65 3.96 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.26 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 983 G 9.80 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 984 D 7.62 3.97 0.00 2.87 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 *1007 M 8.38 4.27 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 1008 D 8.60 4.16 0.00 2.68 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 1009 D 7.84 4.80 0.00 2.68 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1010 V 7.04 4.11 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 0.74 0.00 0.00 0.96 0.00 0.00 1011 V 8.48 4.55 2.04 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 0.93 0.00 0.00 0.97 0.00 0.00 1012 D 8.76 4.65 0.00 2.87 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 1013 A 9.02 4.15 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 1014 D 8.28 4.50 0.00 2.74 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 1015 E 8.35 4.42 0.00 2.06 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 2.28 2.28 0.00 1016 Y 7.85 4.61 0.00 2.92 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1017 L 7.78 4.49 0.00 1.50 1.41 0.88 0.84 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 *1018 I 8.26 3.97 1.87 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 1.27 0.49 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.