NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 562 G 3.9385 8.3393 109.7374 45.1792 0.0000 174.1854 563 S 4.3298 7.8170 114.1292 54.7943 64.1812 171.4933 564 P 4.6992 0.0000 0.0000 62.6822 33.3534 176.7861 565 A 4.5547 8.9374 123.5136 51.4600 20.4943 175.9818 566 A 4.9679 8.2264 119.0172 50.1997 21.9147 176.3336 567 A 4.3223 8.7523 123.8095 50.4890 19.7143 175.8029 568 P 4.3255 0.0000 0.0000 62.2317 31.7728 175.6812 569 P 4.4568 0.0000 0.0000 64.3818 31.8231 176.2185 570 T 4.6850 7.6696 108.6910 59.7415 71.0307 173.4258 571 L 4.7813 8.2667 123.1911 52.6459 43.2379 175.1162 572 P 4.4316 0.0000 0.0000 62.0284 31.5646 174.7870 573 P 4.3941 0.0000 0.0000 64.2931 31.6619 176.9989 574 Y 4.2914 6.7587 116.1717 57.8869 38.3932 176.3928 575 F 3.7251 6.4335 118.9846 59.6118 39.3163 175.2479 576 M 4.1911 7.3370 121.0301 54.8545 32.2921 175.2623 577 K 4.0864 8.5153 127.9817 58.5704 32.6948 176.4284 578 G 4.0613 9.1967 114.0705 45.2391 0.0000 174.2027 579 S 4.3536 7.9935 115.9480 58.8782 64.1202 173.4193 580 I 4.8997 8.2274 122.9562 59.6779 39.7938 174.8976 581 I 4.2473 8.8011 128.0862 59.9025 39.3254 174.6561 582 Q 4.7030 8.3753 127.7889 54.4964 29.6651 175.3320 583 L 4.1210 9.1285 127.4660 53.9489 42.4655 178.3636 584 A 4.1923 7.7937 122.8654 55.2123 18.3332 179.1356 585 N 4.3459 7.9584 111.8705 54.3894 37.4751 176.1219 586 G 3.9468 8.4064 108.0799 44.8887 0.0000 173.7408 587 E 4.1445 9.0368 120.3644 56.5278 30.7486 175.7975 588 L 5.1330 8.3491 122.3588 52.9600 44.0727 175.8480 589 K 4.6729 8.8712 123.9700 54.2645 36.2083 175.8848 590 K 4.6032 8.7218 125.7698 56.1604 33.1883 178.3883 591 V 3.8526 8.7468 122.7772 64.9384 31.2746 178.2556 592 E 4.4200 8.2781 116.4321 58.0535 29.7399 176.8511 593 D 4.7975 8.0311 118.2086 54.3402 41.7122 176.8851 594 L 4.2242 7.8752 119.6551 54.9881 42.3212 176.5693 595 K 4.9922 9.1336 121.4987 54.3166 35.7153 177.3892 596 T 3.9062 8.6967 116.9404 67.1839 68.1269 176.4984 597 E 3.9747 8.2107 119.7578 59.7010 29.4714 179.1091 598 D 4.2470 8.1259 118.8354 57.1483 40.8105 178.8353 599 F 3.9572 8.0280 117.9244 60.3686 38.9748 177.3654 600 I 3.7604 7.9185 119.4738 64.8173 36.8979 178.5456 601 Q 4.0232 8.2764 118.7117 58.9696 28.5167 179.0163 602 S 4.0357 8.0257 115.9850 61.4942 62.6370 176.5825 603 A 4.0118 7.8821 122.4073 55.1336 18.1863 179.0252 604 E 4.0392 8.0359 116.9805 59.4061 29.7895 178.7943 605 I 3.8664 7.8791 119.4780 62.9337 37.5674 176.6012 606 S 4.4357 7.5632 114.0397 57.6293 62.8731 173.6492 607 N 4.6176 8.6765 123.8388 54.7038 39.0335 175.3494 608 D 4.7724 7.9430 117.1002 54.5486 42.5746 176.0128 609 L 5.4499 8.1513 117.6510 52.6491 45.3156 175.6202 610 K 4.7733 9.0905 119.7919 55.2491 36.8609 174.8780 611 I 4.7006 8.2900 121.0749 60.7519 38.1043 175.0829 612 D 5.2325 9.4479 126.0159 52.4576 44.8788 174.4667 613 S 5.2750 8.3849 115.3317 56.8586 66.3887 172.8559 614 S 4.9855 8.9358 116.8343 57.2638 67.2980 172.9397 615 T 4.8174 8.5881 119.3810 61.8867 71.0382 174.2065 616 V 3.8264 8.7715 126.6616 63.1540 31.8303 176.0770 617 E 4.5009 9.1448 128.0264 57.7899 31.2512 176.6008 618 R 4.5884 7.2919 117.2761 55.1186 33.7521 173.8187 619 I 5.0792 8.2299 125.4908 59.5154 40.4996 174.3287 620 E 4.8053 8.9381 123.7413 54.4610 33.7718 174.1791 621 D 4.8964 8.6133 120.0449 54.3187 41.7585 176.9913 622 S 4.6887 8.2810 118.1476 57.2044 64.7408 173.7368 623 H 4.2732 9.0189 114.5190 58.0692 28.5980 175.7006 624 S 4.6039 7.8533 116.9754 55.7359 64.0091 171.9387 625 P 4.3428 0.0000 0.0000 64.1412 31.7625 176.8413 626 G 3.9119 9.0222 109.4148 45.3668 0.0000 172.3775 627 V 4.8891 7.6141 119.4403 60.8727 34.1655 174.6864 628 A 4.8755 9.0091 129.7932 50.9616 21.5313 175.9293 629 V 4.5453 8.8195 120.3873 61.6449 33.2404 174.6812 630 I 4.7509 8.7791 129.8065 59.5011 39.7576 174.4052 631 Q 4.8728 8.8174 128.6079 54.6157 30.6855 174.1476 632 F 5.3616 9.5211 124.9925 55.6164 42.8104 174.5114 633 A 4.7913 9.1790 125.0840 51.0774 19.9142 176.4044 634 V 4.3369 8.5598 123.8390 60.7204 32.5338 176.8886 635 G 3.7722 8.2794 117.3938 46.9571 0.0000 174.5622 636 E 4.4126 8.4527 122.5068 55.6076 31.4585 176.1697 637 H 3.8970 8.9370 117.6039 57.0175 27.7626 176.5338 638 R 3.8301 7.4634 114.8087 56.4449 27.2750 175.5949 639 A 4.3005 7.3618 124.6982 51.8465 20.4983 177.4925 640 Q 4.8245 8.5784 120.1037 55.2397 30.1689 175.5540 641 V 4.4791 8.9894 123.9228 61.2089 34.8107 174.0820 642 S 5.2710 8.7328 123.5096 57.0647 65.1868 173.2190 643 V 4.9544 8.9841 124.1589 61.1490 35.2969 173.9885 644 E 4.8958 9.2103 127.7282 55.9045 30.5647 175.7501 645 V 4.7732 8.8097 124.5629 60.5818 35.5154 174.8346 646 L 4.5348 8.5608 126.2878 54.9027 42.5384 178.8244 647 V 3.7520 8.7656 116.2650 64.2891 31.6822 178.0826 648 E 4.3281 8.0182 114.9355 56.7768 30.0759 175.9627 649 Y 3.7962 7.8834 122.6582 57.3383 39.2304 173.5354 650 P 4.6220 0.0000 0.0000 61.9059 32.3060 175.7152 651 F 4.8593 9.6101 124.1833 56.6704 41.3462 174.9287 652 F 4.2625 8.9974 123.9989 56.6103 40.7158 174.4017 653 V 4.5172 7.7957 127.9416 61.5195 31.6249 174.9565 654 F 3.9951 9.5114 131.0126 59.9272 39.9628 176.0018 655 G 3.8649 9.0769 114.1102 45.7963 0.0000 173.3145 656 Q 4.1862 7.4055 115.5136 55.2440 33.4236 175.6497 657 G 2.2048 7.8317 104.9964 43.1383 0.0000 171.6992 658 W 4.8584 7.8537 119.4575 57.3814 30.3266 175.7203 659 S 5.3505 9.5737 120.0477 57.4615 67.4007 173.2999 660 S 5.2620 9.0700 117.1466 57.2246 66.4156 174.5993 661 C 4.2036 9.0043 117.2777 62.3745 28.6896 174.5225 662 C 4.7067 8.2237 118.6291 55.7668 32.1154 171.7888 663 P 4.2583 0.0000 0.0000 65.2697 31.2346 177.0829 664 E 3.9205 8.2314 117.3443 59.5461 29.4932 179.0303 665 R 3.9669 7.8817 117.4504 59.2284 30.1452 178.8016 666 T 3.8342 7.8977 115.7455 66.6866 68.4003 176.5181 667 S 4.1069 8.4312 115.3666 61.5519 62.1906 176.2884 668 Q 3.9384 7.8665 119.8028 58.4204 28.4437 178.0665 669 L 3.9247 7.5844 120.4913 57.0948 42.5613 177.8752 670 F 4.9264 7.9947 114.7581 55.8007 40.2886 175.2239 671 D 4.6193 8.1110 116.8796 55.0384 39.9153 172.7516 672 L 4.5010 7.8854 119.1607 51.8882 42.7331 174.0491 673 P 4.4207 0.0000 0.0000 63.0220 31.7970 175.6317 674 C 5.2317 8.3286 119.6658 57.9532 32.0212 174.2457 675 S 4.4396 8.8799 118.5303 58.0779 64.2027 173.3392 676 K 4.6805 8.4536 123.7193 55.7200 32.4021 176.3463 677 L 4.4311 8.6059 130.9301 55.9003 42.7267 176.4255 678 S 4.6218 9.2880 118.5399 56.1042 66.2542 173.5533 679 V 3.7684 8.2211 121.0544 65.0840 31.3835 176.2465 680 G 4.0044 9.1725 116.0675 45.0913 0.0000 173.5524 681 D 4.4174 8.0268 120.4879 54.7330 42.1338 175.7595 682 V 4.5892 8.4682 123.0964 61.7639 33.3402 174.0436 683 C 5.1340 9.1733 127.7680 58.6923 29.4379 173.1093 684 I 5.0835 8.7582 118.3232 59.6734 39.7543 175.3081 685 S 4.7830 8.7835 118.4304 57.2878 67.8899 173.1017 686 L 5.0852 8.7090 123.6477 54.2546 42.4934 176.0145 687 T 4.7707 8.6582 113.5229 59.1954 72.8803 172.9802 688 L 4.5416 8.3456 121.9299 54.8713 41.5679 177.4587 689 K 3.9475 9.0419 129.2807 59.8717 32.7900 177.2521 *690 N 4.5503 7.9899 119.7038 52.4689 38.2783 175.5971 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 562 G 8.34 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 0.00 563 S 7.82 4.33 0.00 4.07 3.87 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 0.00 564 P 0.00 4.70 0.00 2.13 2.12 0.00 3.77 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 2.01 2.00 0.00 565 A 8.94 4.55 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 0.00 566 A 8.23 4.97 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 0.00 567 A 8.75 4.32 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 0.00 568 P 0.00 4.33 0.00 2.10 2.04 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 569 P 0.00 4.46 0.00 2.20 2.20 0.00 3.75 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 2.01 1.97 0.00 570 T 7.67 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 1.24 0.00 0.00 571 L 8.27 4.78 0.00 1.92 1.97 1.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 572 P 0.00 4.43 0.00 1.92 2.09 0.00 4.08 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 1.06 2.02 0.00 573 P 0.00 4.39 0.00 2.23 2.33 0.00 3.67 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 2.07 1.95 0.00 574 Y 6.76 4.29 0.00 2.91 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 0.00 575 F 6.43 3.73 0.00 1.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 576 M 7.34 4.19 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 577 K 8.52 4.09 0.00 1.96 1.75 0.00 2.04 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.60 7.81 578 G 9.20 4.06 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 0.00 0.00 0.00 579 S 7.99 4.35 0.00 3.96 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 0.00 580 I 8.23 4.90 1.86 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 1.35 0.79 0.89 0.00 0.00 581 I 8.80 4.25 1.78 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.89 0.72 0.00 0.00 582 Q 8.38 4.70 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 7.05 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 583 L 9.13 4.12 0.00 1.79 1.43 0.78 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 584 A 7.79 4.19 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 585 N 7.96 4.35 0.00 2.79 2.93 0.00 0.00 6.25 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 G 8.41 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 0.00 0.00 0.00 587 E 9.04 4.14 0.00 2.02 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 2.30 2.26 0.00 588 L 8.35 5.13 0.00 1.48 1.54 0.90 0.87 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 0.00 589 K 8.87 4.67 0.00 1.72 1.55 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.40 7.81 590 K 8.72 4.60 0.00 2.08 1.98 0.00 1.86 0.00 0.00 2.05 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.45 7.81 591 V 8.75 3.85 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 1.11 0.00 0.00 592 E 8.28 4.42 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 593 D 8.03 4.80 0.00 2.94 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 0.00 594 L 7.88 4.22 0.00 2.11 1.51 1.04 0.23 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 0.00 595 K 9.13 4.99 0.00 1.72 1.86 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.53 7.81 596 T 8.70 3.91 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 0.47 0.00 0.00 597 E 8.21 3.97 0.00 2.03 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 2.39 2.45 0.00 598 D 8.13 4.25 0.00 2.51 2.43 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 0.00 599 F 8.03 3.96 0.00 3.07 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 600 I 7.92 3.76 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.97 0.95 0.00 0.00 601 Q 8.28 4.02 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.66 0.00 602 S 8.03 4.04 0.00 3.79 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 0.00 603 A 7.88 4.01 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 0.00 604 E 8.04 4.04 0.00 2.09 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 2.32 2.35 0.00 605 I 7.88 3.87 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.73 0.89 0.00 0.00 606 S 7.56 4.44 0.00 3.82 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 0.00 607 N 8.68 4.62 0.00 2.72 2.84 0.00 0.00 7.00 8.06 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 0.00 608 D 7.94 4.77 0.00 2.58 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 609 L 8.15 5.45 0.00 1.47 1.53 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 610 K 9.09 4.77 0.00 1.73 1.87 0.00 1.31 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.31 1.41 7.81 611 I 8.29 4.70 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.63 0.96 0.00 0.00 612 D 9.45 5.23 0.00 2.64 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 S 8.38 5.27 0.00 3.86 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 0.00 614 S 8.94 4.99 0.00 3.73 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 0.00 615 T 8.59 4.82 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 616 V 8.77 3.83 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 0.52 0.00 0.00 0.69 0.00 0.00 617 E 9.14 4.50 0.00 1.88 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 2.24 2.42 0.00 618 R 7.29 4.59 0.00 1.78 1.61 0.00 3.08 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 619 I 8.23 5.08 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.65 0.88 0.00 0.00 620 E 8.94 4.81 0.00 1.97 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 2.26 0.00 621 D 8.61 4.90 0.00 2.59 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 0.00 622 S 8.28 4.69 0.00 3.94 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 0.00 623 H 9.02 4.27 0.00 3.27 3.49 0.00 5.71 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 624 S 7.85 4.60 0.00 3.81 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 0.00 625 P 0.00 4.34 0.00 2.02 1.98 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 626 G 9.02 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 0.00 0.00 0.00 627 V 7.61 4.89 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 1.05 0.00 0.00 0.93 0.00 0.00 628 A 9.01 4.88 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 0.00 629 V 8.82 4.55 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 0.96 0.00 0.00 0.95 0.00 0.00 630 I 8.78 4.75 1.58 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 1.00 0.53 -0.09 0.00 0.00 631 Q 8.82 4.87 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 632 F 9.52 5.36 0.00 2.93 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 0.00 633 A 9.18 4.79 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 0.00 634 V 8.56 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 0.93 0.00 0.00 0.93 0.00 0.00 635 G 8.28 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 0.00 0.00 0.00 636 E 8.45 4.41 0.00 1.91 1.62 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 2.24 2.14 0.00 637 H 8.94 3.90 0.00 3.26 3.45 0.00 5.70 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 638 R 7.46 3.83 0.00 1.80 2.17 0.00 3.11 0.00 0.00 3.08 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 639 A 7.36 4.30 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 0.00 640 Q 8.58 4.82 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 641 V 8.99 4.48 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.97 0.00 0.00 642 S 8.73 5.27 0.00 3.83 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 0.00 643 V 8.98 4.95 2.36 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 1.11 0.00 0.00 1.14 0.00 0.00 644 E 9.21 4.90 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 645 V 8.81 4.77 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 1.16 0.00 0.00 1.22 0.00 0.00 646 L 8.56 4.53 0.00 1.74 1.63 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 647 V 8.77 3.75 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 0.89 0.00 0.00 0.94 0.00 0.00 648 E 8.02 4.33 0.00 2.01 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 2.28 2.12 0.00 649 Y 7.88 3.80 0.00 2.98 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 0.00 650 P 0.00 4.62 0.00 1.59 1.61 0.00 2.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.72 0.00 651 F 9.61 4.86 0.00 3.29 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 0.00 652 F 9.00 4.26 0.00 2.47 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 0.00 653 V 7.80 4.52 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 654 F 9.51 4.00 0.00 3.13 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 0.00 655 G 9.08 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 0.00 0.00 0.00 656 Q 7.41 4.19 0.00 1.87 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.32 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 657 G 7.83 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 658 W 7.85 4.86 0.00 3.32 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 0.00 659 S 9.57 5.35 0.00 3.84 3.76 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 0.00 660 S 9.07 5.26 0.00 4.14 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 0.00 661 C 9.00 4.20 0.00 3.11 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 0.00 662 C 8.22 4.71 0.00 2.95 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 663 P 0.00 4.26 0.00 2.21 2.32 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 664 E 8.23 3.92 0.00 2.02 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 2.37 2.41 0.00 665 R 7.88 3.97 0.00 1.98 1.90 0.00 3.17 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 666 T 7.90 3.83 4.35 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 0.00 0.00 0.00 1.22 0.00 0.00 667 S 8.43 4.11 0.00 3.87 3.93 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 0.00 668 Q 7.87 3.94 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 669 L 7.58 3.92 0.00 1.33 1.17 0.53 -0.02 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 0.00 670 F 7.99 4.93 0.00 3.06 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 671 D 8.11 4.62 0.00 2.80 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 672 L 7.89 4.50 0.00 1.52 1.48 0.70 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 673 P 0.00 4.42 0.00 2.15 2.02 0.00 3.74 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 2.08 2.14 0.00 674 C 8.33 5.23 0.00 2.82 2.83 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 0.00 675 S 8.88 4.44 0.00 3.87 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 676 K 8.45 4.68 0.00 1.78 1.74 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.46 7.81 677 L 8.61 4.43 0.00 1.80 1.63 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 678 S 9.29 4.62 0.00 3.96 3.87 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 0.00 679 V 8.22 3.77 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 0.82 0.00 0.00 0.86 0.00 0.00 680 G 9.17 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 0.00 681 D 8.03 4.42 0.00 2.66 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 0.00 682 V 8.47 4.59 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 0.96 0.00 0.00 0.88 0.00 0.00 683 C 9.17 5.13 0.00 3.00 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 0.00 684 I 8.76 5.08 1.76 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 -0.10 1.06 0.00 0.00 685 S 8.78 4.78 0.00 3.80 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 0.00 686 L 8.71 5.09 0.00 1.58 1.64 0.83 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 687 T 8.66 4.77 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 688 L 8.35 4.54 0.00 1.56 1.66 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 689 K 9.04 3.95 0.00 1.74 1.87 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.44 7.81 *690 N 7.99 4.55 0.00 2.53 2.62 0.00 0.00 6.50 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.