NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 P 4.3851 0.0000 0.0000 62.9160 32.2522 176.0339 15 V 3.9837 8.2005 118.1037 63.1464 31.6611 177.4201 16 F 3.9537 8.4328 121.9144 61.9309 39.9796 176.1213 17 A 4.1707 8.2640 119.8341 55.4420 18.1240 179.3206 18 R 3.9169 8.0606 116.5232 59.5362 29.9804 178.1228 19 E 3.9649 7.7558 118.2840 58.7751 29.6860 178.3604 20 L 3.8902 8.3659 120.9761 57.9872 42.0646 178.3281 21 H 4.0540 8.8929 118.4914 59.3128 29.9142 177.0777 22 A 4.0528 7.8593 122.1586 55.1327 18.2114 179.6825 23 Q 3.8746 7.6872 116.6164 59.2102 28.8290 178.9458 24 L 3.9700 7.8903 119.8741 57.8324 41.7439 179.6223 25 V 3.5456 8.0731 118.5425 66.3125 31.4087 178.1460 26 Q 4.0004 8.0369 117.3256 58.7716 28.5037 178.4576 27 A 4.2974 7.7741 122.9533 54.6235 18.3041 179.6837 28 L 4.0898 8.2625 117.7875 57.8084 41.5816 179.7829 29 G 3.5867 7.9474 105.5425 48.0191 0.0000 175.4301 30 D 4.3018 7.9643 121.0143 56.9776 40.8192 178.9616 31 V 3.5833 7.7329 118.6476 66.0321 31.4117 177.8802 32 K 3.8389 8.5731 117.6762 59.8229 32.1513 179.1180 33 R 3.9812 8.1764 118.1336 59.2265 30.1351 178.8382 34 R 3.5161 7.7068 118.4548 59.4692 29.9235 178.1912 35 L 4.0685 7.8628 117.4744 56.6383 41.3498 178.7971 36 L 4.2127 7.7879 118.6424 56.4551 41.8497 177.6650 37 R 4.0285 7.6402 115.7597 55.4020 30.4261 177.6980 38 G 4.4196 7.3525 108.2827 44.4216 0.0000 172.4645 39 G 3.7019 7.7068 103.3006 45.2778 0.0000 172.4323 40 T 4.3755 7.5924 110.7930 61.2258 71.2913 175.0761 41 Q 4.3291 8.6476 119.1017 58.6881 28.5977 178.5576 42 Q 3.9494 8.1283 120.6817 59.4184 29.2302 177.9986 43 Q 4.0973 8.1921 118.9218 59.1769 28.6944 178.6329 44 Y 4.2078 8.0470 117.6267 61.2113 37.9569 178.5143 45 Q 4.0366 8.2479 120.3210 59.3630 29.3083 178.1019 46 Q 3.9042 8.1859 119.0149 59.0434 28.7603 179.2214 47 W 4.1194 8.3650 119.5644 59.5013 29.0758 178.7489 48 Q 4.1694 8.6160 118.7172 58.7320 28.1258 178.2971 49 Q 4.0962 8.4877 121.4138 58.9811 29.0729 177.8145 50 E 3.8633 8.0448 120.0494 59.1606 29.6075 178.6228 51 A 4.0996 8.2125 120.8892 55.1903 18.4118 179.3971 52 D 4.5035 8.5483 118.6206 56.8854 40.9496 178.6104 53 A 3.9778 7.9030 121.2144 55.4714 18.1614 179.7875 54 I 3.6970 7.5966 116.6677 64.6264 37.1181 178.2817 55 E 4.1057 8.6029 119.5310 59.2259 29.2139 179.2290 56 A 4.2442 8.7433 121.4381 54.8902 18.4182 180.6654 57 G 3.8265 7.9242 101.7968 45.3806 0.0000 175.2782 *59 N 4.7006 8.1010 118.9483 53.1567 40.7107 176.8769 60 I 3.6833 7.9303 118.7176 64.6488 36.6972 178.4226 61 I 3.7129 7.9056 119.0870 63.8818 37.4972 177.3149 62 E 4.1049 8.0060 119.0009 58.3130 29.7772 177.5068 63 K 4.3094 7.9980 116.0563 56.9208 32.4198 178.1434 64 I 4.0976 7.2278 120.8641 63.4099 37.8231 176.0343 65 K 4.2127 7.5209 122.6665 56.8554 32.1741 176.0378 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 14 P 0.00 4.39 0.00 2.17 2.16 0.00 3.67 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 1.92 2.09 0.00 15 V 8.20 3.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 16 F 8.43 3.95 0.00 3.22 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 17 A 8.26 4.17 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.06 3.92 0.00 1.90 2.13 0.00 3.18 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 19 E 7.76 3.96 0.00 2.23 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 20 L 8.37 3.89 0.00 1.68 1.67 0.92 1.03 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 21 H 8.89 4.05 0.00 3.34 3.44 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.86 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.69 3.87 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 24 L 7.89 3.97 0.00 1.75 1.68 0.92 0.60 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 25 V 8.07 3.55 2.19 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 1.03 0.00 0.00 0.88 0.00 0.00 26 Q 8.04 4.00 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 27 A 7.77 4.30 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 4.09 0.00 1.84 1.74 0.93 0.85 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 G 7.95 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.96 4.30 0.00 2.90 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.73 3.58 2.30 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 1.25 0.00 0.00 1.21 0.00 0.00 32 K 8.57 3.84 0.00 1.92 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.61 7.81 33 R 8.18 3.98 0.00 1.99 1.88 0.00 3.09 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 34 R 7.71 3.52 0.00 1.15 1.41 0.00 2.67 0.00 0.00 2.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.64 0.00 35 L 7.86 4.07 0.00 1.89 1.80 1.04 0.61 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 36 L 7.79 4.21 0.00 1.71 1.69 0.89 1.19 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 37 R 7.64 4.03 0.00 1.82 1.87 0.00 3.16 0.00 0.00 3.12 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.48 0.00 38 G 7.35 4.42 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 0.00 39 G 7.71 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.59 4.38 4.30 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 1.24 0.00 0.00 41 Q 8.65 4.33 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.95 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 42 Q 8.13 3.95 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 43 Q 8.19 4.10 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 44 Y 8.05 4.21 0.00 3.26 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 45 Q 8.25 4.04 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 46 Q 8.19 3.90 0.00 2.16 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 47 W 8.37 4.12 0.00 3.47 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 8.62 4.17 0.00 2.43 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 49 Q 8.49 4.10 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 50 E 8.04 3.86 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 51 A 8.21 4.10 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.55 4.50 0.00 2.88 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 53 A 7.90 3.98 1.35 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 0.00 0.00 54 I 7.60 3.70 2.01 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 1.54 0.73 0.95 0.00 0.00 55 E 8.60 4.11 0.00 2.15 2.01 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 2.35 2.62 0.00 56 A 8.74 4.24 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.92 3.83 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 0.00 0.00 0.00 *59 N 8.10 4.70 0.00 2.98 2.93 0.00 0.00 7.01 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.93 3.68 2.02 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 1.42 0.97 0.93 0.00 0.00 61 I 7.91 3.71 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.99 0.00 0.00 62 E 8.01 4.10 0.00 2.02 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 0.00 2.29 2.46 0.00 63 K 8.00 4.31 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.57 7.81 64 I 7.23 4.10 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.76 0.92 0.00 0.00 65 K 7.52 4.21 0.00 1.79 1.88 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.