NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 504 K 3.1986 8.3101 119.9243 57.3362 33.6746 172.9912 505 A 4.0422 6.3407 119.9807 51.8676 21.5060 173.9315 506 D 4.6491 9.3530 119.2222 53.5837 43.2008 173.2851 507 Y 3.9827 8.0908 117.3924 59.1565 37.1675 170.8873 508 I 4.8716 8.9443 122.5126 59.3036 42.0510 174.2007 509 W 4.6879 9.1265 135.0000 57.3293 31.9358 174.6727 510 F 5.0622 8.8078 130.1460 56.3107 41.5156 174.2740 511 N 3.6041 9.8289 126.3378 54.0465 36.4570 175.9720 512 G 3.7862 5.4770 105.2378 44.6128 0.0000 173.6553 513 E 4.5977 7.0228 119.0147 54.4878 33.2368 175.3964 514 M 4.8982 8.6900 123.4233 54.9772 32.4373 175.6164 515 V 4.5627 8.7268 124.7684 60.6308 34.5101 175.6018 516 R 4.2856 8.7500 125.1702 56.1083 31.0457 177.1529 517 W 4.2242 9.3009 132.2696 60.8190 30.6386 178.0426 518 E 4.1882 8.5069 115.4474 59.3109 28.9527 177.5978 519 D 4.6137 7.9433 116.0183 54.8256 41.3590 177.5464 520 A 4.5661 7.5997 123.4139 50.9232 16.4740 176.5582 521 K 4.7778 8.1197 119.4627 54.0435 35.9545 176.2249 522 V 4.6962 7.9109 119.3341 59.6594 34.7216 174.9976 523 H 4.3057 8.6991 120.9756 56.0759 30.2587 176.7283 524 V 3.7087 7.9467 124.5657 64.1596 31.3762 176.4921 525 M 4.5120 7.7884 119.1924 55.1188 32.2334 175.9814 526 S 4.3309 8.0640 117.2358 58.7206 63.6842 174.3385 527 H 4.0369 9.2906 125.7448 59.8389 29.2134 177.1403 528 A 4.2322 8.2725 123.2559 54.5123 17.8704 179.5122 529 L 3.8883 7.8871 116.7941 57.4158 41.7180 178.2887 530 H 4.3728 7.7973 114.2010 56.1620 29.8367 175.2045 531 Y 4.7521 7.6726 116.3558 56.9082 38.5205 176.3220 532 G 3.9610 8.0506 107.2425 46.7109 0.0000 175.0764 533 T 4.6723 7.3518 110.9645 60.1259 67.2285 173.1657 534 S 4.9311 7.5678 120.4920 57.7392 67.7233 174.2628 535 V 5.1670 9.2807 120.4039 61.4206 34.8756 174.1694 536 F 5.5849 8.8849 121.1805 55.7727 41.5462 172.7833 537 E 4.6734 9.2688 117.0966 54.5640 34.3488 175.2201 538 G 4.0540 8.5767 107.3176 44.6959 0.0000 172.2030 539 I 4.4989 7.7871 126.0050 59.1540 41.6703 174.8557 540 R 4.6794 8.2926 122.5423 54.3824 33.9877 173.8846 541 C 5.1924 8.7144 123.4420 57.9508 33.7898 172.0872 542 Y 4.8732 9.2908 124.0399 56.1184 40.7598 174.3953 543 D 5.0317 8.7148 122.7853 53.8075 42.3117 175.3390 544 S 5.2989 8.5794 122.2813 56.6477 65.7426 173.9008 545 H 4.5447 8.6098 114.3350 57.5196 28.4077 175.9592 546 K 4.3512 8.1366 119.0313 55.9530 32.8551 177.0802 547 G 3.8422 7.9106 108.9848 43.3890 0.0000 170.7526 548 P 5.0299 0.0000 0.0000 63.3664 32.2929 175.8608 549 V 4.9577 9.1477 123.2586 60.0273 35.3905 174.3181 550 V 4.4986 8.9626 125.6233 61.8149 32.5585 174.7083 551 F 4.8005 9.1951 131.9679 58.6363 40.0787 175.6488 552 R 3.5081 8.3335 127.3222 56.8209 28.4186 177.0634 553 H 4.1255 8.0920 119.3341 59.7704 30.2053 175.6961 554 R 3.8509 7.9656 119.6765 59.4000 29.9237 178.0740 555 E 3.8810 8.0714 117.8879 59.8031 29.4969 178.9706 556 H 4.1257 8.0310 115.6367 59.1467 28.8835 177.8797 557 M 4.1437 8.0426 120.3127 58.2323 31.7290 178.6358 558 Q 3.9495 8.3071 120.2000 59.0801 29.1370 178.1581 559 R 3.9046 7.9336 119.8282 58.9009 30.0418 178.2171 560 L 3.9502 7.8890 120.5203 58.5066 42.0972 178.7491 561 H 4.1747 8.2460 115.9057 58.9168 28.7495 177.5887 562 D 4.3676 8.2188 120.8040 57.4123 40.5586 179.0227 563 S 4.1455 8.4830 115.9012 61.5273 62.7463 176.6107 564 A 4.1680 7.9802 123.1570 54.8392 18.0876 179.5938 565 K 3.8546 8.2218 118.3863 59.7199 32.0269 179.1426 566 I 3.5708 7.3912 118.8670 64.0499 37.0927 177.1371 567 Y 4.0693 7.0683 112.9893 57.0379 37.9941 175.8453 568 R 3.9157 7.3388 117.4450 57.0956 28.0740 175.9499 569 F 4.9699 8.1645 117.4558 56.7493 39.4024 173.9726 570 P 4.3194 0.0000 0.0000 62.5091 32.3386 175.3541 571 V 4.5693 8.3055 125.0296 61.0477 32.6874 175.4938 572 S 4.3067 8.9180 123.5024 60.3560 63.5889 174.4945 573 Q 4.4231 7.8799 120.1271 54.8774 29.7998 176.2256 574 S 4.5530 8.4826 117.1292 57.5080 65.7995 175.4343 575 I 3.6308 8.0089 122.2613 64.6600 36.7605 178.4542 576 D 4.3081 7.9383 119.1615 57.2718 40.7230 178.4688 577 E 3.9396 8.0989 119.0497 59.4904 29.5174 179.4548 578 L 3.6831 7.8929 118.9044 57.9295 41.6656 179.5606 579 M 3.9279 8.0225 118.6931 58.2150 31.7342 178.7087 580 E 3.8957 8.2468 118.6082 59.2710 29.6731 179.1353 581 A 3.6431 7.7833 120.8248 55.0226 18.3078 179.2423 582 C 3.9277 7.8790 117.0340 62.6935 31.6067 176.0275 583 R 3.9364 7.8544 119.4723 59.4038 29.6064 178.6897 584 D 4.3623 8.3368 118.9361 57.4763 40.4343 179.1284 585 V 3.7400 7.9298 118.6189 66.0483 31.4906 178.2578 586 I 3.8084 7.7056 119.1219 64.3118 36.8925 178.6835 587 R 3.9361 8.2523 119.0366 59.3990 29.8257 179.4029 588 K 4.0351 8.3755 116.6734 58.8289 32.1390 177.5788 589 N 4.9062 7.9405 113.8632 52.1631 39.0186 174.3280 590 N 4.2272 8.1091 115.2209 54.2812 36.8031 174.1075 591 L 4.7717 7.9836 116.2587 53.5316 43.8289 177.0238 592 T 4.3879 8.5287 110.7056 62.0194 71.0500 173.9311 593 S 4.8439 7.7837 116.5892 56.4601 65.1683 172.7772 594 A 5.1366 8.6163 127.6765 51.5719 23.6859 173.5500 595 Y 4.5618 8.6771 120.6116 55.9120 41.0950 174.4116 596 I 4.5369 7.9973 127.7817 59.7546 39.9982 174.9366 597 R 5.1696 9.1434 126.3327 52.8235 31.9449 171.7513 598 P 5.0530 0.0000 0.0000 61.8134 33.3306 175.0014 599 L 5.2521 9.4829 125.5364 53.7482 45.6873 174.6505 600 I 5.1199 9.2531 128.1347 59.6222 39.4304 174.7966 601 F 5.2892 8.7388 121.5147 54.9642 42.1171 173.9276 602 V 3.8763 8.3538 120.9713 62.3434 31.9829 174.2934 603 G 4.3669 8.4323 122.7334 45.5836 0.0000 174.9980 604 D 5.0540 8.8880 116.6729 53.9971 39.0926 176.0303 605 V 4.6523 7.3638 116.8318 58.9989 34.7500 174.8741 606 G 3.8672 8.4375 110.2263 47.0016 0.0000 172.9618 607 M 4.5109 8.4319 117.2570 54.9740 32.5386 177.0365 608 G 3.7564 7.7318 108.3496 44.9193 0.0000 174.1536 609 V 2.8898 8.2030 122.0693 65.2689 31.5974 176.1488 610 N 4.6028 7.7955 117.7638 51.3197 38.3645 173.2366 611 P 4.0887 0.0000 0.0000 61.3606 32.0011 174.8604 612 P 4.3351 0.0000 0.0000 62.2125 31.9548 175.7719 613 A 4.0540 8.4748 124.0724 54.2437 18.6456 177.9876 614 G 3.9676 8.9731 109.9338 45.1854 0.0000 173.3297 615 Y 4.4352 7.4928 117.8583 56.5358 38.8010 175.1059 616 S 4.5354 8.2871 114.3698 56.5295 66.0555 173.5101 617 T 4.4490 7.4937 112.5311 60.9192 70.4768 173.7107 618 D 4.8298 8.2102 122.7519 53.2075 42.9623 175.7647 619 V 4.8366 9.0062 121.5749 61.3094 34.9728 174.3396 620 I 5.3056 9.1797 127.4700 59.7711 41.7708 174.7765 621 I 5.1205 9.3064 125.4934 59.9494 40.6980 173.9115 622 A 5.2538 8.8995 129.0858 49.9936 21.7773 174.9130 623 A 5.2981 8.8554 121.7436 50.3572 22.5240 175.3421 624 F 5.2154 8.3967 114.3664 54.4346 41.7513 172.0218 625 P 4.8646 0.0000 0.0000 63.7394 31.5469 174.6551 626 W 4.6911 8.4434 130.3455 55.0874 34.2097 174.8625 *634 A 4.3557 8.3258 121.2979 51.0535 18.9281 176.3335 635 L 4.5004 7.1775 121.9835 56.8131 48.1972 174.5347 636 E 4.6887 8.2440 119.1232 54.8544 32.5526 177.7000 637 Q 4.1565 8.3672 115.7171 55.7786 29.7806 176.9288 638 G 4.0536 8.3662 102.2417 44.9638 0.0000 171.4656 639 I 4.8176 8.3135 111.6134 59.0975 41.2921 173.9940 640 D 5.4939 8.8253 121.8281 52.9405 42.6047 175.8545 641 A 5.5191 9.2732 124.9122 50.3031 22.9759 174.5656 642 M 4.8743 8.2128 115.1137 53.1790 35.0725 174.6337 643 V 4.2737 8.6803 121.5457 62.4011 32.0421 176.0252 644 S 4.6338 8.9090 123.9442 58.4126 62.8042 174.2259 645 S 4.3244 9.3402 118.1715 58.7179 63.4890 174.1579 646 W 4.7574 7.8684 121.8857 55.3906 30.3595 175.3488 647 N 5.1785 8.6207 119.6642 52.1489 39.8959 175.0799 648 R 4.4062 8.4928 120.1666 55.2168 31.4272 176.2546 649 A 4.0429 8.7150 121.7971 52.4608 18.4667 177.7557 650 A 4.1596 8.8258 124.1879 51.3883 19.4522 176.7056 651 P 4.2448 0.0000 0.0000 65.5110 31.6384 178.2997 652 N 4.9704 7.9399 114.4981 53.5056 38.6770 173.9649 653 T 4.3105 7.0441 104.4375 60.6574 71.7258 173.8337 654 I 4.3981 7.6197 125.1992 57.6705 39.8323 173.6947 655 P 4.1434 0.0000 0.0000 63.4190 31.3061 177.2026 656 T 4.0891 8.5580 112.8931 62.9839 69.4287 176.2280 657 A 4.0144 7.8758 123.9251 53.4941 18.9822 176.9313 658 A 4.5071 7.2462 118.8343 50.8527 20.3969 178.1781 659 K 4.1885 8.3946 125.5959 54.6797 30.7729 175.1818 660 A 5.3194 7.7717 125.5350 49.7355 22.0720 178.5010 661 G 3.9204 9.2076 108.0429 48.2083 0.0000 176.6299 662 G 3.8532 7.9237 108.1287 47.4989 0.0000 175.3171 663 N 4.5384 8.2187 118.7062 56.3547 38.5799 176.2820 664 Y 4.0439 8.5013 116.6307 59.2579 37.8720 177.8513 665 L 4.0205 7.7157 120.5707 57.4719 41.6363 179.2699 666 S 3.8653 7.8407 112.8075 61.5637 62.3627 176.4590 667 S 3.9878 7.7131 117.2225 61.1488 62.3681 176.4409 668 L 3.9092 7.8628 123.2897 58.0055 41.7528 178.9607 669 L 3.6553 7.5564 118.9114 57.6062 40.9897 179.7377 670 V 3.7719 7.7929 118.2105 66.0620 31.6108 178.3724 671 G 3.6373 8.2657 105.9164 47.7877 0.0000 175.8720 672 S 4.2106 8.3391 116.9616 61.0501 62.5001 176.2327 673 E 3.9207 8.0862 122.9521 58.9320 29.3583 178.6414 674 A 4.0676 7.7427 120.2447 55.4245 18.6184 179.9343 675 R 4.3037 7.9326 117.3729 58.7244 29.8855 179.2351 676 R 4.0674 8.1142 117.8638 58.7886 30.1101 177.1870 677 H 4.9574 7.8392 113.0085 55.2613 29.1924 175.7321 678 G 3.8467 8.0542 109.0884 45.4029 0.0000 173.3810 679 Y 4.6094 8.1104 117.6221 56.8178 39.5405 176.2709 680 Q 4.3108 8.7893 120.3184 58.1776 29.8750 175.9955 681 E 4.7506 8.2290 118.0036 54.9717 33.3736 173.8615 682 G 4.4117 8.9454 111.8098 44.5502 0.0000 172.2260 683 I 4.8285 8.7326 123.9673 59.2605 39.6264 174.6642 684 A 4.9103 9.0093 129.5595 50.6743 21.2491 175.9723 685 L 5.0629 8.2883 120.0987 53.1892 45.1063 176.6838 686 D 4.8810 8.7816 121.0683 52.4925 41.3926 177.3588 687 V 3.7717 8.2439 111.0970 63.9964 31.5768 177.0260 688 N 4.3447 8.1832 115.7832 53.7852 38.8971 175.9732 689 G 3.7715 8.0076 105.8223 45.2046 0.0000 172.9250 690 Y 4.7554 7.9046 117.4502 55.9280 39.6673 175.2177 691 I 4.0087 8.3776 123.7481 61.7662 37.0364 175.2450 692 S 4.5255 8.0244 119.3022 56.4949 63.9213 174.9001 693 E 4.6541 7.0646 114.9350 55.9465 31.6649 175.5027 694 G 3.9528 8.6603 109.0180 44.5799 0.0000 173.3596 695 A 4.1382 8.2343 121.6633 55.0412 18.1317 179.8049 696 G 4.3769 8.2749 102.2647 44.7520 0.0000 171.8532 697 E 4.9287 7.9491 116.0469 54.4182 33.1688 174.2717 698 N 4.8079 9.0443 119.3837 53.3563 40.0897 173.5695 699 L 5.1475 8.1425 122.3569 53.3826 44.7458 175.4673 700 F 4.9073 8.8263 123.3519 55.6408 43.0759 173.8393 701 E 5.2330 9.3587 120.3723 54.6180 34.0116 174.8334 702 V 4.8981 9.0726 122.6889 62.2208 34.3891 174.0594 703 K 4.2998 9.5305 128.0347 57.1493 31.0434 178.6380 704 D 4.6262 9.3594 117.4457 52.9806 39.6995 177.1093 705 G 4.0810 8.1393 104.8450 45.4477 0.0000 171.2175 706 V 4.3388 7.2497 119.6924 60.7564 34.3006 174.1042 707 L 5.1276 8.6073 129.7960 54.0513 43.5932 175.1311 708 F 5.6074 9.5283 124.5602 55.3785 42.8419 174.1684 709 T 4.5129 8.0586 114.5064 60.1128 70.5250 171.0053 710 P 4.9824 0.0000 0.0000 61.3940 32.4051 174.5680 711 P 4.2349 0.0000 0.0000 61.6908 32.5772 177.2388 712 F 4.8366 8.0299 116.0796 60.2828 38.8132 177.5186 713 T 4.2069 7.9068 108.3901 63.2494 68.6260 174.5025 714 S 4.6700 8.1238 119.0191 58.7328 63.0786 174.6409 715 S 3.6891 7.9808 112.7840 58.8827 60.6400 171.3344 716 A 4.7673 7.7635 123.0724 50.1903 20.0900 177.4334 717 L 4.1675 8.6586 125.9569 54.3710 42.7793 176.6042 718 P 4.4772 0.0000 0.0000 62.0052 28.7900 176.1560 719 G 3.7699 8.0589 108.3462 44.9155 0.0000 171.1914 720 I 3.8385 8.2592 124.4054 63.9095 37.2675 178.8939 721 T 4.0321 7.8383 116.5726 66.1749 68.4184 176.5515 722 R 4.1938 8.0615 120.2886 59.7591 30.1774 177.8673 723 D 4.3501 8.1888 117.4358 57.2297 41.1117 177.9969 724 A 3.4306 7.6662 121.1429 55.1036 18.2616 179.6665 725 I 3.5924 7.9499 118.4872 64.5856 37.0711 178.7561 726 I 3.7960 7.8738 120.6706 64.3703 36.9742 178.7127 727 K 4.1536 8.1411 119.3508 59.3651 31.8991 179.5136 728 L 4.1830 8.3716 119.4148 57.6727 41.4510 179.3290 729 A 4.0341 8.4185 121.1641 55.2267 18.3983 179.9019 730 K 3.9910 8.0500 116.6056 59.5828 31.8588 179.5108 731 E 4.1079 7.9510 117.8389 59.1271 29.5141 178.5302 732 L 4.3669 7.7896 116.4587 54.7957 41.8895 177.6928 733 G 3.8912 7.7579 107.0808 45.7465 0.0000 173.1077 734 I 4.3007 7.7413 120.4912 59.6142 38.3849 175.4756 735 E 4.1029 8.7612 128.1319 56.1031 30.8411 175.1719 736 V 4.6911 8.3390 126.3697 61.0874 34.2683 174.5795 737 R 4.3608 8.8744 127.0101 54.3590 32.7992 174.7006 738 E 4.5816 8.7531 126.8823 55.2973 29.7241 174.8619 739 Q 4.5934 8.6194 124.3586 54.3661 32.7023 174.0882 740 V 3.6359 8.2148 120.4211 63.1050 32.2524 175.0097 741 L 4.8642 8.2776 126.7069 52.7763 44.5998 176.5498 742 S 4.8553 8.4682 117.2682 57.5050 64.6695 175.1962 743 R 3.7670 8.4908 120.6859 59.6267 29.7655 178.3731 744 E 4.0030 8.1922 118.1108 59.2910 29.4152 179.1432 745 S 4.0343 7.6561 113.6078 61.4097 62.4923 176.6919 746 L 3.8988 7.2825 121.7099 57.4376 41.3233 178.2568 747 Y 4.5918 7.3898 115.2246 59.3776 38.1996 176.7678 748 L 4.4716 7.6383 117.4575 54.1936 42.9838 176.6919 749 A 4.2138 7.2088 121.8491 52.1995 18.9166 177.2260 750 D 4.7094 8.7771 120.9278 56.8950 41.7308 176.8044 751 E 5.0509 8.0970 115.9099 55.1417 34.5863 174.7719 752 V 5.1532 8.3771 120.6638 60.6741 34.8993 173.1985 753 F 5.4773 8.9141 118.0864 56.0376 41.8693 173.0141 754 M 5.3943 9.5161 119.7666 53.9373 35.1879 175.2444 755 S 5.7351 8.2684 114.6228 55.9827 66.9595 173.1555 756 G 4.2437 8.3052 107.2831 46.3943 0.0000 174.5178 757 T 3.9870 9.0767 117.3253 66.6487 68.7513 176.1784 758 A 3.8549 8.1893 122.1400 54.9730 18.6059 178.4164 759 A 4.4066 8.1208 116.3733 52.6580 20.8478 179.4985 760 E 3.5538 8.8683 115.4962 57.4135 29.0814 176.9697 761 I 4.8802 8.7245 133.0184 60.6824 39.4770 173.8130 762 T 4.6954 8.8132 125.1129 60.8299 70.3211 172.7504 763 P 4.8224 0.0000 0.0000 62.7592 33.0728 175.4056 764 V 4.8633 8.7739 123.1302 61.4706 32.5211 175.5671 765 R 4.5109 9.0811 125.3105 57.6482 30.8945 176.2008 766 S 5.1078 7.6536 112.5563 57.6847 66.2704 174.3235 767 V 4.7883 8.5577 121.5928 62.3433 33.5958 175.3277 768 D 4.5701 10.0826 127.5472 55.5115 38.7182 175.1349 769 G 4.0167 8.8679 106.4995 45.4294 0.0000 174.0321 770 I 4.2443 7.6699 121.9580 59.3784 38.0552 175.1952 771 Q 4.3069 8.6483 127.0957 56.1483 29.7832 175.8329 772 V 3.9082 8.6761 125.5942 62.0413 30.9759 175.3193 773 G 3.6110 9.3027 109.1976 47.2189 0.0000 172.2184 774 E 3.9574 8.4725 126.8281 55.2954 27.8831 175.8571 775 G 3.8843 7.9165 105.2725 46.2954 0.0000 173.1884 776 R 4.7932 7.3133 113.6934 53.6559 34.9129 174.6321 777 C 4.1019 8.2309 119.9147 60.1097 31.9584 173.9296 778 G 3.9358 8.7670 113.2703 45.2142 0.0000 172.7748 779 P 4.3490 0.0000 0.0000 65.7010 31.3201 179.3908 780 V 3.6358 8.2659 116.9407 66.1991 31.4084 178.1748 781 T 3.4395 8.5734 116.0483 66.1131 68.1551 176.4839 782 K 3.8688 8.0075 121.4856 59.6299 32.3016 178.8923 783 R 3.9098 7.8681 118.2319 59.5889 29.9993 179.2179 784 I 3.7238 7.6513 119.3724 64.2427 36.9176 178.6015 785 Q 3.7634 8.0714 119.0451 58.9198 28.5791 178.7177 786 Q 4.1007 8.3380 118.9595 59.0722 28.5704 178.8384 787 A 4.0368 7.8415 120.5045 54.8928 18.5332 179.3127 788 F 4.0033 8.1696 119.2072 61.5769 39.7128 177.5254 789 F 4.7834 8.4413 117.2719 59.8445 38.7616 177.8232 790 G 3.9431 8.1304 106.8962 46.2896 0.0000 175.6997 791 L 3.9971 7.0298 120.4883 57.1638 41.7038 178.4443 792 F 4.7436 7.3384 115.6086 57.8424 38.8499 176.7404 793 T 4.4449 7.8678 107.9780 60.9358 70.1261 175.8111 794 G 3.7361 8.0220 110.4151 45.2418 0.0000 174.4061 795 E 3.9739 7.9658 118.3752 58.9420 29.7367 177.2096 796 T 4.4001 7.6819 116.5459 61.3138 69.5893 173.7691 797 E 4.0240 8.5390 128.1900 56.1700 30.1335 176.8892 798 D 4.6416 8.2916 126.2903 53.2596 39.6633 176.3784 799 K 3.4462 7.1488 122.3511 57.3337 32.4657 178.0166 800 W 4.3194 7.5577 116.4409 55.8772 29.9984 175.8050 801 G 3.7949 7.5390 105.9058 46.2997 0.0000 174.6816 802 W 4.5725 8.9903 120.4726 58.0183 30.6724 176.7968 803 L 4.9515 8.2161 120.2488 53.4935 42.1354 175.7419 804 D 4.8762 8.6445 125.0462 52.3977 42.7644 175.6369 805 Q 4.3913 8.7076 125.7967 56.0973 28.9043 176.8593 806 V 3.6792 8.3635 123.9289 66.0625 32.3327 176.2272 807 N 4.6571 8.2266 118.8886 52.4837 37.1674 174.9112 808 Q 4.2727 8.1548 119.9762 56.7179 28.0062 174.3948 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 504 K 8.31 3.20 0.00 0.79 0.87 0.00 1.27 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.04 7.81 505 A 6.34 4.04 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 0.00 506 D 9.35 4.65 0.00 2.35 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 507 Y 8.09 3.98 0.00 3.23 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 508 I 8.94 4.87 1.83 0.00 0.00 -0.35 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 0.74 0.87 0.00 0.00 509 W 9.13 4.69 0.00 3.51 3.19 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 0.00 510 F 8.81 5.06 0.00 2.94 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 0.00 511 N 9.83 3.60 0.00 2.54 2.63 0.00 0.00 7.27 8.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 512 G 5.48 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 513 E 7.02 4.60 0.00 1.74 1.71 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 2.08 2.03 0.00 514 M 8.69 4.90 0.00 1.76 1.95 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 515 V 8.73 4.56 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 1.02 0.00 0.00 1.01 0.00 0.00 516 R 8.75 4.29 0.00 2.15 2.13 0.00 3.28 0.00 0.00 2.95 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.62 0.00 517 W 9.30 4.22 0.00 3.59 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 E 8.51 4.19 0.00 2.05 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 2.37 2.53 0.00 519 D 7.94 4.61 0.00 2.86 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 0.00 520 A 7.60 4.57 1.13 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 0.00 0.00 521 K 8.12 4.78 0.00 1.76 1.71 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.32 1.40 7.81 522 V 7.91 4.70 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.25 0.00 0.00 523 H 8.70 4.31 0.00 3.27 3.27 0.00 5.87 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 524 V 7.95 3.71 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 0.65 0.00 0.00 0.86 0.00 0.00 525 M 7.79 4.51 0.00 2.05 2.28 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 2.61 2.55 0.00 526 S 8.06 4.33 0.00 3.98 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 0.00 527 H 9.29 4.04 0.00 3.41 3.48 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 528 A 8.27 4.23 1.51 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 0.00 0.00 529 L 7.89 3.89 0.00 1.84 1.55 0.90 0.87 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 0.00 530 H 7.80 4.37 0.00 2.12 2.29 0.00 5.83 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 Y 7.67 4.75 0.00 2.97 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 0.00 532 G 8.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 T 7.35 4.67 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 1.46 0.00 0.00 534 S 7.57 4.93 0.00 4.10 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 0.00 535 V 9.28 5.17 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.17 0.00 0.00 536 F 8.88 5.58 0.00 3.19 2.97 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 0.00 537 E 9.27 4.67 0.00 1.90 1.78 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 2.19 2.53 0.00 538 G 8.58 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 0.00 539 I 7.79 4.50 1.56 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.57 0.71 0.00 0.00 540 R 8.29 4.68 0.00 1.53 1.09 0.00 2.21 0.00 0.00 2.84 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.09 0.00 541 C 8.71 5.19 0.00 2.86 2.66 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 0.00 542 Y 9.29 4.87 0.00 2.65 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 0.00 0.00 0.00 0.00 543 D 8.71 5.03 0.00 2.71 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 0.00 544 S 8.58 5.30 0.00 4.40 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 0.00 545 H 8.61 4.54 0.00 3.28 3.51 0.00 5.70 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 K 8.14 4.35 0.00 1.70 1.99 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.18 0.82 7.81 547 G 7.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 P 0.00 5.03 0.00 2.16 2.25 0.00 3.68 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 2.11 2.01 0.00 549 V 9.15 4.96 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.13 0.00 0.00 550 V 8.96 4.50 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 0.71 0.00 0.00 0.85 0.00 0.00 551 F 9.20 4.80 0.00 3.40 3.26 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 0.00 552 R 8.33 3.51 0.00 1.43 1.56 0.00 2.21 0.00 0.00 2.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 553 H 8.09 4.13 0.00 3.19 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 554 R 7.97 3.85 0.00 1.88 1.90 0.00 3.24 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 555 E 8.07 3.88 0.00 2.09 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 2.25 2.40 0.00 556 H 8.03 4.13 0.00 3.37 3.31 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 557 M 8.04 4.14 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.84 0.00 558 Q 8.31 3.95 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 559 R 7.93 3.90 0.00 1.97 2.11 0.00 3.04 0.00 0.00 2.98 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 560 L 7.89 3.95 0.00 2.04 1.83 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 561 H 8.25 4.17 0.00 3.44 3.35 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 562 D 8.22 4.37 0.00 2.81 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 0.00 563 S 8.48 4.15 0.00 4.02 3.98 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 0.00 564 A 7.98 4.17 1.53 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 0.00 565 K 8.22 3.85 0.00 1.91 1.96 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.46 7.81 566 I 7.39 3.57 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 0.49 0.00 0.00 567 Y 7.07 4.07 0.00 1.88 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 0.00 0.00 0.00 568 R 7.34 3.92 0.00 2.04 2.12 0.00 3.18 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 569 F 8.16 4.97 0.00 2.97 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 0.00 570 P 0.00 4.32 0.00 1.80 1.79 0.00 3.29 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.77 0.00 571 V 8.31 4.57 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.99 0.00 0.00 572 S 8.92 4.31 0.00 4.04 3.98 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 0.00 573 Q 7.88 4.42 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.07 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 574 S 8.48 4.55 0.00 4.02 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 0.00 575 I 8.01 3.63 1.79 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.01 0.84 0.00 0.00 576 D 7.94 4.31 0.00 2.65 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 577 E 8.10 3.94 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 578 L 7.89 3.68 0.00 1.79 1.60 1.00 0.65 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 0.00 579 M 8.02 3.93 0.00 1.85 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.15 0.00 580 E 8.25 3.90 0.00 2.17 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 2.30 2.45 0.00 581 A 7.78 3.64 0.17 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 0.00 582 C 7.88 3.93 0.00 3.05 3.16 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 0.00 583 R 7.85 3.94 0.00 2.07 1.97 0.00 3.35 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.97 0.00 584 D 8.34 4.36 0.00 2.90 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 0.00 585 V 7.93 3.74 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 1.20 0.00 0.00 1.18 0.00 0.00 586 I 7.71 3.81 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.97 0.00 0.00 587 R 8.25 3.94 0.00 1.99 2.00 0.00 3.15 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 1.68 1.69 0.00 588 K 8.38 4.04 0.00 1.82 1.78 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.60 7.81 589 N 7.94 4.91 0.00 2.95 2.97 0.00 0.00 7.10 7.66 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 0.00 590 N 8.11 4.23 0.00 2.86 2.91 0.00 0.00 6.84 7.53 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 0.00 591 L 7.98 4.77 0.00 1.67 1.62 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 592 T 8.53 4.39 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 0.00 593 S 7.78 4.84 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 594 A 8.62 5.14 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 0.00 595 Y 8.68 4.56 0.00 2.89 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 596 I 8.00 4.54 1.59 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.57 0.81 0.00 0.00 597 R 9.14 5.17 0.00 2.15 2.01 0.00 3.35 0.00 0.00 3.72 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 598 P 0.00 5.05 0.00 2.16 1.96 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 599 L 9.48 5.25 0.00 1.70 1.62 0.61 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 600 I 9.25 5.12 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 2.43 2.40 0.00 740 V 8.21 3.64 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 -0.11 0.00 0.00 0.69 0.00 0.00 741 L 8.28 4.86 0.00 1.52 1.40 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 742 S 8.47 4.86 0.00 4.17 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 0.00 743 R 8.49 3.77 0.00 1.84 1.92 0.00 3.25 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 744 E 8.19 4.00 0.00 2.09 2.07 0.00 0.00 0.00 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 2.53 0.00 745 S 7.66 4.03 0.00 3.98 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 0.00 746 L 7.28 3.90 0.00 1.12 1.51 0.73 0.79 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 0.00 747 Y 7.39 4.59 0.00 3.07 2.91 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 0.00 748 L 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0.00 0.00 1.01 0.00 0.00 773 G 9.30 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 0.00 774 E 8.47 3.96 0.00 2.21 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 0.00 2.29 2.25 0.00 775 G 7.92 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 0.00 0.00 0.00 776 R 7.31 4.79 0.00 1.66 1.82 0.00 3.20 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 777 C 8.23 4.10 0.00 3.18 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 0.00 778 G 8.77 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 779 P 0.00 4.35 0.00 2.19 2.13 0.00 3.88 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 2.14 2.17 0.00 780 V 8.27 3.64 2.40 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 1.08 0.00 0.00 0.97 0.00 0.00 781 T 8.57 3.44 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 782 K 8.01 3.87 0.00 2.14 1.80 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.55 7.81 783 R 7.87 3.91 0.00 2.04 1.97 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 784 I 7.65 3.72 1.55 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.67 0.70 0.00 0.00 785 Q 8.07 3.76 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 786 Q 8.34 4.10 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 787 A 7.84 4.04 1.40 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 0.00 0.00 788 F 8.17 4.00 0.00 2.98 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 F 8.44 4.78 0.00 3.22 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 0.00 790 G 8.13 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 791 L 7.03 4.00 0.00 0.27 1.09 0.70 1.33 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 0.00 792 F 7.34 4.74 0.00 3.23 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 0.00 793 T 7.87 4.44 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 1.29 0.00 0.00 794 G 8.02 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 0.00 795 E 7.97 3.97 0.00 1.95 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 2.30 2.32 0.00 796 T 7.68 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 797 E 8.54 4.02 0.00 1.82 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 798 D 8.29 4.64 0.00 2.80 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 0.00 799 K 7.15 3.45 0.00 0.79 0.94 0.00 0.97 0.00 0.00 1.22 0.00 0.00 2.71 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.13 1.02 7.81 800 W 7.56 4.32 0.00 1.96 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 0.00 801 G 7.54 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 802 W 8.99 4.57 0.00 3.44 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 803 L 8.22 4.95 0.00 1.74 1.76 1.03 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 804 D 8.64 4.88 0.00 2.91 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 0.00 805 Q 8.71 4.39 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 806 V 8.36 3.68 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.98 0.00 0.00 807 N 8.23 4.66 0.00 2.77 2.80 0.00 0.00 6.75 7.69 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 0.00 808 Q 8.15 4.27 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.65 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.