NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3022 8.3149 120.1370 56.5114 33.5382 174.8552 3 T 4.3491 8.2701 118.9227 62.0064 69.8422 172.9403 4 I 4.6185 8.2618 125.0970 59.3841 41.6719 174.0007 5 E 4.6360 8.7137 124.2098 54.5378 30.9698 175.4966 6 V 4.6198 8.0696 118.4332 58.6622 35.7186 175.6309 7 D 4.6241 8.3579 121.5335 53.1047 41.5002 176.9651 8 D 4.3926 8.6871 120.9398 57.8786 40.8665 178.8810 9 E 4.0006 8.2544 118.9720 59.3706 29.6581 178.5062 10 L 4.0860 9.1202 120.7008 58.0263 42.0170 178.3620 11 Y 3.9527 8.0785 119.7040 60.8884 38.7670 178.1006 12 S 4.2514 8.4422 116.1226 61.7727 62.6947 176.0624 13 Y 4.1595 7.9202 121.3024 60.8364 38.8615 178.0691 14 I 3.6662 7.9095 120.4476 64.2487 37.2316 178.2489 15 A 3.8861 8.0362 122.2095 54.9924 18.0074 179.3735 16 S 4.2776 8.0735 110.6734 60.4208 63.1131 174.5243 17 H 4.4855 7.5301 119.1028 55.7499 28.7030 175.3564 18 T 4.0765 7.5942 117.7930 63.9183 68.5851 174.1616 19 K 4.2474 9.8314 125.7342 56.6103 34.3351 175.7880 20 H 4.6754 8.0505 115.3908 53.3785 29.9075 172.7650 21 I 3.6455 8.3089 124.7144 63.3115 37.0809 176.7388 22 G 3.9660 8.9949 113.6365 44.9957 0.0000 173.1562 23 E 4.1539 7.8892 117.7062 55.7187 30.3876 177.3950 24 S 4.4568 8.4401 115.1897 57.7345 65.5533 175.0535 25 A 3.9813 8.3895 123.3822 55.2106 17.9708 179.9994 26 S 4.1015 8.0244 113.3115 62.0494 62.8592 176.5531 27 D 4.3694 7.8925 121.5876 57.1821 40.2538 179.0416 28 I 3.6922 7.3551 119.2271 64.3918 37.2986 178.0314 29 L 4.1333 8.0494 118.7106 57.9905 41.7701 179.4630 30 R 4.2745 8.3715 118.2803 59.2226 29.8202 179.2485 31 R 3.8695 7.6252 115.7947 56.9240 29.7929 177.6892 *33 L 4.2279 7.8297 115.9866 52.8492 43.4557 177.4599 34 K 3.9295 7.8041 116.7349 57.0020 30.0883 175.6318 35 F 4.4950 8.2042 126.9382 58.3117 39.2734 175.2616 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 K 8.31 4.30 0.00 1.78 1.82 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 3 T 8.27 4.35 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 1.23 0.00 0.00 4 I 8.26 4.62 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.62 0.94 0.00 0.00 5 E 8.71 4.64 0.00 1.92 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 2.21 2.31 0.00 6 V 8.07 4.62 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 0.88 0.00 0.00 1.11 0.00 0.00 7 D 8.36 4.62 0.00 2.96 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 8 D 8.69 4.39 0.00 2.72 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 9 E 8.25 4.00 0.00 2.05 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 0.00 2.39 2.40 0.00 10 L 9.12 4.09 0.00 1.86 1.95 1.00 1.05 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 11 Y 8.08 3.95 0.00 3.12 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 12 S 8.44 4.25 0.00 4.18 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 13 Y 7.92 4.16 0.00 3.05 3.23 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 14 I 7.91 3.67 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.00 0.78 0.00 0.00 15 A 8.04 3.89 1.19 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 0.00 0.00 16 S 8.07 4.28 0.00 3.97 4.07 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 17 H 7.53 4.49 0.00 3.17 3.26 0.00 5.86 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.59 4.08 4.20 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 1.26 0.00 0.00 19 K 9.83 4.25 0.00 1.52 1.63 0.00 1.59 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.47 7.81 20 H 8.05 4.68 0.00 3.14 3.20 0.00 5.66 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.31 3.65 1.87 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 1.34 0.45 0.91 0.00 0.00 22 G 8.99 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 0.00 0.00 0.00 23 E 7.89 4.15 0.00 2.10 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 2.39 2.24 0.00 24 S 8.44 4.46 0.00 4.08 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 25 A 8.39 3.98 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 26 S 8.02 4.10 0.00 3.89 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 27 D 7.89 4.37 0.00 2.77 2.71 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 0.00 0.00 0.00 28 I 7.36 3.69 1.96 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 1.49 0.66 0.88 0.00 0.00 29 L 8.05 4.13 0.00 1.66 1.76 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.37 4.27 0.00 1.93 1.99 0.00 3.24 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.84 0.00 31 R 7.63 3.87 0.00 1.97 2.05 0.00 3.13 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 *33 L 7.83 4.23 0.00 1.81 1.80 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.80 3.93 0.00 1.91 1.97 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.43 7.81 35 F 8.20 4.49 0.00 2.96 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 * Residues marked with a * may have inaccurate shift predictions.