NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 T 4.2044 8.1593 110.9105 60.3436 68.8633 173.2186 18 P 4.0062 0.0000 0.0000 63.1673 31.7037 175.6651 19 C 4.6682 8.4007 117.0895 55.1491 40.6990 175.0540 20 V 3.8311 8.0154 119.9216 62.3719 31.5799 173.6851 21 P 4.1568 0.0000 0.0000 63.9729 31.8118 176.2047 22 A 3.7637 9.2763 121.6452 52.4849 15.9516 176.7141 23 E 4.7735 7.9393 118.2395 56.3942 32.6687 174.2912 24 C 4.9029 9.5014 124.7807 55.4814 43.7838 172.4445 25 F 5.2799 8.5783 122.4939 56.9126 39.8942 174.6829 26 D 4.3978 8.3298 128.0066 53.7860 41.2777 177.1725 27 L 3.8536 8.4720 126.5225 56.7137 42.1291 178.0676 28 L 4.0948 8.1906 120.4545 56.6480 42.2085 177.3219 29 V 4.0293 7.7069 115.0452 61.7661 32.3724 174.9823 30 R 3.3954 7.5417 116.8842 58.3252 28.1929 174.3391 31 H 5.1395 7.3177 112.5890 54.5452 34.1138 173.2046 32 C 5.5639 8.9958 116.0085 55.8175 39.0743 174.4241 33 V 4.7158 8.9696 116.3674 58.8968 36.3482 174.7550 34 A 4.4231 8.7290 124.2215 52.9222 18.4924 179.4187 35 C 4.2053 8.8695 119.5872 59.2463 40.5855 176.3778 36 G 3.5126 7.9177 107.6884 47.7589 0.0000 174.8981 37 L 4.1340 8.0791 119.8251 56.3069 41.9494 177.0617 38 L 4.5658 7.4021 117.2537 52.7886 43.2164 175.9826 39 R 4.3788 8.5394 123.2708 54.7665 30.4827 176.0017 40 T 4.2983 8.3225 116.0668 59.7654 70.4050 172.9400 *41 P 4.2086 0.0000 0.0000 62.1059 31.4872 172.8025 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 17 T 8.16 4.20 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 1.16 0.00 0.00 18 P 0.00 4.01 0.00 2.24 2.06 0.00 3.68 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.01 0.00 19 C 8.40 4.67 0.00 3.25 3.12 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 20 V 8.02 3.83 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 1.00 0.00 0.00 0.94 0.00 0.00 21 P 0.00 4.16 0.00 2.08 1.98 0.00 3.82 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 22 A 9.28 3.76 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.94 4.77 0.00 1.96 1.95 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 2.36 2.33 0.00 24 C 9.50 4.90 0.00 2.89 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 25 F 8.58 5.28 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 26 D 8.33 4.40 0.00 2.69 2.35 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 0.00 27 L 8.47 3.85 0.00 1.61 1.66 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.19 4.09 0.00 1.52 1.80 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.71 4.03 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 0.91 0.00 0.00 0.94 0.00 0.00 30 R 7.54 3.40 0.00 1.96 2.03 0.00 3.27 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 31 H 7.32 5.14 0.00 2.98 3.13 0.00 5.57 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 9.00 5.56 0.00 2.93 3.07 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 33 V 8.97 4.72 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 0.65 0.00 0.00 0.91 0.00 0.00 34 A 8.73 4.42 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 35 C 8.87 4.21 0.00 3.06 3.17 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 0.00 36 G 7.92 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 0.00 0.00 0.00 37 L 8.08 4.13 0.00 1.63 1.72 0.91 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.40 4.57 0.00 1.63 1.57 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.54 4.38 0.00 1.78 1.88 0.00 3.14 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 40 T 8.32 4.30 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 1.21 0.00 0.00 *41 P 0.00 4.21 0.00 1.86 1.90 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.