NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8382 8.2133 109.7225 45.6618 0.0000 175.2636 3 K 4.1533 8.4995 124.9510 56.3856 31.6646 175.7832 4 G 3.8095 7.5432 108.5125 45.4225 0.0000 173.4030 5 D 4.4336 7.8181 120.7349 53.9059 41.4969 177.0711 6 R 4.0282 8.6100 125.9332 58.5629 30.5606 176.9923 7 R 4.0751 7.5281 117.1677 55.5170 30.2163 175.3477 8 T 4.6613 7.1776 106.5460 59.3042 72.5926 174.2591 9 R 3.9202 8.5086 119.9577 58.8015 29.8962 178.1142 10 R 4.2669 7.9236 117.5419 58.6260 30.4794 178.6609 11 G 4.2613 7.8837 104.9207 46.3012 0.0000 174.7255 12 K 4.2742 7.6355 121.3652 58.5690 32.5918 178.6049 13 I 3.6315 7.2385 119.2967 64.1927 36.8906 178.2060 14 W 4.1513 8.3024 128.4809 60.3108 30.6060 176.8268 15 R 3.4849 7.4821 114.8235 56.6397 29.9500 175.8945 16 G 4.1767 7.9851 108.3591 46.2622 0.0000 174.4539 17 T 4.0131 7.2804 107.6707 61.3521 69.5258 172.5978 18 Y 4.7983 7.8867 119.4454 56.6233 41.2281 175.9659 19 G 4.0460 7.9127 109.4258 46.1315 0.0000 174.7846 20 K 4.0416 8.7638 120.6078 59.5935 32.4749 178.2693 21 Y 4.6559 7.8020 114.2827 58.0493 38.6932 175.2150 22 R 4.8347 7.2053 114.3832 55.7415 33.0693 171.9551 23 P 4.5456 0.0000 0.0000 62.8891 32.9466 177.8213 24 R 3.8665 8.0539 119.6329 55.5093 28.5183 176.3660 25 K 3.5892 7.5590 123.6487 56.1407 33.0094 175.5823 *26 K 4.1330 8.3851 119.5941 54.7865 32.3269 172.3474 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 2 G 8.21 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 3 K 8.50 4.15 0.00 1.22 1.32 0.00 1.36 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.33 7.81 4 G 7.54 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 7.82 4.43 0.00 2.63 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.61 4.03 0.00 1.83 2.00 0.00 3.27 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 7 R 7.53 4.08 0.00 1.43 1.05 0.00 2.99 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 8 T 7.18 4.66 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 1.13 0.00 0.00 9 R 8.51 3.92 0.00 2.01 1.99 0.00 3.26 0.00 0.00 3.39 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 10 R 7.92 4.27 0.00 1.89 1.95 0.00 3.16 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 11 G 7.88 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 0.00 0.00 0.00 12 K 7.64 4.27 0.00 2.29 1.80 0.00 1.57 0.00 0.00 1.83 0.00 0.00 3.17 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.75 7.81 13 I 7.24 3.63 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.84 0.93 0.00 0.00 14 W 8.30 4.15 0.00 3.17 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.48 3.48 0.00 2.02 1.88 0.00 3.47 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.34 0.00 16 G 7.99 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 17 T 7.28 4.01 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 18 Y 7.89 4.80 0.00 2.93 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 19 G 7.91 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 20 K 8.76 4.04 0.00 1.74 1.78 0.00 1.53 0.00 0.00 1.38 0.00 0.00 2.23 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.76 1.18 7.81 21 Y 7.80 4.66 0.00 2.98 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.21 4.83 0.00 1.78 1.94 0.00 3.17 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.48 0.00 23 P 0.00 4.55 0.00 2.08 1.96 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 24 R 8.05 3.87 0.00 1.55 1.61 0.00 3.14 0.00 0.00 2.87 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.50 0.00 25 K 7.56 3.59 0.00 1.85 1.78 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.42 7.81 *26 K 8.39 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.