NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 487 G 3.9176 8.3549 109.7325 44.9983 0.0000 173.5505 488 K 4.2608 8.1992 120.5336 54.5236 32.8605 175.9381 489 S 4.3144 9.0827 120.1124 58.9084 64.5016 174.4876 490 T 3.9942 8.4849 120.4872 66.0659 68.6325 175.2604 491 T 4.4817 7.6403 117.9879 61.9512 69.5287 174.1964 492 L 3.9046 8.3507 126.9722 56.1271 42.2585 176.9994 493 F 5.0035 7.3512 114.0221 55.8989 42.9351 173.3644 494 S 4.6598 8.7547 116.2474 57.2776 65.7528 175.1708 495 R 4.1774 8.5074 115.7688 58.2178 29.0590 176.6842 496 H 4.9123 7.8807 114.8407 55.6345 29.6141 174.9120 497 T 3.8889 7.7208 117.4525 64.0123 68.7949 173.3988 498 K 4.9518 8.5640 124.2021 54.5500 35.3445 174.9263 499 A 5.0670 9.1950 125.3840 50.2724 22.9713 174.6900 500 I 4.8231 8.6103 120.6668 59.7553 39.6566 174.9407 501 V 4.9060 8.4110 126.6782 61.0383 33.1893 174.5365 502 W 4.7632 9.5444 135.0000 56.1260 32.1828 173.3942 503 G 4.1758 8.4536 114.6766 45.2231 0.0000 176.2477 *505 Q 3.9572 8.9923 122.0481 55.5913 29.5700 175.7236 506 T 4.1615 7.5189 111.6937 64.9213 69.3801 176.5342 507 R 3.9066 7.9696 120.8715 59.0450 29.9388 178.2561 508 A 3.9231 7.7057 119.1754 55.1079 18.5656 179.1356 509 V 3.5442 7.5876 115.6051 66.3103 31.7753 177.7812 510 Q 4.3891 8.5456 119.3541 58.8142 28.8533 178.6433 511 G 3.9385 7.8721 104.3318 45.3230 0.0000 175.1571 *513 L 4.7226 7.8855 122.6754 54.7245 44.0071 178.9851 514 D 4.5022 8.5155 118.4406 57.3457 40.7079 178.6753 515 F 4.1807 8.4726 120.9436 61.5413 39.6009 176.6291 516 D 4.4996 8.5919 118.0278 57.7865 40.6298 178.3493 517 Y 3.4471 8.6898 120.0779 60.6197 38.6293 178.2131 518 V 3.4009 7.6663 117.2343 65.3818 31.6712 176.8330 519 C 4.4194 7.4743 115.6423 58.7289 28.2507 173.3670 520 S 3.5420 7.7714 115.7458 59.0631 60.5739 172.8322 521 R 4.2147 7.5923 117.3700 56.5005 30.5060 177.2679 522 D 4.7051 8.7699 120.4480 57.1296 41.2074 176.6992 523 E 4.3952 7.7648 115.3438 53.4780 33.6201 173.1004 524 P 3.7162 0.0000 0.0000 63.2086 31.8554 176.7814 525 S 4.6658 9.3811 115.8856 59.3446 64.6465 173.4363 526 V 4.6916 7.6449 120.7976 61.5221 31.7981 174.8728 527 A 4.3323 8.8629 130.5592 53.9347 20.0113 176.6582 528 A 4.6153 7.2850 115.5668 52.6243 24.5187 174.9911 *530 V 4.2990 8.0964 112.9825 63.5707 33.4537 175.7381 531 Y 4.3770 8.7219 129.2465 56.2350 41.0300 173.2562 532 P 4.6261 0.0000 0.0000 63.8571 31.7822 177.0009 533 F 4.4240 6.5778 116.6448 58.0103 39.1322 174.6958 534 T 4.6882 7.1451 109.7989 59.7446 71.7735 173.2262 535 G 3.9878 8.3157 109.3339 45.1813 0.0000 173.0121 536 D 5.1695 8.8208 120.0737 53.8849 41.9791 176.0655 537 H 4.3763 7.2451 113.9122 56.0813 31.1104 172.9409 538 K 4.9837 8.4880 116.5054 54.6881 35.4439 175.7492 539 Q 4.5447 8.7433 123.1171 54.1012 32.4040 173.9969 540 K 4.6166 8.1823 126.6995 55.6212 33.3042 175.4409 541 F 4.9971 9.0610 125.1199 56.0357 44.1383 172.8586 542 Y 5.0319 9.2160 117.4100 56.3193 39.8914 176.6772 543 W 4.9125 9.1776 135.0000 55.8868 30.9838 177.3128 544 G 2.6768 7.4558 116.7842 46.0093 0.0000 173.5226 545 H 4.5540 8.3583 120.5215 56.4304 29.4695 175.4702 546 K 4.2583 7.8164 121.0396 56.1036 32.8240 174.3965 547 E 5.0050 8.6570 125.2805 54.5319 31.2000 174.8171 548 I 4.8276 8.7306 119.4333 59.2258 41.8608 173.6875 549 L 5.2331 8.4960 122.0836 53.0626 44.3541 175.8787 550 I 4.6348 8.7961 124.7694 58.6545 39.3204 173.4663 551 P 4.6337 0.0000 0.0000 62.6606 33.1233 175.1940 552 V 4.5875 8.5517 122.5716 61.2451 33.8789 174.1262 553 F 5.0551 8.7317 126.2562 55.7886 41.2098 177.0519 554 K 4.4638 9.3255 123.3405 58.0250 32.6097 175.8174 555 N 5.2842 7.8037 116.6250 51.8190 40.9203 174.1751 *557 A 4.1655 8.5934 120.4104 53.3618 20.8337 178.0842 558 D 4.3243 7.7730 114.9112 57.6008 41.1012 179.4750 559 A 2.6675 7.2480 117.4638 52.6835 17.8537 178.7098 *561 R 4.2234 7.9947 120.3610 57.6498 31.5673 176.9660 562 K 4.1208 7.8338 115.1607 58.3771 32.9264 176.8703 563 H 5.2068 7.9836 114.9822 52.1186 28.8537 172.4401 564 P 4.3903 0.0000 0.0000 64.9001 31.7859 178.3110 565 E 4.0890 8.0613 116.6840 57.8334 30.1593 176.5628 566 V 3.9802 7.6222 121.2057 63.0225 31.9819 174.8425 567 D 5.4531 8.6309 125.0197 51.7496 41.2570 174.9751 568 V 4.9177 7.6954 118.6711 61.3868 35.2803 173.5606 569 L 5.2254 8.9802 129.3320 53.3668 45.0492 174.7850 570 I 4.6180 9.0240 127.5517 59.8514 39.4018 174.2978 571 N 5.0171 9.1566 128.0890 52.0787 39.6295 174.2180 572 F 4.6709 9.3137 124.5109 57.1763 39.6016 176.4546 573 A 4.4492 8.6233 122.9265 52.4471 18.7349 178.3810 574 S 4.5764 8.6946 114.9937 57.4695 64.0186 175.3578 575 L 4.0744 8.3834 120.6681 58.5542 40.2129 178.6999 576 R 4.1561 7.5336 117.4660 58.0540 30.4516 177.2238 577 S 4.6922 8.1036 112.0892 58.1848 64.5812 176.0017 578 A 3.7955 7.9105 124.0888 55.1427 18.4681 179.0655 579 Y 4.0007 7.9647 115.8589 60.9536 39.3115 176.6198 580 D 4.3424 8.3136 118.4675 57.3297 41.3681 178.3092 581 S 4.1424 7.7486 113.1953 61.5773 62.9105 176.2325 582 T 4.0969 7.2090 115.6969 63.7392 67.6426 175.0931 *584 E 4.4122 8.2668 124.0650 56.6838 31.4016 178.0587 585 T 4.0445 7.7337 116.9821 63.5116 67.9204 175.2147 *587 N 4.5028 8.1730 117.6449 52.6871 40.7074 174.1004 588 Y 4.3937 7.9997 117.0107 55.8650 38.7662 176.3720 589 A 4.2330 8.5590 128.6699 53.9105 19.0910 178.3378 590 Q 4.0188 8.1257 114.2925 58.7135 28.9277 176.0597 591 I 4.2536 7.6058 119.5731 61.2092 36.6289 175.4163 592 R 4.4358 8.6272 125.5750 57.0689 32.0453 176.8484 593 T 5.0506 7.7440 115.0321 61.6460 72.7250 172.9117 594 I 5.0678 8.8451 126.2837 59.4596 40.6993 174.1694 595 A 5.0317 8.8311 128.9834 50.5616 21.1953 175.6657 596 I 4.4921 8.5940 124.0775 59.8172 38.7150 176.7354 597 I 4.0828 8.7217 128.8886 63.4748 38.2594 176.7543 598 A 4.1245 8.0662 123.0480 52.6463 19.0641 176.3414 599 E 4.4939 8.8226 122.2099 56.2576 31.1020 175.9608 600 G 4.0038 8.9009 112.7962 45.4423 0.0000 173.0875 601 I 3.9868 7.5015 120.4136 59.6462 37.8399 174.6493 602 P 4.1996 0.0000 0.0000 63.1367 32.7896 176.7955 603 E 4.0170 8.9871 121.3537 59.8946 29.6547 179.7239 604 A 4.0840 8.0128 119.7740 54.8066 18.4367 179.5552 605 L 3.8278 7.7702 117.5051 58.1438 41.7676 179.4418 606 T 4.0271 8.0235 115.7322 66.6560 68.2480 176.8974 607 R 3.8799 8.2611 120.1618 59.1757 30.0477 179.2539 608 K 4.0442 7.8166 117.3915 59.2128 31.9804 179.4193 609 L 4.0083 8.1574 119.4129 57.8836 41.5721 179.5888 610 I 3.6907 7.9689 119.7872 64.1638 37.0321 178.3066 611 K 3.8467 8.2253 120.5896 59.4739 31.9986 178.7381 612 K 4.0567 8.1701 119.5405 59.3409 32.1308 178.4876 613 A 3.9627 8.3332 121.4823 55.4780 18.3120 179.3493 614 D 4.3155 8.5159 117.6783 57.5949 40.6171 179.0688 615 Q 3.9893 7.8927 117.7139 58.6217 28.8593 178.3272 616 K 4.3247 8.0828 116.8915 56.1081 32.6629 177.7636 617 G 3.8206 7.6036 107.4385 45.6098 0.0000 172.5266 618 V 4.3246 7.5308 119.1934 61.6873 32.8354 175.4542 619 T 4.4113 8.7010 124.8424 62.6953 69.9834 173.5968 620 I 4.8343 8.3631 127.1155 59.6693 39.3984 174.9387 621 I 4.2362 8.6369 128.6761 61.7251 39.1404 173.9969 622 G 3.7085 8.7436 113.7479 43.6066 0.0000 170.1732 623 P 5.1298 0.0000 0.0000 62.6830 33.1438 174.9876 624 A 3.8653 8.5164 117.7789 53.8185 16.4695 176.7510 625 T 4.6975 7.4636 112.8683 60.5372 71.1151 174.8722 626 V 3.6716 8.3023 125.9439 62.9799 33.2158 175.8389 627 G 3.8634 8.5408 109.7939 43.2897 0.0000 175.6676 628 G 4.4134 5.3800 111.2728 45.2473 0.0000 171.2002 629 I 4.4734 7.8544 118.4498 59.3209 41.1217 173.5727 630 K 4.5257 8.9845 128.2069 53.1398 32.5224 172.7614 631 P 4.9907 0.0000 0.0000 63.4206 31.6852 177.3662 632 G 3.9932 9.1110 110.1397 45.8503 0.0000 173.0268 633 C 4.7520 8.3021 114.3559 60.3739 30.6812 173.8929 634 F 4.9425 7.7577 118.5728 57.1690 42.3388 172.0326 635 K 4.1456 7.1052 125.2958 54.3102 35.2029 175.4014 636 I 3.6487 8.1569 128.6704 59.7631 37.9535 176.9575 637 G 3.9408 8.6967 118.5955 47.2713 0.0000 173.3259 638 N 4.6885 8.9427 122.5749 53.2667 38.5617 174.6111 639 T 3.9530 7.5921 116.7962 65.1167 68.7689 174.7207 640 G 3.8567 8.8259 113.8595 44.2505 0.0000 174.7219 641 G 3.7928 7.8406 108.7987 46.4161 0.0000 175.0079 *643 L 4.4184 8.5139 120.4019 54.4995 44.9494 178.5177 644 D 4.3612 8.3318 117.2936 57.7034 40.9116 178.1069 645 N 4.3678 8.0977 116.5426 56.5560 39.1399 176.5250 646 I 3.8248 7.9068 120.7911 64.6690 37.2064 178.2306 647 L 4.2574 8.7383 119.5970 57.8444 41.3291 179.3333 648 A 4.1063 7.9570 119.5531 54.7001 18.3354 178.8753 649 S 4.5747 7.8196 112.0270 56.2285 63.8061 174.3091 650 K 3.4267 7.9299 120.5740 57.4642 30.2125 176.0840 651 L 4.4901 8.0839 115.7932 55.3505 41.6353 178.2461 652 Y 4.4038 7.2615 117.1787 57.2831 38.7234 175.0226 653 R 4.6585 6.7762 114.7797 53.8767 32.6262 173.2608 654 P 4.5076 0.0000 0.0000 62.7810 32.3975 176.5977 655 G 4.4855 8.3361 109.1726 45.5266 0.0000 173.2038 656 S 4.8837 8.5561 117.2438 58.2475 64.9815 173.7621 657 V 4.5502 7.9220 121.3735 61.1860 33.1255 174.5473 658 A 5.0525 8.3520 129.6425 50.7734 21.4438 174.9292 659 Y 6.1067 8.4202 116.8860 55.1303 42.1797 174.3763 660 V 5.3598 8.5205 119.2156 60.5440 35.4223 174.1427 661 S 5.0518 8.9329 116.1319 57.7023 66.8861 175.2809 662 R 4.1230 9.0780 118.4625 59.2671 30.8823 177.6604 663 S 4.7229 8.1669 113.7410 57.8233 64.0742 174.5867 664 G 3.9007 8.7185 112.9663 47.7267 0.0000 175.9399 665 G 3.5543 8.1866 106.0410 47.3614 0.0000 174.7896 *667 S 4.1749 8.1214 116.7547 58.3879 64.5033 175.7334 668 N 4.3148 8.0659 118.0708 56.6371 38.5499 176.5009 669 E 4.0152 7.8004 120.5272 59.1835 29.6314 178.8179 670 L 3.8801 7.5952 118.6549 57.5071 41.6199 178.9067 671 N 4.3077 8.1057 116.7004 56.3266 38.3898 176.9279 672 N 4.2678 8.0898 118.1746 56.7720 38.8840 176.9892 673 I 3.6375 8.0639 121.5547 64.5085 37.2695 178.5878 674 I 3.5502 7.9852 121.2518 64.2619 36.5534 178.6421 675 S 4.1431 8.2243 114.8680 60.8100 62.7222 176.0049 676 R 4.2144 7.5547 120.1561 57.0674 30.2217 176.7596 677 T 4.4945 7.2474 106.3760 61.1064 70.3635 173.2315 678 T 2.8854 7.1971 110.6879 59.9172 71.2891 173.0324 679 D 4.3018 6.7445 120.3536 53.9417 39.9394 175.0144 680 G 3.6795 7.7785 106.6436 43.7559 0.0000 173.0442 681 V 4.1376 8.2320 118.6570 63.4148 32.1516 175.6395 682 Y 4.1893 9.1698 129.3825 59.4501 39.7521 175.1881 683 E 4.8438 7.8693 118.1763 54.8981 33.4909 173.7197 684 G 3.2500 9.0900 112.4581 43.9753 0.0000 171.5201 685 V 4.8328 8.3411 122.4488 60.7096 35.4012 173.9708 686 A 5.2346 8.7314 129.2656 50.2850 19.9962 176.5256 687 I 3.8888 8.9845 116.7265 62.2197 38.3257 177.5372 688 G 4.1768 7.8439 107.3142 46.9358 0.0000 173.4685 689 G 3.9501 8.1428 105.3213 45.1070 0.0000 173.7791 690 D 4.5483 7.6699 119.4681 53.3910 41.7012 176.4459 691 R 3.6922 8.3420 120.7563 58.8755 29.9592 175.9698 692 Y 4.7298 7.0534 116.0452 55.1607 38.1883 173.3508 693 P 4.4728 0.0000 0.0000 61.8342 32.3124 177.3563 694 G 3.8433 9.1077 111.7521 47.9883 0.0000 174.2292 695 S 4.7990 7.7688 112.0035 56.3574 66.0657 173.1214 696 T 4.4715 8.5487 112.2710 59.7116 70.9873 175.6091 697 F 4.5674 7.7747 113.1383 59.2722 39.0154 177.3568 *699 D 4.4756 8.2223 121.8883 54.8462 42.5466 177.7369 700 H 3.9213 7.7427 116.0704 58.4303 28.5455 177.9780 701 V 3.5667 7.8817 120.2198 65.8177 31.2886 178.0853 702 L 3.9503 7.7511 118.1598 57.8875 41.3573 179.2596 703 R 3.9011 7.2646 116.2123 59.7884 30.4467 178.4238 704 Y 4.5413 7.9801 116.5157 61.1800 37.6091 178.3126 705 Q 4.0858 8.3365 120.0609 58.7479 29.1494 177.1298 706 D 5.0317 7.7447 117.2431 53.2448 41.3297 176.2155 707 T 4.4639 7.4180 117.9234 61.1137 69.3532 173.0587 708 P 4.1760 0.0000 0.0000 65.5890 31.4556 178.5608 709 G 3.5678 7.9463 105.1375 47.7886 0.0000 173.5180 710 V 3.4633 7.1608 120.5269 62.2721 31.7749 175.5537 711 K 4.3684 8.4514 125.5394 56.7433 33.1599 176.3061 *713 I 4.1796 7.4935 121.2808 61.1204 39.0315 174.5006 714 V 4.8894 9.0397 126.0165 61.0568 34.6136 174.2193 715 V 4.5981 9.0098 127.6365 61.0107 34.3453 173.8598 716 L 4.5065 8.4713 131.0382 53.9765 42.5673 175.6875 717 G 4.2902 8.5081 116.4949 46.1772 0.0000 170.1857 718 E 5.2303 9.0191 118.3337 54.7603 32.9928 175.9732 719 I 3.7013 8.0143 125.7134 62.8001 38.7131 176.1402 720 G 3.7526 9.2936 116.3264 46.7985 0.0000 174.7475 721 G 3.9790 8.8375 113.3345 45.2020 0.0000 173.1099 722 T 4.8032 8.0049 104.8196 61.1254 69.4460 175.4770 723 E 3.9528 8.4323 124.9832 60.3120 29.5701 178.6194 724 E 4.1513 8.1556 117.4784 59.2414 29.5199 178.6353 725 Y 4.2280 7.9518 116.9336 60.6074 37.8411 178.3242 726 K 4.1282 8.2663 119.8075 59.1790 32.0538 179.4306 727 I 3.7275 7.6739 120.1197 64.5008 36.9911 177.7719 728 C 4.0150 8.2156 117.0917 63.3140 28.0231 176.4668 729 R 4.0412 8.2067 119.2862 59.2016 29.6551 179.3384 730 G 3.6954 8.1901 105.5123 47.8848 0.0000 175.8696 731 I 4.0382 7.7944 123.4944 63.6500 36.9653 178.7071 732 K 4.0236 8.0522 118.1781 59.4170 32.0007 178.6513 733 E 4.2531 8.6674 116.6651 56.5987 29.5826 177.8992 734 G 3.9393 7.8629 107.2505 45.6487 0.0000 174.7828 735 R 3.9738 7.9850 120.6749 57.9541 30.0827 176.3944 736 L 4.8989 8.0192 119.0704 53.1593 42.9893 176.7804 737 T 4.5179 8.9773 113.1699 61.4461 70.6786 174.9145 738 K 4.2821 8.1183 120.5180 55.0031 32.8423 174.8432 739 P 4.5492 0.0000 0.0000 63.1544 31.9535 175.9378 740 I 4.8479 8.6017 122.8189 59.5319 40.6164 174.2982 741 V 5.0124 9.1698 127.1678 61.4888 33.6123 174.0504 742 C 5.8239 8.9593 126.8277 57.0046 35.5698 172.2600 743 W 5.2179 8.7328 134.4191 55.9222 33.8818 173.0602 744 C 4.7734 8.2147 125.7629 58.0216 28.8938 174.0051 745 I 3.9262 8.2295 118.1832 60.4462 39.2567 176.5046 746 G 3.8084 8.8183 109.4803 45.8329 0.0000 175.8684 747 T 3.8323 7.9186 111.6733 63.9629 68.8287 174.4010 748 C 4.3149 7.9574 119.3790 58.9254 31.7789 173.2288 749 A 4.1340 7.5361 122.2820 53.5098 16.1258 176.5916 750 T 4.2951 7.7357 109.4099 60.1033 69.8965 173.6359 *767 Q 4.0333 8.1800 128.1296 55.6633 30.1798 175.7437 768 A 4.0361 8.6100 126.2832 55.4370 18.4927 180.0494 769 S 4.3202 7.9680 108.2144 60.5788 63.5258 174.7057 770 E 4.5084 8.2924 120.5298 57.1990 29.9170 176.6330 771 T 4.3310 7.5589 110.7305 61.1187 70.9384 175.2472 772 A 3.8045 8.4081 124.6161 55.2355 18.4714 180.0486 773 V 3.4518 7.7894 115.9824 66.3376 31.5328 177.9122 774 A 4.0441 7.9921 120.1032 55.0858 18.1868 179.7708 775 K 3.6632 8.1094 116.8779 59.6004 32.1341 179.1154 776 N 4.1594 8.5155 117.0620 56.5315 38.4729 177.2604 777 Q 3.9509 8.1746 120.4115 59.1536 29.0535 178.0651 778 A 4.0888 8.2376 121.9154 55.0155 18.4516 179.5929 779 L 3.9142 8.1235 117.7562 57.7004 41.6079 179.5628 780 K 4.1534 7.8821 120.7789 59.2003 31.9860 178.7133 781 E 3.9257 8.0581 116.8747 59.0006 29.4197 178.4255 782 A 4.3220 7.4917 118.6046 52.5093 18.7796 178.0013 783 G 3.7348 7.9645 106.1063 44.7501 0.0000 173.8327 784 V 3.7508 7.6853 120.1411 62.1460 33.0966 175.5472 785 F 4.4460 9.0875 126.3833 57.7615 39.2975 174.0806 786 V 5.1776 8.4819 124.0535 59.3644 32.6629 173.7993 787 P 4.6015 0.0000 0.0000 62.1092 32.2233 177.4694 788 R 4.1391 8.4071 118.0850 59.0372 30.2821 176.7047 789 S 2.9760 6.6620 111.0218 56.7674 65.9380 176.6488 790 F 3.1939 7.4179 122.4122 61.0364 39.0072 176.5432 791 D 4.3154 7.4997 117.9108 56.3602 41.2406 176.4322 792 E 4.4496 7.7613 117.1684 55.8830 30.3606 177.3461 793 L 3.7634 7.7670 123.7498 58.0660 41.8628 179.2692 794 G 3.4728 7.6422 105.0172 47.7688 0.0000 175.0994 795 E 3.8984 7.9914 120.7502 59.2954 29.4438 179.3007 796 I 3.6910 7.6477 118.4011 63.7709 37.9915 177.8053 797 I 3.6048 7.7611 120.8763 64.4730 36.8837 178.1127 798 Q 4.0963 8.2959 120.5504 59.1459 28.8618 178.1044 799 S 4.0231 8.2851 114.4699 61.5254 62.5630 176.3722 800 V 3.2763 7.8678 121.1133 65.8526 31.0949 177.3928 801 Y 4.0488 8.1309 119.3684 60.8515 38.6625 177.8338 802 E 3.7193 8.5275 119.7981 59.3869 29.5379 179.1603 803 D 4.2721 7.8397 118.6528 57.2694 40.8447 178.7631 804 L 3.9845 7.5768 119.0709 57.3422 41.5443 179.7435 805 V 3.8124 7.8493 119.6671 65.3198 31.2241 177.8615 806 A 3.9747 7.7548 119.4210 55.0735 18.2847 178.4406 807 N 4.6615 8.0438 112.7074 52.8737 38.4705 176.8819 808 G 3.8755 7.7615 108.3128 45.8293 0.0000 175.3704 809 V 3.6472 7.3901 119.9598 64.8833 31.7901 176.2975 810 I 4.2680 7.6294 121.3665 59.3728 38.4010 174.7328 811 V 4.2339 8.0896 125.6807 59.9734 31.3614 172.7328 812 P 4.2042 0.0000 0.0000 62.3445 31.3099 176.7338 813 A 4.2032 8.5031 126.2775 52.2182 18.9856 176.1656 814 Q 4.3544 8.2569 118.4052 54.6349 29.7736 176.2177 815 E 3.9996 8.8071 122.3786 56.6654 29.7701 176.3513 816 V 4.3519 8.1692 123.8341 60.0362 33.3847 173.6681 817 P 4.4014 0.0000 0.0000 61.9735 31.8679 174.1918 818 P 4.3695 0.0000 0.0000 60.8815 32.4917 174.3089 819 P 4.0568 0.0000 0.0000 63.8954 31.8469 176.7951 820 T 4.0253 7.4490 116.0089 63.0988 67.7759 173.0670 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 487 G 8.35 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 488 K 8.20 4.26 0.00 1.80 1.69 0.00 1.76 0.00 0.00 2.31 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.54 1.45 7.81 489 S 9.08 4.31 0.00 3.76 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 0.00 490 T 8.48 3.99 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 0.00 491 T 7.64 4.48 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 0.00 492 L 8.35 3.90 0.00 0.50 0.35 0.79 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 493 F 7.35 5.00 0.00 3.05 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 0.00 494 S 8.75 4.66 0.00 3.95 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 0.00 495 R 8.51 4.18 0.00 1.93 2.09 0.00 2.96 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.31 0.00 496 H 7.88 4.91 0.00 3.18 3.34 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 497 T 7.72 3.89 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 0.64 0.00 0.00 498 K 8.56 4.95 0.00 1.63 1.66 0.00 1.59 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.34 7.81 499 A 9.19 5.07 1.44 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 0.00 0.00 500 I 8.61 4.82 1.90 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 1.09 0.69 0.97 0.00 0.00 501 V 8.41 4.91 2.16 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 0.96 0.00 0.00 1.06 0.00 0.00 502 W 9.54 4.76 0.00 3.52 3.21 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 0.00 503 G 8.45 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 *505 Q 8.99 3.96 0.00 1.65 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.85 0.00 0.00 0.00 0.00 0.00 2.05 1.16 0.00 506 T 7.52 4.16 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 1.18 0.00 0.00 507 R 7.97 3.91 0.00 1.90 1.94 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 508 A 7.71 3.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 509 V 7.59 3.54 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 -0.12 0.00 0.00 0.88 0.00 0.00 510 Q 8.55 4.39 0.00 2.63 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 511 G 7.87 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 *513 L 7.89 4.72 0.00 2.05 2.12 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 514 D 8.52 4.50 0.00 2.97 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 515 F 8.47 4.18 0.00 3.09 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 516 D 8.59 4.50 0.00 3.52 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 0.00 517 Y 8.69 3.45 0.00 2.60 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 0.00 518 V 7.67 3.40 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 0.63 0.00 0.00 1.00 0.00 0.00 519 C 7.47 4.42 0.00 2.92 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 520 S 7.77 3.54 0.00 3.93 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 0.00 521 R 7.59 4.21 0.00 2.35 2.25 0.00 3.54 0.00 0.00 3.60 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.70 0.00 522 D 8.77 4.71 0.00 2.76 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 0.00 523 E 7.76 4.40 0.00 1.82 1.58 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 2.16 2.34 0.00 524 P 0.00 3.72 0.00 1.69 1.60 0.00 3.11 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.00 525 S 9.38 4.67 0.00 4.30 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 526 V 7.64 4.69 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 0.71 0.00 0.00 0.89 0.00 0.00 527 A 8.86 4.33 1.18 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 0.00 528 A 7.29 4.62 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *530 V 8.10 4.30 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 0.80 0.00 0.00 0.96 0.00 0.00 531 Y 8.72 4.38 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 532 P 0.00 4.63 0.00 1.68 1.92 0.00 2.42 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.82 0.00 533 F 6.58 4.42 0.00 2.24 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 0.00 534 T 7.15 4.69 4.29 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 1.33 0.00 0.00 535 G 8.32 3.99 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 0.00 0.00 0.00 536 D 8.82 5.17 0.00 2.50 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.25 4.38 0.00 3.19 3.41 0.00 5.39 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 K 8.49 4.98 0.00 1.57 1.66 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.69 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.22 1.28 7.81 539 Q 8.74 4.54 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 1.96 1.78 0.00 540 K 8.18 4.62 0.00 1.63 1.46 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.97 1.18 7.81 541 F 9.06 5.00 0.00 2.97 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 0.00 542 Y 9.22 5.03 0.00 2.96 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 0.00 543 W 9.18 4.91 0.00 3.28 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 G 7.46 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 0.00 0.00 0.00 545 H 8.36 4.55 0.00 3.06 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 K 7.82 4.26 0.00 1.88 2.00 0.00 1.81 0.00 0.00 1.96 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.65 1.52 7.81 547 E 8.66 5.01 0.00 2.14 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 2.02 1.68 0.00 548 I 8.73 4.83 1.88 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 1.42 1.22 1.00 0.00 0.00 549 L 8.50 5.23 0.00 1.50 1.57 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 550 I 8.80 4.63 2.10 0.00 0.00 0.47 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 0.88 0.90 0.00 0.00 551 P 0.00 4.63 0.00 1.91 1.98 0.00 3.54 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.17 0.00 552 V 8.55 4.59 1.66 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 0.93 0.00 0.00 0.82 0.00 0.00 553 F 8.73 5.06 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 0.00 554 K 9.33 4.46 0.00 1.83 1.81 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.54 7.81 555 N 7.80 5.28 0.00 2.95 2.73 0.00 0.00 6.99 7.54 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 *557 A 8.59 4.17 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 558 D 7.77 4.32 0.00 2.86 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 559 A 7.25 2.67 0.97 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 *561 R 7.99 4.22 0.00 1.98 1.95 0.00 3.27 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 562 K 7.83 4.12 0.00 1.71 1.73 0.00 1.75 0.00 0.00 1.96 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.37 7.81 563 H 7.98 5.21 0.00 3.17 3.25 0.00 5.63 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 564 P 0.00 4.39 0.00 2.17 2.18 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 565 E 8.06 4.09 0.00 2.14 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 0.00 2.37 2.24 0.00 566 V 7.62 3.98 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.92 0.00 0.00 567 D 8.63 5.45 0.00 2.73 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 568 V 7.70 4.92 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 1.20 0.00 0.00 0.88 0.00 0.00 569 L 8.98 5.23 0.00 1.77 1.50 1.03 0.88 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 0.00 570 I 9.02 4.62 2.04 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 1.25 0.83 0.76 0.00 0.00 571 N 9.16 5.02 0.00 2.68 2.71 0.00 0.00 6.73 7.34 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 0.00 572 F 9.31 4.67 0.00 3.35 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 A 8.62 4.45 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 574 S 8.69 4.58 0.00 4.10 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 0.00 575 L 8.38 4.07 0.00 1.78 2.01 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 576 R 7.53 4.16 0.00 1.78 2.11 0.00 3.17 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 577 S 8.10 4.69 0.00 4.01 3.80 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 0.00 578 A 7.91 3.80 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 579 Y 7.96 4.00 0.00 2.92 3.03 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 0.00 580 D 8.31 4.34 0.00 2.71 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 0.00 581 S 7.75 4.14 0.00 3.19 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 0.00 582 T 7.21 4.10 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 *584 E 8.27 4.41 0.00 2.01 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 0.00 2.36 2.48 0.00 585 T 7.73 4.04 4.41 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 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0.00 1.26 0.00 0.00 772 A 8.41 3.80 1.23 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 0.00 0.00 0.00 773 V 7.79 3.45 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 1.06 0.00 0.00 0.94 0.00 0.00 774 A 7.99 4.04 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 0.00 775 K 8.11 3.66 0.00 1.78 1.58 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.90 1.65 7.81 776 N 8.52 4.16 0.00 2.76 2.85 0.00 0.00 6.73 7.89 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 0.00 777 Q 8.17 3.95 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 778 A 8.24 4.09 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 779 L 8.12 3.91 0.00 1.81 1.71 0.82 0.71 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 0.00 780 K 7.88 4.15 0.00 2.03 1.98 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.35 7.81 781 E 8.06 3.93 0.00 2.01 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 2.36 2.53 0.00 782 A 7.49 4.32 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 0.00 783 G 7.96 3.73 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 0.00 0.00 0.00 784 V 7.69 3.75 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 1.02 0.00 0.00 0.96 0.00 0.00 785 F 9.09 4.45 0.00 3.24 3.03 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 0.00 786 V 8.48 5.18 2.19 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 1.28 0.00 0.00 1.01 0.00 0.00 787 P 0.00 4.60 0.00 2.15 2.05 0.00 4.23 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 788 R 8.41 4.14 0.00 1.92 2.00 0.00 3.25 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 789 S 6.66 2.98 0.00 3.90 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 0.00 790 F 7.42 3.19 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 0.00 791 D 7.50 4.32 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 792 E 7.76 4.45 0.00 1.85 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 2.13 2.08 0.00 793 L 7.77 3.76 0.00 1.14 0.98 0.85 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 794 G 7.64 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 3.90 0.00 2.11 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 0.00 2.34 2.29 0.00 796 I 7.65 3.69 1.84 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.92 0.00 0.00 797 I 7.76 3.60 1.91 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.51 0.83 0.00 0.00 798 Q 8.30 4.10 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 799 S 8.29 4.02 0.00 3.88 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 0.00 800 V 7.87 3.28 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 0.61 0.00 0.00 0.21 0.00 0.00 801 Y 8.13 4.05 0.00 3.01 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 802 E 8.53 3.72 0.00 1.99 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 2.33 2.54 0.00 803 D 7.84 4.27 0.00 2.81 2.64 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 0.00 804 L 7.58 3.98 0.00 1.70 1.63 0.90 0.61 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 0.00 805 V 7.85 3.81 1.86 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 1.20 0.00 0.00 0.20 0.00 0.00 806 A 7.75 3.97 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 807 N 8.04 4.66 0.00 2.74 2.81 0.00 0.00 6.96 8.13 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 0.00 808 G 7.76 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 0.00 809 V 7.39 3.65 2.16 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 0.77 0.00 0.00 0.91 0.00 0.00 810 I 7.63 4.27 1.70 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.34 0.99 0.00 0.00 811 V 8.09 4.23 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 0.83 0.00 0.00 0.92 0.00 0.00 812 P 0.00 4.20 0.00 2.12 2.11 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 813 A 8.50 4.20 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 0.00 814 Q 8.26 4.35 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 815 E 8.81 4.00 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 816 V 8.17 4.35 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 0.82 0.00 0.00 0.94 0.00 0.00 817 P 0.00 4.40 0.00 2.02 1.92 0.00 3.70 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 2.01 2.07 0.00 818 P 0.00 4.37 0.00 1.66 0.95 0.00 3.30 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.76 0.00 819 P 0.00 4.06 0.00 1.50 1.62 0.00 3.58 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 820 T 7.45 4.03 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 1.12 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.