NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 I 4.0723 8.0249 121.4423 60.1248 39.1883 175.7679 13 P 4.0743 0.0000 0.0000 62.9458 32.4999 173.7388 14 E 4.0489 8.6822 122.5489 59.1543 30.0686 179.0812 15 W 4.3094 8.3884 116.3333 59.7413 27.8753 178.3545 16 K 3.2742 6.7852 118.6660 58.9202 30.9300 179.1777 17 Q 3.9264 7.3596 117.0787 58.8715 28.5155 178.5675 18 E 4.1447 8.4856 120.0597 59.1624 29.4734 178.9496 19 E 3.9214 8.2055 119.4232 59.4630 29.8109 178.9514 20 V 3.7009 7.7571 118.0571 66.1708 31.2366 177.5333 21 D 4.2842 7.7313 117.5066 56.9883 40.8975 178.0708 22 A 3.9273 8.3246 121.2725 55.6587 18.3539 179.8466 23 I 3.6629 8.4251 118.1926 64.6360 37.0197 178.9301 24 V 3.6446 7.4849 117.6570 65.7102 31.5273 177.7065 25 E 4.0986 8.8186 119.0956 59.8586 28.6763 179.3182 26 M 4.1273 8.1627 118.2941 58.2230 31.7272 178.8405 27 I 4.0293 7.6074 119.2798 63.8144 37.3123 177.7826 28 E 4.1627 8.0876 119.4849 58.6441 29.4669 178.3503 29 S 4.3346 7.3344 113.0952 59.1523 64.6286 174.8719 *63 R 4.1885 7.1301 119.4904 55.4897 31.4617 175.9488 64 N 4.3315 8.8024 118.6950 56.8874 38.4614 177.8458 65 T 4.0587 7.9373 110.4854 64.8376 68.6787 176.2317 66 L 4.0082 7.7262 121.2838 57.1879 41.7823 179.2289 67 L 3.9575 7.8189 119.0377 58.0120 41.8339 179.2425 68 E 4.2302 8.6562 118.6828 59.3008 29.0387 179.6115 69 R 3.8122 7.4420 118.1443 59.2518 30.5351 177.7667 70 A 4.4751 7.9885 121.7838 54.5695 18.1722 179.2906 71 L 3.9191 8.1385 116.3894 58.2612 41.9218 179.3498 72 D 4.5146 7.6465 114.7114 55.8273 40.8441 176.3807 73 D 4.5554 8.6490 126.1015 54.3354 41.2500 175.9070 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 12 I 8.02 4.07 1.85 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 1.38 1.04 0.88 0.00 0.00 13 P 0.00 4.07 0.00 1.84 2.06 0.00 3.45 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.25 0.00 14 E 8.68 4.05 0.00 2.08 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 2.40 2.37 0.00 15 W 8.39 4.31 0.00 3.63 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 K 6.79 3.27 0.00 1.41 1.37 0.00 1.26 0.00 0.00 1.42 0.00 0.00 2.75 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.30 0.21 7.81 17 Q 7.36 3.93 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 18 E 8.49 4.14 0.00 2.21 2.04 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 2.35 2.50 0.00 19 E 8.21 3.92 0.00 2.32 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 2.39 0.00 20 V 7.76 3.70 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 0.94 0.00 0.00 0.88 0.00 0.00 21 D 7.73 4.28 0.00 3.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.32 3.93 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 I 8.43 3.66 2.01 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 1.08 0.91 0.00 0.00 24 V 7.48 3.64 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.97 0.00 0.00 25 E 8.82 4.10 0.00 2.18 1.98 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 2.33 2.35 0.00 26 M 8.16 4.13 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.59 0.00 27 I 7.61 4.03 2.06 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 0.71 0.91 0.00 0.00 28 E 8.09 4.16 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 29 S 7.33 4.33 0.00 4.21 3.98 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 *63 R 7.13 4.19 0.00 1.97 1.98 0.00 3.26 0.00 0.00 3.44 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 64 N 8.80 4.33 0.00 2.77 2.88 0.00 0.00 6.74 7.05 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 65 T 7.94 4.06 4.22 0.00 0.00 0.00 0.00 0.00 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 66 L 7.73 4.01 0.00 1.88 1.73 0.87 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.82 3.96 0.00 1.82 1.71 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.66 4.23 0.00 1.94 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 2.33 2.54 0.00 69 R 7.44 3.81 0.00 1.98 2.12 0.00 3.30 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 70 A 7.99 4.48 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.14 3.92 0.00 1.74 1.76 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 72 D 7.65 4.51 0.00 2.86 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 73 D 8.65 4.56 0.00 2.75 2.51 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.