NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 665 N 4.7098 8.3829 117.7869 52.3816 39.5337 175.5808 *666 F 4.4423 8.7491 117.8813 57.6494 39.0958 174.8377 667 E 4.6348 7.8403 119.8222 57.8009 31.0155 177.4904 668 Q 4.1903 8.4308 121.6631 56.8226 29.5011 179.8194 669 S 4.8603 7.7841 112.9691 57.2401 62.3445 177.3214 670 L 4.7660 7.3952 124.2191 53.5407 43.4009 177.8958 671 K 4.1125 9.3720 130.4245 57.8360 32.4543 176.1709 672 N 4.6840 9.0298 117.6088 54.8309 38.1992 178.0592 673 L 4.7850 7.8488 117.3547 53.5724 43.5956 176.9705 674 V 4.1469 8.5591 121.7179 61.2759 33.7498 174.1279 675 V 4.4477 8.0963 128.5174 61.5365 32.5905 175.8609 676 S 4.6058 8.7639 125.9842 57.9874 64.5085 174.5383 677 E 4.2660 8.7116 114.5766 57.5322 30.1741 173.8225 678 K 4.2226 7.8926 120.2081 57.1380 33.3255 175.7461 679 I 4.3549 8.2156 128.3941 59.9036 37.6358 175.6012 680 L 4.0649 8.8180 129.1250 57.0544 42.2810 177.6157 681 G 3.8339 7.0332 103.4030 46.1354 0.0000 171.9693 682 Y 5.0260 8.6576 117.9143 56.5708 40.2909 175.5301 683 G 4.2237 9.1421 110.6646 45.5322 0.0000 172.7272 684 S 4.2186 8.5679 116.0699 59.2625 63.0458 169.7244 685 S 3.6647 8.8680 119.0079 59.1008 58.5294 170.9966 686 G 4.1834 7.8832 101.0666 46.7611 0.0000 172.1140 687 T 4.6522 7.2906 117.2046 61.8417 69.6054 174.1179 688 V 4.3734 8.4002 126.3975 60.8358 34.7365 174.0974 689 V 4.6346 8.4465 127.2796 61.3183 33.4121 174.7280 690 F 5.2060 9.2371 126.8354 55.7387 42.0461 175.0315 691 Q 4.4170 8.9245 122.0239 56.7088 30.4433 175.7465 692 G 4.5766 8.4798 109.0885 46.5236 0.0000 172.1094 693 S 5.1953 8.5601 113.6108 57.0168 67.4761 173.6344 694 F 5.0098 9.1690 122.6816 57.0794 40.5573 174.7302 695 Q 3.4908 9.7176 129.0531 56.8421 26.3467 174.0641 696 G 4.1725 8.4824 107.3586 45.9600 0.0000 175.4854 697 R 3.8121 7.4358 119.2427 55.5866 30.3873 174.1051 698 P 4.8603 0.0000 0.0000 62.6028 32.0905 176.2626 699 V 4.7495 8.7786 116.9410 59.4520 36.6046 174.5464 700 A 4.8074 8.7646 125.9600 51.3635 19.8794 176.5574 701 V 4.4822 8.8154 123.8786 62.0641 33.4986 174.7071 702 K 4.7704 9.3744 130.4399 54.9838 33.5732 174.6814 703 R 4.5332 9.0140 129.8864 55.4779 31.4560 175.1588 704 M 4.9974 8.5322 125.2115 53.0539 36.3744 175.3093 705 L 4.4302 8.7603 122.8147 55.2029 42.2468 179.2811 706 I 3.7551 8.3359 123.4342 63.6749 35.6244 177.2511 707 D 4.4298 8.0075 117.5417 56.2170 39.7106 179.7266 708 F 4.7683 8.2206 120.0501 58.7452 39.4252 178.5832 709 C 4.2271 7.9659 125.1982 63.6769 27.7525 177.8849 710 D 4.6523 8.1865 124.6170 59.3726 39.7710 182.4197 711 I 4.0922 7.9435 121.0591 64.2320 35.4207 179.6533 712 A 4.4283 7.7315 122.4114 55.8656 18.8370 180.1791 713 L 4.1664 7.7927 123.3934 60.5345 40.7028 181.8826 714 M 4.3542 7.7385 118.8027 59.3601 31.2337 181.4315 715 E 4.2784 7.6514 118.1752 59.5783 29.7854 179.0303 716 I 3.2153 8.2204 122.7072 64.6642 36.9063 179.1559 717 K 3.9208 7.9241 124.5477 59.8600 31.3710 180.9557 718 L 4.2603 7.6606 120.1143 57.1863 41.5592 179.5762 719 L 3.4603 7.8496 119.1534 57.9491 41.3152 179.2553 720 T 3.8675 7.6713 114.6345 67.0574 68.5041 175.7317 721 E 4.0747 7.7575 119.4527 58.6588 30.0578 178.0374 722 S 4.7664 7.6449 114.3104 59.2798 64.1565 175.8810 723 D 4.5041 8.4830 121.4057 55.9334 38.9261 177.1254 724 D 4.3819 8.1104 119.1405 57.2348 41.5552 176.1701 725 H 4.3312 7.9912 118.8018 55.0379 30.3131 174.2197 726 P 4.3831 0.0000 0.0000 65.0827 31.6900 176.5331 727 N 5.5750 8.0243 115.2760 52.3087 39.8227 173.9752 728 V 4.7268 7.4510 119.4812 60.6443 33.3083 175.4742 729 I 3.8320 8.7645 128.5260 61.8174 38.8800 174.6039 730 R 4.4192 8.4472 127.3664 54.8968 31.9320 174.0046 731 Y 4.5750 8.0315 126.5300 57.2015 39.4794 173.4404 732 Y 4.4252 7.7127 123.1171 58.2900 39.2909 175.6734 733 C 4.1871 6.6395 110.4830 57.7137 32.9147 171.6932 734 S 5.4068 8.5384 114.3057 56.9743 66.1859 173.4560 735 E 4.8156 9.0384 121.5038 55.1846 33.4333 173.8311 736 T 5.2410 8.6918 122.2505 62.1286 69.8135 173.9565 737 T 4.6255 8.6404 116.5044 59.5345 71.1338 175.2976 738 D 4.4953 8.7703 123.0337 56.4728 39.8559 178.0932 739 R 4.1555 7.6960 119.8474 58.0297 31.3736 180.9153 740 F 5.3016 8.6221 116.8926 55.2942 44.1427 174.1734 741 L 4.6465 9.0546 120.9573 53.8713 44.5540 174.5624 742 Y 5.0354 9.2694 125.2258 57.0532 40.1557 175.0866 743 I 4.7733 8.7466 123.4950 59.4272 40.7010 174.5817 744 A 4.6464 9.1053 130.5771 51.6694 19.8223 176.2021 745 L 5.4387 9.0322 121.2191 52.3070 47.0681 175.4470 746 E 4.5467 8.7951 121.6122 56.8918 29.9652 176.1724 747 L 4.2505 8.8084 129.4160 54.6938 42.3634 175.8893 748 C 4.5868 8.3492 123.8322 58.3705 30.1349 173.5674 749 N 4.5269 8.4895 117.9006 55.8955 38.7032 175.5240 750 L 4.3048 7.5413 115.7492 53.7432 43.5304 173.5759 751 N 4.9895 8.3192 117.9810 51.8415 39.9059 175.9500 752 L 3.9775 8.8599 122.5305 58.2496 41.9475 178.7529 753 Q 4.2910 8.0263 120.4861 58.6381 28.8016 177.8284 754 D 4.3257 8.7877 119.1831 57.3104 40.9974 178.0835 755 L 3.9528 7.5304 119.1559 58.4380 42.1635 178.9822 756 V 3.7139 8.0780 117.1896 64.5983 32.8263 176.9437 757 E 4.5133 7.9539 119.5109 53.3055 27.4868 176.9655 758 S 4.5850 8.2259 126.5409 58.2773 62.4201 177.4416 *772 Y 4.4934 8.4491 126.0501 58.5320 38.1754 170.8762 773 N 4.4240 7.9319 121.0734 51.1109 39.7575 173.8542 774 P 3.9215 0.0000 0.0000 65.9292 31.2941 178.4767 775 I 3.6814 7.5461 119.0193 63.7589 36.8939 178.1323 776 S 4.0620 7.8391 114.3311 61.4276 62.2167 175.9646 777 L 3.9579 7.9076 121.0703 57.8925 41.3333 179.4029 778 L 3.4670 7.5579 118.0390 57.6227 41.5040 179.4139 779 R 3.1940 8.1254 118.5630 59.4006 29.9671 178.3662 780 Q 3.9651 8.2708 117.9251 59.1095 28.7769 178.9235 781 I 3.7209 7.9637 120.5314 64.3553 37.1672 178.2149 782 A 4.0148 8.2292 121.4035 55.3915 18.1387 179.3035 783 S 4.1355 8.4620 112.1316 61.7325 62.3088 176.8849 784 G 3.5204 8.2411 108.0409 47.7312 0.0000 175.9131 785 V 3.4927 7.8619 120.8625 65.5744 31.5758 177.6183 786 A 3.9270 8.2994 120.9415 55.6225 18.1202 179.0963 787 H 4.0263 7.8486 116.3207 59.4211 29.9660 177.4199 788 L 4.0657 7.8890 120.7230 58.3870 41.5222 179.4078 789 H 4.4598 8.6953 116.6247 58.6955 28.3641 178.0118 790 S 4.2729 8.0274 115.4420 60.5910 62.8634 175.4591 791 L 4.4459 7.3194 120.2056 53.3767 41.8784 176.2855 792 K 3.9077 8.0625 117.6203 57.7440 30.0321 175.0329 793 I 4.7573 8.2150 119.7639 59.6337 38.9155 175.4519 794 I 4.5190 8.4472 127.1854 59.9507 38.5526 176.4053 795 H 3.7598 9.4240 125.6239 58.9019 29.8000 177.5517 796 R 4.0599 9.2450 114.5944 56.6422 28.6904 176.4126 797 D 4.7210 7.4898 117.6577 52.7523 41.4917 175.0580 798 L 4.0471 8.0925 118.6027 53.9890 42.5009 176.7318 799 K 3.6417 7.8260 120.8119 54.7933 35.3075 174.6511 800 P 4.0156 0.0000 0.0000 65.4007 31.1669 178.6885 801 Q 4.1478 7.6146 115.2550 57.5756 29.1799 175.9856 802 N 4.8346 7.9332 114.3885 52.7948 40.4025 174.1310 803 I 4.7068 7.3737 120.1746 59.7204 39.3490 175.1434 804 L 4.8388 8.9652 127.9210 53.3433 44.5827 175.9660 805 V 4.8186 8.9526 119.8172 61.3018 35.2308 174.0324 806 S 5.0385 8.8387 122.0481 56.8132 64.8175 174.4031 807 T 4.4556 9.8750 117.5217 62.1657 69.6866 175.7547 808 S 4.3383 7.4991 116.4826 58.6264 64.3434 174.8205 809 S 4.1791 8.7092 121.3754 61.6687 62.5215 176.5963 810 R 3.8370 8.1281 120.3961 58.9537 29.7434 178.1209 811 F 4.4531 8.2133 115.7606 59.7362 39.7761 177.4427 812 T 4.3989 7.9498 106.4805 62.5995 69.3954 175.8500 813 A 4.0815 7.9152 124.6769 54.8171 18.6694 177.5011 814 D 4.6293 7.9027 114.9862 54.2638 41.8706 175.6993 815 Q 5.0586 8.6657 123.5956 54.5036 30.4966 176.4862 816 Q 4.0761 8.1528 121.4126 59.8837 28.9038 178.0990 817 T 4.4156 7.7485 110.3179 59.7952 68.8683 176.9035 818 G 3.8841 8.1385 110.8188 46.2880 0.0000 173.1106 819 A 4.3632 8.3280 125.7032 51.7421 17.8878 176.5883 820 E 4.7313 8.4038 121.1698 55.2772 32.5478 176.4609 821 N 4.4999 9.1152 121.6462 55.8326 38.9834 175.2664 822 L 4.7924 7.6398 115.5296 53.0158 44.4784 176.1491 823 R 4.7076 8.3499 121.0355 54.7011 33.2737 174.1147 824 I 4.5412 9.1818 128.2678 60.6357 38.9406 174.7952 825 L 5.1642 8.8714 126.9476 52.9625 44.8669 175.5394 826 I 4.6162 8.7636 125.7850 60.6940 38.6945 175.3496 827 S 4.8568 8.2700 121.0450 57.7915 66.5373 171.4610 828 D 4.3919 9.1439 120.7748 54.9357 37.9139 173.2240 829 F 4.5882 8.4391 125.5661 56.6804 40.0416 178.9445 830 G 3.5697 7.9686 112.2015 48.5832 0.0000 176.0791 831 L 4.1330 7.6336 118.0719 56.0198 42.2363 176.8547 832 C 4.0856 6.8367 115.6887 60.2230 28.8518 173.6712 833 K 4.4377 8.8993 123.2286 54.4081 35.0733 174.7815 834 K 4.7792 8.5450 128.4718 55.5324 33.1928 176.2759 835 L 4.4113 8.8027 129.8389 54.8325 42.7003 176.9852 836 D 4.6140 8.5397 119.8757 52.7417 40.6678 177.0605 837 S 4.3080 8.8482 111.4876 62.6680 62.5621 175.2558 838 G 4.3288 7.7923 107.5985 44.7571 0.0000 171.1395 839 Q 4.1879 7.3046 124.3384 53.8275 30.2586 176.6451 *842 F 4.6477 8.5756 113.7970 59.0579 39.3010 176.1102 843 R 4.3385 8.4502 123.4830 56.3793 27.6748 177.6741 *852 T 4.5854 7.7266 115.0793 60.5934 71.0213 177.4663 853 S 4.9415 7.8998 116.0796 58.0490 63.4051 175.8378 854 G 3.5252 8.2965 111.4205 47.2901 0.0000 175.3117 855 W 4.8123 8.1935 118.2835 56.4593 29.6312 175.5520 856 R 4.5839 7.8154 116.6021 54.4215 31.5499 176.3530 857 A 2.6283 8.0090 123.5303 50.4899 19.3012 176.9387 858 P 4.0622 0.0000 0.0000 65.9056 30.8902 178.6976 859 E 3.5394 7.7324 115.6914 58.6891 29.6206 178.3895 860 L 4.1559 7.4408 118.5580 56.4338 41.8643 178.3972 861 L 4.3027 7.5594 120.1101 56.3747 42.7466 177.8671 862 E 3.9563 8.3327 116.7584 56.6074 30.1223 179.2174 863 E 4.2287 8.5267 119.2792 54.6415 30.5317 175.2822 864 S 4.2340 8.5114 117.4082 57.9785 63.6337 173.1042 865 N 4.8511 8.4475 123.1174 52.1125 40.5824 174.3393 866 N 4.5163 8.6868 122.4512 56.4208 39.0925 177.3234 867 L 4.3843 7.9433 113.5486 55.0691 41.1119 176.9669 868 Q 4.2170 7.6144 120.6455 54.9334 30.0738 176.1296 *893 T 4.2170 8.2952 118.2815 58.6856 70.5520 172.8740 894 K 4.7275 7.9685 126.3481 55.2445 35.4611 177.8383 895 R 4.1905 8.4385 125.0366 55.2738 30.2020 174.7024 896 R 4.1221 8.2020 121.3249 56.9755 30.4992 176.2186 897 L 4.3190 7.4977 118.0309 54.2343 44.0636 176.0597 898 T 4.4112 7.8051 114.9481 59.6071 71.7989 175.4049 899 R 3.8494 8.7035 119.4769 59.6525 29.6408 178.9322 900 S 4.1120 7.7315 112.4043 61.3021 62.7130 176.2765 901 I 3.6379 7.6663 122.4462 64.5840 37.6150 177.4513 902 D 4.6370 8.3863 120.8916 56.8122 40.6451 178.8071 903 I 3.7851 7.6163 120.5676 64.0205 37.0396 178.1729 904 F 4.3687 8.4773 122.6879 60.9037 38.8692 177.1967 905 S 4.3590 7.9813 112.6037 61.7236 62.6651 176.0530 906 M 4.1129 8.7455 122.3114 58.3054 31.4387 178.3147 907 G 3.3475 8.2182 106.1814 47.9277 0.0000 175.4986 908 C 4.1999 8.0142 118.8312 62.7116 28.2054 176.2764 909 V 3.8401 8.2682 119.9377 65.9326 31.0008 177.9964 910 F 4.2663 8.8698 118.0075 60.9665 38.8250 177.0199 911 Y 4.1311 8.0116 118.0723 60.8312 38.2685 177.1432 912 Y 4.9513 8.5762 122.0514 60.2739 38.9017 178.4395 913 I 3.6917 8.1909 120.6140 64.5767 37.2788 178.5834 914 L 3.9563 8.0435 119.8456 57.2474 41.6164 179.0357 915 S 4.4155 8.1842 113.5058 57.8120 63.6652 174.4201 916 K 3.5959 7.9201 121.3238 55.5164 28.9013 180.6466 917 G 3.4352 7.2635 112.2758 46.1544 0.0000 175.2638 918 K 4.3614 7.9104 119.6409 56.3551 33.0783 175.1846 919 H 5.3759 8.5925 120.0346 53.6709 32.1882 173.4481 920 P 3.9712 0.0000 0.0000 64.7149 31.2093 177.7981 921 F 4.4650 8.2278 113.5700 56.9921 39.6490 174.4509 922 G 3.8335 7.8526 108.0553 44.4986 0.0000 174.1055 923 D 4.5241 8.9307 119.4312 53.7083 40.2945 174.1887 924 K 3.9267 8.5674 121.9747 58.0107 32.1078 179.0554 925 Y 4.4094 7.8687 115.4013 61.6180 37.8260 177.4259 926 S 4.6152 7.8596 111.5022 58.9818 62.9177 175.7753 927 R 4.1631 7.7718 123.4652 59.8044 29.9392 178.0765 928 E 3.8759 8.0097 118.5664 59.0755 29.6296 178.6213 929 S 4.1010 7.9702 112.8573 61.5387 62.6587 175.7495 930 N 4.5021 7.9543 118.5043 56.2300 37.8184 177.6039 931 I 3.1359 7.7765 121.3569 64.2165 36.9397 178.4173 932 I 3.7157 7.1292 119.3013 64.6149 37.0683 178.5285 933 R 4.1271 8.0984 117.2054 56.6263 30.4237 176.4995 934 G 3.9015 7.8491 105.5850 46.9628 0.0000 174.1799 935 I 4.4471 8.6089 121.0893 59.2200 38.7745 176.0394 936 F 4.7953 7.7708 120.9720 54.8496 41.5535 174.0852 937 S 4.4832 8.8092 113.2978 56.0787 65.8338 174.3646 938 L 4.1828 8.2811 127.5200 54.4474 42.2316 176.9346 939 D 4.6705 7.6911 117.9791 55.3285 42.0591 177.1340 940 E 4.7933 8.3627 119.6929 55.9581 29.9763 177.1671 941 M 4.5853 7.7268 118.8977 54.1240 31.0435 176.9489 942 K 4.0188 8.0856 121.5067 59.8031 32.9812 178.4390 943 C 3.8493 7.5661 114.8330 62.8545 28.0985 174.8891 944 L 4.1063 7.6160 118.1784 55.0844 41.6375 176.7768 945 H 4.4051 8.7137 120.6062 57.5145 29.4716 175.6749 946 D 4.4402 7.9256 119.2882 54.0517 41.7954 176.8985 947 R 3.9599 8.6137 127.3639 58.9739 30.1760 179.0395 948 S 4.4951 8.0198 115.2727 61.0263 62.8701 176.5253 949 L 4.0999 7.9360 122.3292 57.4987 41.2866 179.4434 950 I 3.6296 7.4381 119.0036 64.2189 36.9856 178.2817 951 A 4.0219 7.9941 121.5744 55.1986 18.2442 179.5388 952 E 3.8385 8.2734 116.7150 59.6803 29.6347 179.6082 953 A 3.9554 8.6640 121.0596 55.1539 18.3059 179.9192 954 T 3.8318 8.1772 114.8074 66.7492 68.3539 176.1219 955 D 4.3554 7.8604 119.5878 57.3497 41.2456 178.1760 956 L 3.8429 7.7422 120.4185 58.2094 42.0917 178.9669 957 I 3.6289 7.7712 119.8823 64.4256 36.8818 178.7139 958 S 3.9721 7.9278 113.5655 61.1506 63.0867 176.4463 959 Q 4.1228 7.7833 121.8137 59.3085 28.4124 178.3343 960 M 4.0087 7.9586 119.8261 57.9182 32.1124 177.9442 961 I 4.1969 7.6012 110.1801 60.2491 37.8696 175.2352 962 D 4.6108 7.6830 120.0343 54.9579 41.4636 176.1579 963 H 4.2724 9.0707 124.7269 58.3578 30.2963 174.5016 964 D 4.7291 8.9246 120.5745 51.9421 41.6373 175.1437 965 P 4.3083 0.0000 0.0000 65.5327 31.5954 178.5806 966 L 4.0936 7.6963 117.2633 56.9472 41.7123 178.2912 967 K 4.2063 7.6651 116.9540 57.9807 32.4059 177.6169 968 R 4.2961 7.3936 119.3919 54.9604 30.4120 174.9543 969 P 4.4816 0.0000 0.0000 62.5755 32.2339 176.6558 970 T 4.2543 8.2417 110.1113 61.1491 70.5993 175.3217 971 A 3.9896 8.5404 123.0322 55.6463 18.0355 179.6935 972 M 4.0281 7.9869 116.1776 58.6271 32.2441 178.1708 973 K 4.0413 7.8762 118.5786 59.3840 32.6165 178.5733 974 V 3.8845 7.9216 118.7204 66.1615 31.2753 178.1110 975 L 3.9124 7.5363 116.6726 57.5304 41.5033 179.0832 976 R 4.3643 7.6427 116.0442 56.8979 30.8351 176.5262 977 H 3.9531 7.9891 120.1631 55.2076 30.6965 174.2763 978 P 2.0000 0.0000 0.0000 64.1290 31.0583 177.9787 979 L 3.7701 7.6055 120.4457 58.0383 41.7392 177.6147 980 F 4.6794 7.5122 114.2308 57.9827 39.3409 176.1485 981 W 4.5513 7.5856 121.1561 55.7542 29.7100 174.8716 982 P 4.6394 0.0000 0.0000 62.3299 33.1444 177.6827 983 K 3.6098 8.4461 117.6420 59.1105 31.8970 179.8389 984 S 4.0942 7.9305 114.5624 61.2392 62.9420 176.3419 985 K 4.0046 7.9196 122.8356 59.0672 32.0064 178.8567 986 K 4.2861 7.9781 118.5825 59.3266 31.8882 179.0260 987 L 4.0979 7.9966 120.8548 58.3102 42.0928 178.3838 988 E 3.7443 8.1937 119.1601 59.2885 29.4551 178.4095 989 F 3.0639 8.3393 120.6569 61.2575 39.3832 177.2227 990 L 3.8451 8.0240 118.3440 57.5104 41.3625 179.5844 991 L 3.7952 7.9662 119.1763 57.7160 41.6821 179.6383 992 K 3.8324 8.1275 118.7963 59.4157 31.9863 179.5916 993 V 3.3420 7.4491 118.5181 65.7357 31.3041 178.0531 994 S 3.8445 7.7852 112.8892 61.5479 62.2068 176.0071 995 D 4.4061 7.9203 121.2763 56.9121 39.9901 178.8069 996 R 3.9374 7.6492 119.4620 59.2540 29.7251 178.1395 997 L 4.0434 7.6524 117.3506 56.4803 41.3577 178.7977 998 E 3.7135 7.3898 116.9633 58.7974 29.4620 178.1007 999 I 3.9046 7.2117 118.9197 63.7355 37.5291 176.7993 1000 E 4.0440 7.3171 118.7411 56.0929 30.1428 176.1362 1001 N 4.4531 8.7562 123.4102 54.2520 39.7268 176.3755 1002 R 4.1212 8.7014 126.1208 58.8185 30.2993 174.5595 1003 D 4.4389 8.0061 115.9580 55.1261 39.8665 176.7504 1004 P 4.8074 0.0000 0.0000 59.6428 32.3923 173.5917 1005 P 4.4508 0.0000 0.0000 62.6782 31.8547 176.3501 1006 S 4.3723 8.4448 115.5286 57.5137 63.9503 174.8865 1007 A 4.0060 8.6593 122.5847 55.3732 18.2053 179.4340 1008 L 4.1140 7.8519 118.0051 58.4424 42.2951 178.9455 1009 L 4.1326 7.6939 118.8094 58.2577 41.5526 179.5004 1010 M 4.1421 8.0866 118.2121 58.3071 31.6076 178.9663 1011 K 4.0054 7.7153 117.5596 59.3050 32.4574 179.1980 1012 F 4.0912 8.2124 117.6856 60.5422 39.0500 176.9361 1013 D 4.4384 8.6858 117.9040 57.5560 40.7221 178.3223 1014 A 4.2053 8.1006 120.3805 54.7432 18.5608 179.0023 1015 G 3.8457 8.0584 102.4110 45.8373 0.0000 175.8354 1016 S 4.2678 8.0528 118.5483 61.5810 62.9438 175.9448 1017 D 4.4570 8.2979 121.1955 57.5686 40.3807 178.6970 1018 F 4.3401 8.2131 119.0237 61.4034 39.6038 176.8054 1019 V 3.8532 7.6273 116.6979 64.2060 32.9135 176.1040 1020 I 4.7751 8.3579 119.9518 58.6766 36.9888 174.1602 1021 P 4.5292 0.0000 0.0000 64.5481 31.8659 178.4434 1022 S 4.1381 8.1357 112.0147 59.3107 63.3794 175.3345 1023 G 3.9065 9.4280 108.9680 45.6569 0.0000 172.8190 1024 D 4.8283 7.8766 119.3869 51.8102 41.9306 175.4905 1025 W 4.8505 8.8462 125.2441 58.6423 28.4654 178.1956 1026 T 3.9090 7.5826 119.6552 67.6449 67.6457 176.7447 1027 V 3.6930 7.3976 118.8182 66.1628 31.6031 179.7841 1028 K 4.1028 7.7648 115.7213 56.8415 32.1280 176.8193 1029 F 4.6277 7.3425 119.7935 55.6576 41.7870 176.2091 1030 D 4.7623 8.5423 126.5193 55.5565 41.6456 179.1706 1031 K 4.3504 8.6186 124.2759 61.1037 31.9001 180.5827 1032 T 4.1671 7.9595 110.8615 64.3167 67.7741 176.1402 1033 F 4.1975 8.5668 125.6243 62.2363 39.3116 177.4429 1034 M 4.4155 8.1610 120.6491 59.9661 31.1060 180.5102 1035 D 4.6061 7.7916 120.5953 58.3442 39.3923 180.9005 1036 N 4.7594 7.8608 118.5742 55.9436 37.6454 178.3515 1037 L 3.9552 7.2238 127.4420 59.9427 40.8740 182.5671 1038 E 4.5086 8.2526 120.3477 60.6315 29.7350 181.2539 1039 R 4.3700 7.3674 121.5755 62.9700 29.4093 183.6525 *1040 Y 4.2706 7.5010 115.4007 58.8418 37.2951 178.7857 1041 R 4.7384 7.8826 121.0743 54.3269 33.1842 175.5082 1042 K 4.3299 8.2002 119.5665 54.2008 32.3915 172.5798 1043 Y 5.0470 8.0592 118.5933 54.8790 39.7554 174.7094 1044 H 4.4123 9.0277 123.5574 55.4921 29.3035 176.9701 1045 S 3.8150 8.8100 119.5283 59.4459 63.4020 175.5558 1046 S 4.9049 7.8941 113.7699 58.2812 64.2096 175.2749 1047 K 4.3751 7.8779 120.1894 55.9552 33.7833 177.7946 1048 L 4.1007 8.7651 126.9798 58.6057 42.0695 179.8630 1049 M 3.8779 8.0820 120.2781 59.9767 31.1446 182.0154 1050 D 4.6634 8.0553 119.4772 56.4939 41.2914 178.4227 1051 L 2.4400 7.0114 119.7875 57.4210 41.9021 178.8966 1052 L 3.7350 7.5002 120.1411 58.0647 41.9355 178.9219 1053 R 3.9101 8.2627 119.8133 58.5872 30.0904 178.1395 1054 A 4.1038 8.5180 121.0712 55.3150 18.2608 179.3085 1055 L 3.6086 7.7861 118.6442 58.0770 41.9032 179.2700 1056 R 3.9413 7.8113 118.4243 59.5927 30.0389 178.1510 1057 N 4.4475 8.5489 116.6230 56.5040 38.3444 177.5307 1058 K 4.1432 8.0482 118.5000 59.5345 32.3869 178.6416 1059 Y 3.8273 8.1010 119.9930 61.1321 38.5951 177.6588 1060 H 4.1894 8.6508 115.9383 58.2062 29.0045 176.4771 1061 H 4.9629 8.3792 117.3569 55.5494 29.4619 176.9491 1062 F 4.1552 7.9839 126.3628 61.3714 39.5019 177.0269 1063 M 4.0851 8.0862 119.3255 58.4122 32.1839 176.7676 1064 D 4.4985 7.8465 117.4710 56.0972 41.3472 176.9799 1065 L 4.0517 7.0332 118.6701 53.7393 42.3490 175.8892 1066 P 4.4103 0.0000 0.0000 62.8110 33.2420 178.0182 1067 E 3.9427 8.8554 121.4279 61.7655 29.4285 179.2084 1068 D 4.6346 8.0101 119.4649 56.0386 39.5935 178.5800 1069 I 3.7926 7.6719 120.7278 63.8927 37.0674 177.7704 1070 A 3.6554 7.6934 120.7969 54.9354 18.3663 178.7316 1071 E 4.1096 8.1139 117.7622 59.8643 29.4765 179.3503 1072 L 4.2278 7.5036 116.9610 57.3946 41.5334 177.7085 1073 M 4.1463 8.5717 118.9854 55.7519 33.1629 178.0094 1074 G 4.1510 7.9827 110.5422 44.0175 0.0000 172.0120 1075 P 4.7357 0.0000 0.0000 61.9536 32.9229 176.4682 1076 V 3.9889 8.3599 114.3988 63.1338 31.2677 177.0576 1077 P 3.4214 0.0000 0.0000 64.3239 35.2105 177.2798 1078 D 4.5911 8.1732 116.7103 56.7304 41.2290 179.1375 1079 G 3.7449 8.1648 105.2715 47.9085 0.0000 175.0593 1080 F 4.4333 8.5761 124.9650 60.5780 39.4073 176.5361 1081 Y 4.3320 9.0287 119.4896 61.1333 38.6431 177.8241 1082 D 4.6207 8.8037 121.5531 56.9190 39.5196 178.0080 1083 Y 3.8584 8.4545 120.4050 60.6187 38.7026 178.1694 1084 F 4.5134 7.9950 118.1218 60.1452 38.9451 178.1584 1085 T 4.2309 8.1152 111.6830 64.7433 68.3786 177.7326 1086 K 3.9025 7.8474 126.4287 59.8899 31.8123 183.5893 1087 R 3.9346 6.9081 115.8030 57.2673 31.0805 177.1293 1088 F 4.7420 7.9598 117.3184 54.3888 40.0764 173.0667 1089 P 4.4194 0.0000 0.0000 64.9503 31.6925 178.4335 1090 N 4.8050 7.9973 114.3237 53.3067 38.7910 176.4474 1091 L 3.9707 8.0945 122.0393 58.2097 42.0942 178.8215 1092 L 4.1533 7.9123 119.5623 58.4252 42.2360 178.6905 1093 I 3.8345 7.9458 118.2534 63.7612 38.0858 177.9303 1094 G 3.8067 8.4492 106.9350 47.9931 0.0000 175.9642 1095 V 3.7989 8.1645 121.2854 65.5440 31.4629 177.4264 1096 Y 4.3098 8.6591 119.7721 61.1004 38.5776 177.8598 1097 M 3.9121 8.3943 119.7551 58.6583 32.0585 178.9227 1098 I 3.4771 7.4925 119.3148 64.1849 37.0661 178.7809 1099 V 3.5883 8.0957 119.5577 65.8419 31.2420 178.0452 1100 K 3.9414 8.4989 120.9681 59.1685 31.9271 178.9192 1101 E 4.2182 7.6243 117.7418 60.5610 30.1993 182.5117 1102 N 5.0319 8.0639 115.0703 52.8079 39.9027 175.4966 1103 L 4.9068 8.0213 120.9035 54.3031 42.6386 177.8896 1104 S 4.5059 8.3513 115.2660 60.2418 63.9406 173.8633 1105 D 4.7500 7.9378 121.0446 53.1948 39.2631 176.9903 1106 D 4.7793 7.7837 120.3773 53.8107 41.6786 176.2452 1107 Q 4.0534 8.7183 125.9591 59.2353 28.9357 179.7883 1108 I 3.9910 7.9927 118.0648 64.4730 37.5150 178.3913 1109 L 4.5748 8.0055 119.2580 57.0688 41.4645 179.2521 1110 R 4.2347 9.2935 119.7798 59.5948 29.8384 178.5715 1111 E 4.1085 7.9006 118.1697 58.9079 29.1932 179.5850 1112 F 3.9072 8.1991 116.2578 60.3616 39.2058 177.4170 1113 L 4.3606 8.2556 117.6603 57.2694 41.5138 177.6779 1114 Y 4.9657 8.2002 112.7129 57.3349 39.1543 175.8796 1115 S 4.2412 8.0341 120.2835 58.9323 63.0997 174.3367 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 665 N 8.38 4.71 0.00 2.67 2.66 0.00 0.00 6.90 7.23 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 *666 F 8.75 4.44 0.00 2.38 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 0.00 0.00 0.00 0.00 667 E 7.84 4.63 0.00 1.80 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 1.91 2.11 0.00 668 Q 8.43 4.19 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.45 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 669 S 7.78 4.86 0.00 3.59 3.69 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 0.00 670 L 7.40 4.77 0.00 1.50 1.54 0.31 0.65 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 0.00 671 K 9.37 4.11 0.00 1.72 1.63 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.25 7.81 672 N 9.03 4.68 0.00 2.74 2.75 0.00 0.00 7.20 7.30 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 0.00 673 L 7.85 4.78 0.00 1.39 1.53 0.90 0.80 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 0.00 674 V 8.56 4.15 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 0.90 0.00 0.00 0.89 0.00 0.00 675 V 8.10 4.45 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 0.51 0.00 0.00 0.66 0.00 0.00 676 S 8.76 4.61 0.00 3.92 3.88 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 0.00 677 E 8.71 4.27 0.00 2.01 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 2.21 1.86 0.00 678 K 7.89 4.22 0.00 1.84 1.77 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.44 7.81 679 I 8.22 4.35 1.66 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.80 0.08 0.00 0.00 680 L 8.82 4.06 0.00 1.51 1.65 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 681 G 7.03 3.83 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 0.00 0.00 0.00 682 Y 8.66 5.03 0.00 2.82 2.86 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 0.00 683 G 9.14 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 684 S 8.57 4.22 0.00 3.64 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 685 S 8.87 3.66 0.00 3.46 3.54 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 0.00 686 G 7.88 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 687 T 7.29 4.65 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 1.18 0.00 0.00 688 V 8.40 4.37 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 1.01 0.00 0.00 689 V 8.45 4.63 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 1.02 0.00 0.00 0.86 0.00 0.00 690 F 9.24 5.21 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 691 Q 8.92 4.42 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 692 G 8.48 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 693 S 8.56 5.20 0.00 3.91 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 0.00 694 F 9.17 5.01 0.00 2.80 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 0.00 695 Q 9.72 3.49 0.00 1.49 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.30 0.00 0.00 0.00 0.00 0.00 1.90 1.19 0.00 696 G 8.48 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 697 R 7.44 3.81 0.00 1.83 1.64 0.00 3.04 0.00 0.00 2.93 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.43 0.00 698 P 0.00 4.86 0.00 1.95 1.99 0.00 3.59 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 699 V 8.78 4.75 2.25 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 0.58 0.00 0.00 0.95 0.00 0.00 700 A 8.76 4.81 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 701 V 8.82 4.48 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.99 0.00 0.00 702 K 9.37 4.77 0.00 1.86 1.86 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.36 7.81 703 R 9.01 4.53 0.00 1.99 1.94 0.00 2.21 0.00 0.00 2.84 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.50 0.00 704 M 8.53 5.00 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 705 L 8.76 4.43 0.00 2.04 1.61 1.15 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 706 I 8.34 3.76 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 1.16 0.72 0.91 0.00 0.00 707 D 8.01 4.43 0.00 2.69 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 0.00 708 F 8.22 4.77 0.00 3.25 3.02 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 0.00 709 C 7.97 4.23 0.00 2.88 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 0.00 710 D 8.19 4.65 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 0.00 711 I 7.94 4.09 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 1.57 0.54 0.91 0.00 0.00 712 A 7.73 4.43 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 0.00 713 L 7.79 4.17 0.00 1.61 1.70 0.92 0.96 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 0.00 714 M 7.74 4.35 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.41 0.00 715 E 7.65 4.28 0.00 2.22 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 2.21 2.48 0.00 716 I 8.22 3.22 1.68 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 0.81 0.47 0.37 0.00 0.00 717 K 7.92 3.92 0.00 1.78 1.82 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.36 7.81 718 L 7.66 4.26 0.00 1.72 1.86 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 719 L 7.85 3.46 0.00 1.50 1.38 0.68 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 720 T 7.67 3.87 4.38 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 1.23 0.00 0.00 721 E 7.76 4.07 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 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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 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 853 S 7.90 4.94 0.00 3.98 3.88 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 0.00 854 G 8.30 3.53 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 0.00 855 W 8.19 4.81 0.00 3.28 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 R 7.82 4.58 0.00 1.76 1.81 0.00 3.40 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 857 A 8.01 2.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 858 P 0.00 4.06 0.00 2.02 2.35 0.00 2.72 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 859 E 7.73 3.54 0.00 2.02 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 2.12 2.20 0.00 860 L 7.44 4.16 0.00 1.72 1.73 0.93 1.02 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 1025 W 8.85 4.85 0.00 4.00 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 1026 T 7.58 3.91 4.39 0.00 0.00 0.00 0.00 0.00 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 1027 V 7.40 3.69 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 0.78 0.00 0.00 0.93 0.00 0.00 1028 K 7.76 4.10 0.00 1.49 1.09 0.00 1.02 0.00 0.00 1.35 0.00 0.00 2.80 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.26 0.90 7.81 1029 F 7.34 4.63 0.00 2.99 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1030 D 8.54 4.76 0.00 2.68 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 1031 K 8.62 4.35 0.00 1.75 1.85 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.07 7.81 1032 T 7.96 4.17 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1033 F 8.57 4.20 0.00 3.29 3.42 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 1034 M 8.16 4.42 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 1035 D 7.79 4.61 0.00 2.75 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 1036 N 7.86 4.76 0.00 2.90 3.01 0.00 0.00 7.05 6.55 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 1037 L 7.22 3.96 0.00 1.86 1.71 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 1038 E 8.25 4.51 0.00 2.04 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.19 0.00 1039 R 7.37 4.37 0.00 2.10 1.88 0.00 3.23 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 *1040 Y 7.50 4.27 0.00 2.38 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1041 R 7.88 4.74 0.00 1.76 1.59 0.00 3.07 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.50 0.00 1042 K 8.20 4.33 0.00 1.82 1.57 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 1.02 7.81 1043 Y 8.06 5.05 0.00 2.94 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 1044 H 9.03 4.41 0.00 3.32 3.36 0.00 5.61 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 1045 S 8.81 3.82 0.00 3.87 3.86 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 1046 S 7.89 4.90 0.00 4.08 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 1047 K 7.88 4.38 0.00 2.06 1.86 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.67 1.54 7.81 1048 L 8.77 4.10 0.00 1.87 1.77 0.86 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 1049 M 8.08 3.88 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.21 0.00 1050 D 8.06 4.66 0.00 3.23 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 1051 L 7.01 2.44 0.00 0.27 1.12 0.37 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 1052 L 7.50 3.74 0.00 1.85 1.60 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 1053 R 8.26 3.91 0.00 1.91 2.05 0.00 3.32 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 1054 A 8.52 4.10 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 1055 L 7.79 3.61 0.00 1.13 1.62 0.38 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 1056 R 7.81 3.94 0.00 1.87 2.07 0.00 3.31 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 1.65 1.91 0.00 1057 N 8.55 4.45 0.00 2.91 2.98 0.00 0.00 7.10 8.51 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 1058 K 8.05 4.14 0.00 2.49 2.39 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.71 1.92 7.81 1059 Y 8.10 3.83 0.00 2.76 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 1060 H 8.65 4.19 0.00 3.15 3.27 0.00 5.88 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1061 H 8.38 4.96 0.00 3.38 3.38 0.00 5.82 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1062 F 7.98 4.16 0.00 3.17 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 1063 M 8.09 4.09 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 1064 D 7.85 4.50 0.00 2.86 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 1065 L 7.03 4.05 0.00 1.34 1.38 0.57 0.84 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 1066 P 0.00 4.41 0.00 2.11 1.93 0.00 3.56 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 1067 E 8.86 3.94 0.00 1.96 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 2.33 1.98 0.00 1068 D 8.01 4.63 0.00 2.87 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 1069 I 7.67 3.79 1.80 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 0.95 0.91 0.00 0.00 1070 A 7.69 3.66 1.05 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 1071 E 8.11 4.11 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 1072 L 7.50 4.23 0.00 1.83 1.87 0.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 1073 M 8.57 4.15 0.00 1.95 2.17 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.81 0.00 1074 G 7.98 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 1075 P 0.00 4.74 0.00 2.28 2.28 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 1076 V 8.36 3.99 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 -0.14 0.00 0.00 0.78 0.00 0.00 1077 P 0.00 3.42 0.00 2.31 2.33 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 1078 D 8.17 4.59 0.00 2.81 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 1079 G 8.16 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 1080 F 8.58 4.43 0.00 3.25 3.34 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 1081 Y 9.03 4.33 0.00 3.34 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1082 D 8.80 4.62 0.00 3.00 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 1083 Y 8.45 3.86 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1084 F 7.99 4.51 0.00 3.15 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 1085 T 8.12 4.23 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 0.49 0.00 0.00 1086 K 7.85 3.90 0.00 1.88 1.77 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.35 7.81 1087 R 6.91 3.93 0.00 1.43 0.80 0.00 2.21 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.02 0.00 1088 F 7.96 4.74 0.00 3.04 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 1089 P 0.00 4.42 0.00 2.16 2.26 0.00 3.76 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 1.98 1.86 0.00 1090 N 8.00 4.81 0.00 2.44 2.21 0.00 0.00 6.80 6.74 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 1091 L 8.09 3.97 0.00 1.96 1.78 0.88 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 1092 L 7.91 4.15 0.00 1.99 1.79 0.69 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 1093 I 7.95 3.83 1.90 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.41 1.16 0.00 0.00 1094 G 8.45 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1095 V 8.16 3.80 2.37 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 1.28 0.00 0.00 1.14 0.00 0.00 1096 Y 8.66 4.31 0.00 3.10 3.10 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 0.00 1097 M 8.39 3.91 0.00 1.97 2.21 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.58 0.00 1098 I 7.49 3.48 1.48 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 -0.41 0.00 0.00 1099 V 8.10 3.59 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.10 0.00 0.00 1100 K 8.50 3.94 0.00 1.09 1.53 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.19 7.81 1101 E 7.62 4.22 0.00 2.07 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 0.00 2.22 2.21 0.00 1102 N 8.06 5.03 0.00 2.71 2.88 0.00 0.00 6.92 7.37 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 1103 L 8.02 4.91 0.00 1.75 1.83 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 1104 S 8.35 4.51 0.00 4.20 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 0.00 1105 D 7.94 4.75 0.00 2.82 2.79 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 1106 D 7.78 4.78 0.00 2.90 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 1107 Q 8.72 4.05 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 1108 I 7.99 3.99 1.94 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 1.47 1.19 1.06 0.00 0.00 1109 L 8.01 4.57 0.00 1.98 1.93 0.87 0.98 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 1110 R 9.29 4.23 0.00 1.96 2.18 0.00 3.71 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 1111 E 7.90 4.11 0.00 1.95 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 2.61 2.31 0.00 1112 F 8.20 3.91 0.00 3.40 3.02 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 1113 L 8.26 4.36 0.00 1.51 0.36 1.15 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 1114 Y 8.20 4.97 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 1115 S 8.03 4.24 0.00 4.02 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.