NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 628 S 4.3966 8.1933 115.2914 57.0915 63.8187 174.1445 629 P 3.8296 0.0000 0.0000 65.5665 30.9066 178.1799 630 K 4.1006 8.7618 124.6363 59.7742 32.0998 180.7754 631 A 4.2235 8.0235 121.9219 54.9301 18.2721 179.2726 632 L 3.9832 8.8623 118.3401 58.4605 41.8340 179.7939 633 Q 3.6244 9.1080 120.5795 59.8084 28.5920 179.7556 634 Q 4.0017 8.1879 121.6770 59.9969 28.1584 180.8750 635 K 4.2469 8.3451 121.3498 59.3902 32.2007 178.7560 636 I 3.6507 8.3570 120.5988 65.1507 36.8443 178.0077 637 H 4.5721 8.1360 115.4863 58.2677 28.7911 177.0686 638 E 4.0632 8.7253 121.6902 59.5601 29.1613 178.7825 639 L 3.9360 8.7341 119.5678 58.1047 41.4727 179.4136 640 E 3.8637 7.9037 117.5546 58.8964 29.3505 179.2107 641 G 3.8510 7.9391 105.0937 46.2170 0.0000 173.7084 642 L 4.1345 7.0586 125.1500 55.0375 40.7985 176.5759 *645 Q 4.2066 8.0133 123.8566 56.2540 31.3957 176.3816 646 H 3.9583 8.5405 114.6595 59.0298 29.2718 177.3070 647 A 4.1496 8.3815 121.4494 55.5878 18.3564 179.3745 648 Q 3.9997 7.7905 115.4609 59.2936 29.1881 176.7510 649 N 4.6541 8.5927 114.5021 53.1032 38.4943 176.3802 650 L 2.8105 7.5959 115.9095 55.0497 40.5339 175.9881 651 E 4.1551 7.1026 120.3173 55.8318 27.8007 177.3628 652 F 4.8078 6.3692 122.9356 57.4245 39.6846 173.8013 653 E 3.8554 8.9133 122.4489 57.7037 28.3094 175.9862 654 E 3.9397 8.8027 119.6710 60.2806 29.9780 179.0704 655 A 3.9404 7.7657 121.9444 54.6333 18.4024 179.5552 656 A 3.9187 7.9750 118.2394 55.4372 18.5567 179.6470 657 Q 3.9355 9.0859 117.3817 59.3395 28.8464 179.1428 658 I 3.6472 8.2648 121.0305 64.4224 36.6265 178.4360 659 R 3.8153 7.7047 119.3498 59.4436 29.7872 178.1354 660 D 4.4635 8.1041 118.1899 56.3895 40.8817 178.6269 661 Q 3.9956 8.2859 119.4825 59.2382 28.8209 178.9754 662 L 3.9500 7.9469 119.5613 58.0480 41.2799 179.3330 663 H 4.2321 7.6881 115.5677 59.1773 28.6401 177.5793 664 Q 4.0607 7.9873 119.5390 58.8903 28.5764 178.6277 665 L 3.9440 8.0877 119.9423 59.0021 41.7843 179.1766 666 R 3.7983 8.7367 116.8700 59.3222 29.6349 178.0645 667 E 3.9425 8.1246 121.8854 60.0128 30.1224 179.5241 668 L 4.1001 8.7276 119.0416 57.6922 41.8196 178.9833 669 F 4.1449 8.4521 120.4898 61.7988 39.1903 177.7750 670 I 3.7921 7.8879 116.9315 63.6176 36.8655 177.4760 671 A 4.3092 8.6165 121.6464 53.8792 19.2357 178.8889 672 A 3.9348 7.7914 120.2293 55.3103 18.5572 178.1554 *673 S 4.0249 7.3884 117.7981 58.2755 63.1116 178.7622 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 628 S 8.19 4.40 0.00 3.86 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 0.00 629 P 0.00 3.83 0.00 2.16 1.44 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.83 0.00 630 K 8.76 4.10 0.00 1.76 1.81 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.33 7.81 631 A 8.02 4.22 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 0.00 632 L 8.86 3.98 0.00 2.30 2.09 0.98 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 633 Q 9.11 3.62 0.00 2.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.81 0.00 0.00 0.00 0.00 0.00 1.77 2.12 0.00 634 Q 8.19 4.00 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 635 K 8.35 4.25 0.00 1.91 1.83 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.36 7.81 636 I 8.36 3.65 1.91 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 1.52 1.06 0.63 0.00 0.00 637 H 8.14 4.57 0.00 3.17 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 638 E 8.73 4.06 0.00 1.98 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 2.31 2.37 0.00 639 L 8.73 3.94 0.00 1.66 1.70 0.91 0.23 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 0.00 640 E 7.90 3.86 0.00 2.13 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 2.35 2.33 0.00 641 G 7.94 3.85 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 0.00 0.00 0.00 642 L 7.06 4.13 0.00 1.77 1.72 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 *645 Q 8.01 4.21 0.00 2.26 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.62 0.00 0.00 0.00 0.00 0.00 2.32 1.96 0.00 646 H 8.54 3.96 0.00 3.25 3.51 0.00 5.90 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 647 A 8.38 4.15 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 0.00 0.00 648 Q 7.79 4.00 0.00 1.97 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.42 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 649 N 8.59 4.65 0.00 2.77 2.71 0.00 0.00 7.07 6.75 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 0.00 650 L 7.60 2.81 0.00 1.60 1.48 0.98 0.88 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 0.00 651 E 7.10 4.16 0.00 2.02 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 0.00 2.24 2.14 0.00 652 F 6.37 4.81 0.00 3.12 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 0.00 653 E 8.91 3.86 0.00 2.28 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 2.33 2.42 0.00 654 E 8.80 3.94 0.00 2.13 2.28 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 2.81 2.52 0.00 655 A 7.77 3.94 1.52 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 0.00 0.00 656 A 7.98 3.92 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 0.00 657 Q 9.09 3.94 0.00 1.92 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.65 2.49 0.00 658 I 8.26 3.65 1.81 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 1.41 0.86 0.90 0.00 0.00 659 R 7.70 3.82 0.00 1.94 2.06 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 660 D 8.10 4.46 0.00 2.76 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 0.00 661 Q 8.29 4.00 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 662 L 7.95 3.95 0.00 1.87 1.66 0.92 0.94 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 0.00 663 H 7.69 4.23 0.00 3.43 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 664 Q 7.99 4.06 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.63 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 665 L 8.09 3.94 0.00 1.99 1.75 0.93 0.84 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 0.00 666 R 8.74 3.80 0.00 2.19 1.91 0.00 3.07 0.00 0.00 3.18 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 667 E 8.12 3.94 0.00 1.98 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 2.42 0.00 668 L 8.73 4.10 0.00 1.95 1.75 0.95 1.17 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 0.00 669 F 8.45 4.14 0.00 3.19 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 670 I 7.89 3.79 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.81 0.93 0.00 0.00 671 A 8.62 4.31 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 0.00 672 A 7.79 3.93 1.20 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 *673 S 7.39 4.02 0.00 3.48 3.51 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 * Residues marked with a * may have inaccurate shift predictions.