NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 608 K 4.2822 8.1727 122.0473 56.1303 33.8284 174.1980 609 E 4.4282 8.8618 129.6573 55.6000 30.3687 173.9763 610 I 4.4537 8.6766 128.6712 59.1092 39.7642 174.6713 611 D 4.1679 8.3041 127.1279 54.2693 41.4739 177.5554 612 V 3.7339 8.5967 125.8878 64.4661 31.4564 178.1262 613 S 4.2902 8.2046 114.4545 60.5430 63.1161 174.5391 614 Y 4.6809 8.2229 118.9022 58.6304 38.1742 174.8303 615 V 4.7980 7.5855 120.1088 60.6339 33.5857 174.3729 616 K 4.5814 8.8248 127.7522 54.6626 34.9070 174.6609 617 I 4.3168 8.4684 128.5573 61.0523 37.5459 175.2673 618 E 4.4096 9.0810 126.9538 58.0356 30.9008 176.2470 619 E 4.6929 7.5842 116.7901 55.0750 33.1916 174.3081 620 V 4.3407 8.4907 126.4614 62.4881 31.9835 175.4145 621 I 4.4652 8.4736 120.6924 60.5234 39.1491 174.9230 622 G 4.1603 7.3613 108.5048 46.2409 0.0000 171.7188 623 A 5.1687 8.7861 120.5751 50.2225 22.1502 176.1009 624 G 4.2247 9.3560 111.8116 43.1863 0.0000 173.3040 625 E 3.8080 8.8737 118.8776 58.6252 29.3063 177.7380 626 F 4.7503 8.5620 113.0027 56.1520 40.7157 176.0494 627 G 4.0540 6.7459 105.7178 45.8806 0.0000 171.9185 628 E 4.6753 8.0507 119.2462 56.1511 31.4549 175.8637 629 V 4.9142 8.5088 121.7715 61.5236 34.1730 174.3473 630 C 5.3665 9.2577 124.5525 58.0115 32.7562 172.7964 631 R 4.5723 8.6634 121.5911 55.6079 31.8335 175.8587 632 G 4.0150 8.3533 110.7681 45.8139 0.0000 171.3787 633 R 5.1773 8.8453 118.1171 54.1646 34.0956 174.6039 634 L 5.1215 8.9400 125.2469 53.1413 44.7799 174.9477 635 K 4.7007 9.3570 127.3903 54.7734 34.6407 175.0736 636 A 3.8559 8.2226 129.9454 48.8149 21.6775 173.4520 637 P 4.1748 0.0000 0.0000 64.3349 31.6632 177.3745 638 G 3.9650 8.9498 110.7321 45.1697 0.0000 173.1646 639 K 4.6334 7.5498 118.2304 54.0328 34.8997 176.3339 640 K 4.1821 8.2709 120.8699 55.9208 32.7780 176.7470 641 E 4.4737 8.4576 122.6927 56.6958 30.3740 175.8656 642 S 4.8223 8.9956 118.9817 56.7537 67.2426 172.5576 643 C 4.8466 8.6235 118.3423 59.6660 28.8720 173.6018 644 V 4.8418 8.6431 115.2671 59.5951 36.0578 174.4299 645 A 5.0408 8.7894 124.5296 51.2229 20.9916 176.5176 646 I 4.9797 8.8559 121.4351 59.5799 41.0444 174.6894 647 K 5.1642 9.2893 127.6471 55.3699 33.5940 175.8497 648 T 5.2305 8.7093 114.0832 59.7614 72.3226 172.6938 649 L 4.3752 8.7210 125.7096 53.5151 44.4433 175.9627 650 K 4.6596 8.3238 127.8966 54.8811 34.6050 176.5971 651 G 3.7041 8.3750 108.1663 47.4374 0.0000 173.9348 652 G 3.8073 9.0015 108.3883 45.1068 0.0000 173.0922 653 Y 4.5753 7.4715 116.4440 56.4120 40.0027 175.9650 654 T 4.2937 8.7816 113.0312 61.3557 71.1832 175.6672 655 E 3.9640 8.6548 120.9051 59.5487 29.4158 179.6414 656 R 3.9226 7.9518 118.4111 59.4614 30.1278 178.4799 657 Q 3.9401 8.1511 118.0046 58.7191 28.6252 178.4384 658 R 3.7546 8.1664 122.2762 60.1529 30.0069 179.4868 659 R 3.9114 8.0529 120.3261 61.3130 29.1760 180.2282 660 E 4.0988 8.0222 119.2792 58.8945 29.4438 178.3297 661 F 4.1606 8.0277 121.0054 61.4885 39.4945 177.2110 662 L 3.9792 8.2937 118.4120 57.0386 41.3220 179.3946 663 S 4.1012 8.1459 115.0509 61.3342 62.5744 176.2036 664 E 4.0190 7.7969 121.5365 58.9986 29.2798 178.6053 665 A 3.8552 7.7155 120.2085 55.3238 18.2884 179.4183 666 S 3.9446 7.5763 112.1447 61.8404 63.1051 177.0056 667 I 3.5106 7.7684 122.2178 64.6039 36.9368 178.2359 668 M 3.6483 8.0434 119.9109 58.3287 31.5663 178.8904 669 G 3.6125 7.8346 104.0882 46.7694 0.0000 175.0272 670 Q 3.9540 7.3734 119.1204 56.2278 29.1238 175.7167 671 F 5.3160 6.6934 118.2483 55.7976 41.4363 175.3885 672 E 4.3389 8.8119 124.7270 56.0906 31.1741 173.9416 673 H 4.3404 8.0027 123.7834 54.2529 32.4745 172.7924 674 P 4.3259 0.0000 0.0000 64.8867 31.4287 176.5847 675 N 4.9523 8.2164 116.2272 52.8396 39.0063 173.3147 676 I 4.9078 7.4891 118.7090 59.0825 40.3369 175.6770 677 I 3.8824 8.5489 127.7848 62.1662 37.8490 175.4739 678 R 4.2957 9.1638 127.8979 55.2821 31.3998 174.9395 679 L 4.4713 8.4361 128.8782 55.1950 42.3204 176.0127 680 E 4.2502 9.2713 126.5418 56.9972 30.7804 176.5291 681 G 3.9988 6.8681 103.4113 46.6385 0.0000 171.5578 682 V 5.0680 8.1456 111.9589 59.4803 36.4938 175.5214 683 V 4.9054 8.9829 123.0885 61.7649 33.1314 175.8397 684 T 4.5589 9.8198 117.3209 61.3013 69.9889 174.2584 685 N 4.8634 8.0246 118.6707 52.6602 38.9440 173.9945 686 S 4.5023 7.4726 110.2176 57.8494 65.0940 173.4443 687 M 4.6444 8.3042 123.7622 52.7840 34.0165 173.7838 688 P 4.6197 0.0000 0.0000 62.3341 32.9244 176.0601 689 V 4.0558 8.2845 121.2097 63.4923 32.7985 174.8212 690 M 5.5876 9.2504 125.2743 53.8292 36.9744 173.9939 691 I 4.8830 8.7510 122.0431 59.5480 40.4815 174.4034 692 L 5.3785 8.9571 127.5006 53.2180 44.3629 175.7758 693 T 5.2392 8.8364 112.9537 59.1542 72.8654 172.8774 694 E 4.4049 8.6512 120.1780 57.1019 30.1062 176.1460 695 F 4.9098 8.7268 123.0969 57.2356 41.3276 175.2095 696 M 4.2030 7.7979 125.3615 53.1308 32.5841 176.0223 697 E 3.2368 8.1032 124.7840 58.7994 29.7822 178.7550 698 N 4.6257 7.7910 113.2653 52.0894 39.6183 177.2792 699 G 3.6625 7.6115 107.4999 45.9700 0.0000 172.9900 700 A 4.6353 8.2739 122.4298 51.6783 20.3854 178.3000 701 L 4.0790 8.8738 126.1589 58.1053 42.0956 179.4369 702 D 4.4354 8.1379 118.9793 56.6713 39.4574 178.6476 703 S 4.2116 8.1278 115.7557 60.8744 62.9004 175.9528 704 F 4.3570 8.2650 123.4860 61.1905 39.4849 176.8463 705 L 4.2797 8.4470 118.8027 57.7205 41.2252 179.5751 706 R 4.0949 8.0253 117.3790 59.2304 30.0877 178.4285 707 L 4.0895 7.9591 119.1036 57.0762 42.5376 177.2126 708 N 4.6466 7.5617 116.0200 52.1655 39.1618 174.1709 709 D 4.0146 7.8885 117.9703 55.3233 41.6845 175.8457 710 G 3.3083 5.3800 113.2045 46.0045 0.0000 173.6685 711 Q 4.2325 7.3141 116.6580 55.1752 29.6687 175.5167 712 F 5.3572 7.7484 116.6033 55.5626 41.8142 175.8702 713 T 4.3599 8.9439 115.1293 61.0876 70.8794 176.0838 714 V 3.5910 8.3154 120.2958 66.3973 31.4807 178.0154 715 I 3.7714 7.7564 118.9537 64.3016 36.9771 178.3034 716 Q 3.9718 8.0781 118.6964 59.0045 28.5441 178.6832 717 L 3.9314 8.0975 120.0758 57.9222 41.5513 179.8789 718 V 3.6839 8.3284 118.6768 65.8351 31.4229 178.3204 719 G 3.5870 8.1825 105.6211 47.8550 0.0000 175.5575 720 M 4.0052 8.0811 120.9192 58.3850 31.9862 178.7670 721 L 4.1023 8.0913 119.0872 57.8911 41.6546 179.7563 722 R 4.0258 8.3808 119.0611 59.2668 29.9911 178.7845 723 G 3.6142 8.1150 105.5909 47.8614 0.0000 175.6530 724 I 3.7252 7.9603 122.2565 64.1934 37.2237 178.5155 725 A 3.7482 8.4348 121.6306 54.8575 18.0977 179.7178 726 S 4.1427 8.4388 112.5439 61.3260 62.5122 176.3492 727 G 3.5579 8.1905 108.6303 48.2701 0.0000 175.5585 728 M 3.7106 7.8550 121.2441 57.5298 31.7672 178.4776 729 R 3.8972 8.0160 119.4157 59.8727 30.1171 177.8358 730 Y 3.9473 7.8912 118.7587 60.6542 38.7307 177.7740 731 L 3.5709 7.9028 119.6723 57.6799 41.7038 179.4355 732 A 4.0357 8.3620 121.1304 55.0927 18.0944 179.2427 733 E 3.9005 7.9649 116.9826 59.4983 29.7606 178.1363 734 M 4.2363 7.5756 115.5793 54.5874 32.1618 176.1606 735 S 3.7435 7.7268 114.1533 59.6820 61.2300 171.3011 736 Y 4.5575 8.2629 121.1302 55.7935 39.8209 174.6407 737 V 4.2770 7.6770 127.1929 61.5965 32.6106 174.8230 738 H 4.2487 9.6308 128.2122 59.5275 29.8728 177.7320 739 R 4.3793 8.8065 115.2336 56.5735 29.3341 175.7962 740 D 4.8901 7.8064 116.6519 53.3071 41.5616 175.4647 741 L 3.9326 8.2909 120.4241 54.8291 42.6210 175.2872 742 A 4.5824 8.0504 126.7787 50.7656 22.0625 176.4684 743 A 4.0354 9.4190 124.6005 55.2144 18.6207 180.5984 744 R 4.2989 7.9012 110.4158 58.2568 29.5789 176.9877 745 N 4.6881 8.2677 115.1629 52.9185 38.9054 173.5840 746 I 4.8262 7.6747 121.0089 59.7002 39.2888 174.7969 747 L 5.0928 8.7978 127.0838 53.0796 44.6976 175.6007 748 V 4.7154 8.1591 121.4316 61.2007 34.6826 175.2451 749 N 5.1852 8.8042 125.9552 50.7340 39.6090 175.9160 750 S 4.0847 8.7649 112.2751 60.9701 63.2133 174.5149 751 N 4.6059 8.2023 117.1543 52.6957 38.2555 175.3651 752 L 3.5254 7.8401 116.6105 55.0628 39.9319 174.6537 753 V 3.6607 7.5934 119.7102 62.9990 31.9902 174.2302 754 C 5.1062 8.4450 124.7151 58.3935 29.6722 173.2285 755 K 4.7815 8.9742 122.4524 54.3006 36.2376 175.8559 756 V 4.1195 8.8234 124.9947 63.0330 32.6691 175.0567 757 S 4.8239 8.4645 121.3845 57.4319 66.7414 171.0572 758 D 4.4815 8.9913 120.9156 54.1080 38.0004 172.0165 759 F 4.9427 8.2631 120.9251 54.6810 41.9389 175.6084 760 G 4.1697 7.8892 112.7920 45.7611 0.0000 172.9749 761 L 4.5806 8.5102 120.8317 54.1284 42.5139 176.8952 762 S 4.2793 7.6695 115.5585 57.9206 63.1595 174.5083 763 R 3.9850 8.2471 123.1656 55.9191 30.7543 176.5489 764 F 4.5013 9.0291 122.2152 57.8448 39.6965 177.3648 765 L 4.1754 9.2199 123.7954 57.6355 40.8074 180.8012 766 E 4.1562 8.2648 116.9228 58.9131 29.5992 177.8586 767 E 4.3056 8.5081 118.0117 57.9974 30.2426 176.2193 768 N 4.9342 7.4666 116.5873 51.6300 40.8199 174.3292 769 S 4.1978 9.0773 113.8063 60.3220 63.3357 175.5951 770 S 4.0911 7.7818 118.5795 61.0066 63.8303 175.1984 771 D 4.8419 7.4198 119.4426 53.7005 41.0588 177.6700 *779 G 3.6952 7.6454 108.8348 43.9725 0.0000 174.8272 780 G 3.8836 7.9248 108.1460 44.6111 0.0000 172.5700 781 K 4.7694 8.2893 117.1725 54.9812 33.3082 176.9555 782 I 2.4331 8.0680 123.0285 60.6239 37.4156 175.7840 783 P 4.6269 0.0000 0.0000 61.7061 29.9758 176.5338 784 I 3.6406 8.3597 128.0186 65.2958 37.3288 178.9028 785 R 3.7584 8.0991 116.5985 58.1097 29.9367 177.3544 786 W 4.6900 8.7485 116.5461 56.8029 30.0021 175.6341 787 T 4.6303 7.6036 115.6132 61.5038 69.7997 175.1435 788 A 2.5800 8.0395 127.1873 50.5962 20.3414 176.9734 789 P 3.7473 0.0000 0.0000 65.8634 31.1645 178.8786 790 E 3.5539 7.7475 116.4461 58.6262 29.5706 178.9093 791 A 3.5786 7.4238 121.5177 54.6996 18.2386 179.3924 792 I 3.4040 7.1996 116.9986 64.4450 37.2738 178.2880 793 A 3.7915 7.4461 120.1251 54.2406 17.1382 178.7151 794 F 4.9360 7.6512 113.2112 56.0506 40.2553 176.2886 795 R 3.5698 7.7866 116.3029 56.9566 27.9288 176.5770 796 K 4.3047 7.2037 116.0228 55.2724 31.4832 176.1666 797 F 4.7386 8.7008 123.5271 56.2366 40.2710 176.2708 798 T 4.8610 9.0400 115.7278 59.2428 73.3744 174.9941 799 S 4.3201 8.7493 115.9606 61.7267 62.4371 176.8379 800 A 4.0781 8.0935 123.4659 54.9292 18.1926 179.6426 801 S 4.2568 8.2540 113.1467 61.7185 63.1810 176.3780 802 D 4.6941 8.7048 122.4209 57.2877 40.5958 178.6255 803 A 3.9797 8.3754 121.3986 54.6678 18.2815 179.2405 804 W 4.5439 8.0876 128.0355 60.4024 30.7538 178.1220 805 S 4.8564 8.6814 116.2724 61.4635 62.3139 176.1175 806 Y 4.3126 9.0523 122.5495 60.8580 38.4896 178.5074 807 G 3.2660 8.3468 106.5197 47.7446 0.0000 175.7114 808 I 4.0007 8.1850 122.2407 64.2611 37.0705 178.5420 809 V 3.8891 8.2997 119.3996 66.3669 31.1970 177.8758 810 M 3.8175 7.9417 118.6059 58.0851 31.7885 178.4563 811 W 4.0369 8.2219 128.3280 60.6391 30.9167 177.7530 812 E 4.0434 8.7397 118.6914 59.3804 28.8970 179.6899 813 V 3.4013 7.9804 118.3622 66.3053 31.5220 178.0100 814 M 4.0121 7.8875 116.4652 56.9058 31.5959 177.6822 815 S 4.3738 7.4695 113.9441 56.7265 63.5732 173.9642 816 F 3.8393 8.6182 119.3688 59.0592 36.6537 175.8695 817 G 3.9020 8.6828 104.0107 46.1213 0.0000 174.0616 818 E 4.2137 7.2851 119.2908 55.1995 30.4662 176.2355 819 R 4.2085 8.4986 123.1678 54.9549 30.6304 174.1050 820 P 3.1558 0.0000 0.0000 64.0709 31.6672 175.7226 821 Y 3.2839 6.6235 118.1026 57.4183 36.3952 170.8650 822 W 3.5419 6.6948 123.4187 58.3721 29.0950 174.8551 823 D 4.8792 9.1728 125.6530 54.2103 38.8435 176.0926 824 M 4.1734 8.1588 120.4061 55.5226 32.5115 177.1813 825 S 4.3847 8.6936 118.1148 57.9261 65.3642 175.3047 826 N 4.1410 8.5588 119.8448 56.7063 38.2433 177.4671 827 Q 3.8917 7.9201 120.2680 58.9753 29.1021 177.5401 828 D 4.2488 8.1101 120.1268 57.3293 40.8658 178.9419 829 V 3.1025 7.6752 118.5536 65.9214 31.5645 177.8743 830 I 3.4923 7.4225 119.2995 64.6171 36.9584 178.2336 831 N 4.2712 8.2134 116.8863 56.0093 38.2534 177.3134 832 A 3.9267 8.1064 122.4343 55.3812 18.5149 179.6768 833 I 3.9894 7.7353 119.5702 64.0824 36.9601 178.3542 834 E 4.0280 7.9420 118.6369 58.5786 29.3948 177.6203 835 Q 4.5048 7.7008 116.5477 55.7548 29.7538 176.2781 836 D 4.8142 7.9939 118.6097 54.3488 39.7526 174.3102 837 Y 4.2988 8.1570 121.6780 57.5096 39.4268 174.7270 838 R 4.4212 7.1328 123.5579 53.6224 34.2752 175.1163 839 L 3.6715 7.3010 120.5778 54.4381 41.9159 175.6849 840 P 4.7411 0.0000 0.0000 60.9457 32.7371 173.9760 841 P 4.3439 0.0000 0.0000 61.7463 31.7930 175.2365 842 P 4.4054 0.0000 0.0000 61.4491 31.9598 173.9511 843 P 4.3318 0.0000 0.0000 64.6557 31.5019 176.4568 844 D 4.4222 8.8572 119.9656 54.8236 38.6012 173.2553 845 C 4.2328 8.0675 120.7089 58.0944 32.1342 172.1431 846 P 4.4286 0.0000 0.0000 63.5337 32.3291 177.2668 847 T 3.9245 8.9088 120.1349 66.8599 68.4696 176.8611 848 S 4.2129 8.0671 115.5914 61.4942 62.8876 176.5669 849 L 3.9357 7.7921 122.0305 57.7471 41.4096 178.6171 850 H 4.0807 8.1563 118.1898 59.2392 29.6713 177.0975 851 Q 3.7901 8.5249 121.8172 59.0104 28.8249 177.9393 852 L 3.9469 7.7440 121.2826 58.1854 42.0656 178.7277 853 M 3.1469 7.6967 118.5981 58.1951 31.5714 178.7059 854 L 3.8233 7.2074 117.5049 57.7212 41.8377 179.1274 855 D 4.4001 7.9336 118.9800 57.6340 40.6440 178.6203 856 C 4.0710 7.8828 117.1602 61.9435 27.6839 174.9958 857 W 3.7307 6.9390 118.7116 55.3729 29.4317 176.4864 858 Q 4.2507 7.2471 118.7277 55.8085 28.7502 176.8761 859 K 4.1833 8.8467 123.3158 59.3425 32.7252 176.4026 860 D 4.5883 8.1173 119.8131 53.2942 40.9192 176.4581 861 R 4.0476 8.7485 124.8298 59.3418 29.5114 178.5257 862 N 4.4102 8.4285 114.5529 55.1103 38.6414 175.7666 863 A 4.2977 7.8592 120.1546 53.3577 19.2686 178.1693 864 R 4.2988 7.4131 115.3068 55.1044 30.6951 174.9599 865 P 4.4109 0.0000 0.0000 62.7502 32.1456 177.1606 866 R 4.0861 8.4554 119.7588 55.5078 32.3079 177.9070 867 F 4.1570 8.4544 118.4897 60.2421 38.7905 176.1487 868 P 4.2828 0.0000 0.0000 65.7384 31.1043 178.6072 869 Q 3.9672 7.9612 116.4459 58.6506 28.6991 178.5843 870 V 3.4964 7.6356 119.3528 65.9295 31.5063 178.1314 871 V 3.5585 8.0199 118.2045 66.1925 31.3783 177.8505 872 S 4.1003 8.2168 114.6267 61.7653 62.7334 176.6740 873 A 3.9984 8.0784 123.0752 55.3108 18.1505 179.7563 874 L 4.0018 7.9924 117.4603 57.9729 41.6656 179.4681 875 D 4.4051 8.5177 119.3365 57.1327 40.7036 179.0074 876 K 3.9773 8.1873 119.1087 59.6492 31.8491 179.2061 877 M 4.0584 7.7278 117.6748 58.5927 31.9854 178.5624 878 I 3.8588 7.6028 118.4931 64.5602 37.3529 178.5381 879 R 4.1374 7.8861 117.7482 57.7516 31.4602 176.7492 880 N 5.1157 7.9919 115.3904 50.5802 38.9495 173.4783 881 P 4.3575 0.0000 0.0000 65.8055 31.7491 178.1866 882 A 3.9844 8.1587 120.5141 55.2518 17.8178 179.4536 883 S 4.1468 8.1062 112.4283 61.3323 62.7249 176.0422 884 L 4.1037 7.7611 120.4499 55.8111 41.5796 178.0122 885 K 4.1066 7.8787 118.6334 58.6033 32.5032 177.4671 886 I 3.9678 7.3264 121.1776 60.8615 37.2649 175.2016 887 V 4.6256 8.0148 123.9936 60.7340 34.7188 174.8066 888 A 4.1918 7.9620 127.0534 52.5381 18.2284 177.4205 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 608 K 8.17 4.28 0.00 1.84 1.76 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.45 7.81 609 E 8.86 4.43 0.00 2.06 1.81 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 2.25 2.42 0.00 610 I 8.68 4.45 1.87 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 1.17 0.93 0.97 0.00 0.00 611 D 8.30 4.17 0.00 2.00 1.54 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 0.00 612 V 8.60 3.73 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 0.66 0.00 0.00 0.91 0.00 0.00 613 S 8.20 4.29 0.00 4.04 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 0.00 614 Y 8.22 4.68 0.00 3.02 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 0.00 615 V 7.59 4.80 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 0.77 0.00 0.00 0.97 0.00 0.00 616 K 8.82 4.58 0.00 1.93 1.60 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.31 1.25 7.81 617 I 8.47 4.32 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.68 0.91 0.00 0.00 618 E 9.08 4.41 0.00 1.87 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.18 0.00 619 E 7.58 4.69 0.00 1.98 1.69 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 2.26 2.27 0.00 620 V 8.49 4.34 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 0.89 0.00 0.00 1.05 0.00 0.00 621 I 8.47 4.47 1.98 0.00 0.00 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 1.35 0.94 0.97 0.00 0.00 622 G 7.36 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 0.00 623 A 8.79 5.17 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 624 G 9.36 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 0.00 625 E 8.87 3.81 0.00 1.75 1.72 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 1.47 1.86 0.00 626 F 8.56 4.75 0.00 3.01 2.39 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 0.00 627 G 6.75 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 0.00 628 E 8.05 4.68 0.00 1.98 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 2.43 2.34 0.00 629 V 8.51 4.91 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 1.15 0.00 0.00 1.00 0.00 0.00 630 C 9.26 5.37 0.00 2.85 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 631 R 8.66 4.57 0.00 1.56 1.56 0.00 2.53 0.00 0.00 2.73 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 632 G 8.35 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 0.00 0.00 0.00 633 R 8.85 5.18 0.00 1.66 1.76 0.00 3.28 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 634 L 8.94 5.12 0.00 1.74 1.50 1.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 635 K 9.36 4.70 0.00 1.65 1.61 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.28 1.29 7.81 636 A 8.22 3.86 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 637 P 0.00 4.17 0.00 1.97 1.95 0.00 3.27 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.88 0.00 638 G 8.95 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 639 K 7.55 4.63 0.00 2.01 1.66 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.23 7.81 640 K 8.27 4.18 0.00 1.99 1.72 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.44 0.99 7.81 641 E 8.46 4.47 0.00 1.95 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 2.28 2.38 0.00 642 S 9.00 4.82 0.00 3.87 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 0.00 643 C 8.62 4.85 0.00 2.98 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 0.00 644 V 8.64 4.84 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.92 0.00 0.00 645 A 8.79 5.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 646 I 8.86 4.98 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 1.25 0.81 0.95 0.00 0.00 647 K 9.29 5.16 0.00 1.75 2.05 0.00 1.56 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.44 7.81 648 T 8.71 5.23 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 1.25 0.00 0.00 649 L 8.72 4.38 0.00 0.27 0.81 -0.16 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 650 K 8.32 4.66 0.00 1.85 1.79 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.42 7.81 651 G 8.37 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 0.00 0.00 0.00 652 G 9.00 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 0.00 653 Y 7.47 4.58 0.00 2.92 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 0.00 654 T 8.78 4.29 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 0.00 655 E 8.65 3.96 0.00 2.00 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 0.00 2.40 2.31 0.00 656 R 7.95 3.92 0.00 1.99 1.96 0.00 3.29 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.29 0.00 657 Q 8.15 3.94 0.00 2.51 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.56 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 658 R 8.17 3.75 0.00 1.82 2.06 0.00 3.19 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 659 R 8.05 3.91 0.00 1.87 1.92 0.00 3.32 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 660 E 8.02 4.10 0.00 2.09 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 2.54 2.54 0.00 661 F 8.03 4.16 0.00 2.32 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 0.00 662 L 8.29 3.98 0.00 1.77 1.66 0.94 1.10 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 0.00 663 S 8.15 4.10 0.00 4.02 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 0.00 664 E 7.80 4.02 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.56 0.00 665 A 7.72 3.86 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 666 S 7.58 3.94 0.00 3.94 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 0.00 667 I 7.77 3.51 1.82 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 1.51 0.68 0.65 0.00 0.00 668 M 8.04 3.65 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.47 0.00 669 G 7.83 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 670 Q 7.37 3.95 0.00 1.03 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.62 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 671 F 6.69 5.32 0.00 2.84 2.82 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 0.00 672 E 8.81 4.34 0.00 1.89 1.84 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 2.17 2.20 0.00 673 H 8.00 4.34 0.00 1.71 2.35 0.00 5.73 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 674 P 0.00 4.33 0.00 2.12 2.07 0.00 3.05 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 675 N 8.22 4.95 0.00 2.92 2.90 0.00 0.00 6.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 676 I 7.49 4.91 1.74 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 0.98 0.60 0.91 0.00 0.00 677 I 8.55 3.88 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.79 0.96 0.00 0.00 678 R 9.16 4.30 0.00 1.90 1.81 0.00 3.06 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 679 L 8.44 4.47 0.00 1.61 1.49 0.97 0.96 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 0.00 680 E 9.27 4.25 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 2.31 2.42 0.00 681 G 6.87 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 0.00 0.00 0.00 682 V 8.15 5.07 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 0.61 0.00 0.00 0.96 0.00 0.00 683 V 8.98 4.91 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 1.06 0.00 0.00 1.00 0.00 0.00 684 T 9.82 4.56 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 1.22 0.00 0.00 685 N 8.02 4.86 0.00 2.69 2.82 0.00 0.00 6.72 7.57 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 0.00 686 S 7.47 4.50 0.00 3.74 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 687 M 8.30 4.64 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 688 P 0.00 4.62 0.00 2.08 2.01 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 689 V 8.28 4.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.89 0.00 0.00 690 M 9.25 5.59 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.54 0.00 691 I 8.75 4.88 1.72 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.53 0.81 0.00 0.00 692 L 8.96 5.38 0.00 1.73 1.57 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 693 T 8.84 5.24 4.37 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 1.22 0.00 0.00 694 E 8.65 4.40 0.00 2.03 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 0.00 2.32 2.28 0.00 695 F 8.73 4.91 0.00 2.82 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 0.00 696 M 7.80 4.20 0.00 1.96 1.77 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.38 0.00 697 E 8.10 3.24 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 698 N 7.79 4.63 0.00 2.22 1.60 0.00 0.00 7.03 7.18 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 0.00 699 G 7.61 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 700 A 8.27 4.64 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 0.00 701 L 8.87 4.08 0.00 1.85 1.94 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 702 D 8.14 4.44 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 0.00 703 S 8.13 4.21 0.00 4.16 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 0.00 704 F 8.26 4.36 0.00 3.24 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 705 L 8.45 4.28 0.00 1.98 1.85 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 706 R 8.03 4.09 0.00 2.01 2.04 0.00 3.23 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.89 0.00 707 L 7.96 4.09 0.00 1.75 1.83 0.92 0.94 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 P 0.00 3.75 0.00 1.97 1.97 0.00 2.34 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 1.70 1.52 0.00 790 E 7.75 3.55 0.00 2.36 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 2.28 2.34 0.00 791 A 7.42 3.58 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 792 I 7.20 3.40 1.71 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.72 0.00 0.00 793 A 7.45 3.79 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 794 F 7.65 4.94 0.00 3.09 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 0.00 795 R 7.79 3.57 0.00 2.06 2.24 0.00 3.15 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 796 K 7.20 4.30 0.00 1.72 1.80 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.55 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4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 806 Y 9.05 4.31 0.00 3.48 3.38 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 0.00 807 G 8.35 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 0.00 0.00 0.00 808 I 8.19 4.00 2.28 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.04 0.50 0.00 0.00 809 V 8.30 3.89 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.15 0.00 0.00 810 M 7.94 3.82 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.24 0.00 811 W 8.22 4.04 0.00 3.59 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 0.00 812 E 8.74 4.04 0.00 2.35 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 2.63 2.83 0.00 813 V 7.98 3.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.95 0.00 0.00 814 M 7.89 4.01 0.00 1.88 1.91 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.75 0.00 815 S 7.47 4.37 0.00 3.56 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 0.00 816 F 8.62 3.84 0.00 3.19 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 0.00 817 G 8.68 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 0.00 818 E 7.29 4.21 0.00 1.78 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 2.68 2.46 0.00 819 R 8.50 4.21 0.00 1.99 1.86 0.00 3.34 0.00 0.00 3.50 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 820 P 0.00 3.16 0.00 1.33 1.08 0.00 3.63 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.99 0.00 821 Y 6.62 3.28 0.00 2.91 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 0.00 822 W 6.69 3.54 0.00 3.66 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 823 D 9.17 4.88 0.00 2.83 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 0.00 824 M 8.16 4.17 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.46 0.00 825 S 8.69 4.38 0.00 4.03 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 826 N 8.56 4.14 0.00 2.70 2.84 0.00 0.00 6.45 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 827 Q 7.92 3.89 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 828 D 8.11 4.25 0.00 2.90 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 829 V 7.68 3.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.44 0.00 0.00 830 I 7.42 3.49 1.87 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.95 0.76 0.00 0.00 831 N 8.21 4.27 0.00 2.77 2.80 0.00 0.00 6.97 7.27 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 0.00 832 A 8.11 3.93 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 0.00 833 I 7.74 3.99 1.80 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.32 1.03 0.00 0.00 834 E 7.94 4.03 0.00 1.91 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 2.28 2.38 0.00 835 Q 7.70 4.50 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 5.45 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 836 D 7.99 4.81 0.00 2.92 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 0.00 837 Y 8.16 4.30 0.00 3.06 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 0.00 838 R 7.13 4.42 0.00 1.65 1.70 0.00 3.24 0.00 0.00 3.08 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 839 L 7.30 3.67 0.00 0.82 0.78 -1.29 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 840 P 0.00 4.74 0.00 2.33 2.19 0.00 4.16 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 841 P 0.00 4.34 0.00 2.03 1.92 0.00 3.69 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 842 P 0.00 4.41 0.00 2.04 1.53 0.00 3.54 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.02 0.00 843 P 0.00 4.33 0.00 2.04 2.02 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 844 D 8.86 4.42 0.00 2.86 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 845 C 8.07 4.23 0.00 2.93 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 0.00 846 P 0.00 4.43 0.00 2.18 2.12 0.00 3.65 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.30 0.00 847 T 8.91 3.92 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 1.23 0.00 0.00 848 S 8.07 4.21 0.00 4.02 4.12 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 0.00 849 L 7.79 3.94 0.00 1.85 1.71 0.90 1.00 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 0.00 850 H 8.16 4.08 0.00 3.20 3.42 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 Q 8.52 3.79 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 852 L 7.74 3.95 0.00 1.75 1.73 0.85 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 853 M 7.70 3.15 0.00 0.51 1.62 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.21 0.00 854 L 7.21 3.82 0.00 1.59 1.64 0.92 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 855 D 7.93 4.40 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 C 7.88 4.07 0.00 2.50 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 857 W 6.94 3.73 0.00 2.97 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 0.00 0.00 0.00 0.00 858 Q 7.25 4.25 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 859 K 8.85 4.18 0.00 1.83 1.93 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.54 7.81 860 D 8.12 4.59 0.00 2.84 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 861 R 8.75 4.05 0.00 2.09 2.37 0.00 3.05 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 862 N 8.43 4.41 0.00 2.89 2.93 0.00 0.00 6.96 6.65 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 0.00 863 A 7.86 4.30 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 0.00 864 R 7.41 4.30 0.00 1.89 1.85 0.00 3.42 0.00 0.00 3.64 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.66 0.00 865 P 0.00 4.41 0.00 2.03 1.96 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 866 R 8.46 4.09 0.00 1.84 1.88 0.00 3.13 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 867 F 8.45 4.16 0.00 3.14 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 0.00 868 P 0.00 4.28 0.00 2.17 2.13 0.00 3.57 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 869 Q 7.96 3.97 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 870 V 7.64 3.50 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 0.76 0.00 0.00 0.73 0.00 0.00 871 V 8.02 3.56 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 1.12 0.00 0.00 0.96 0.00 0.00 872 S 8.22 4.10 0.00 4.05 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 0.00 873 A 8.08 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 874 L 7.99 4.00 0.00 1.89 1.76 1.04 1.19 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 0.00 875 D 8.52 4.41 0.00 2.83 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 0.00 876 K 8.19 3.98 0.00 2.12 1.85 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.35 7.81 877 M 7.73 4.06 0.00 2.01 2.29 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.58 0.00 878 I 7.60 3.86 2.01 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 0.57 0.91 0.00 0.00 879 R 7.89 4.14 0.00 2.22 1.99 0.00 3.22 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 0.00 880 N 7.99 5.12 0.00 2.80 2.70 0.00 0.00 6.61 7.50 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 0.00 881 P 0.00 4.36 0.00 2.26 2.32 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 882 A 8.16 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 883 S 8.11 4.15 0.00 4.09 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 0.00 884 L 7.76 4.10 0.00 1.79 1.76 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 885 K 7.88 4.11 0.00 2.14 1.87 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.47 1.28 7.81 886 I 7.33 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 1.18 0.72 0.91 0.00 0.00 887 V 8.01 4.63 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.99 0.00 0.00 888 A 7.96 4.19 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.