NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5261 8.2893 118.7933 54.4345 33.2738 175.9761 2 V 3.6852 7.8206 123.0603 62.9430 32.2886 175.5475 3 S 4.6560 8.6675 115.0154 55.2538 68.1774 176.2289 4 K 3.9264 8.6122 122.1180 59.6244 31.7100 179.3445 5 L 3.9737 7.8563 120.2928 58.1057 42.1020 178.9704 6 S 4.4611 8.2536 115.8090 60.9958 62.8648 176.2603 7 Q 3.9218 8.2262 123.2155 58.7745 28.5858 178.0060 8 L 3.9507 7.8259 120.2736 58.2257 42.3134 178.5054 9 Q 4.1461 8.3808 118.3164 59.3069 28.6375 179.0308 10 T 3.9541 8.0645 116.6296 66.6167 68.3838 177.3506 11 E 3.8540 7.9529 117.3220 56.9684 29.2340 178.9031 *13 L 4.1835 7.9121 120.7702 54.8865 43.9286 179.0830 14 A 3.9492 8.0850 119.9467 55.2271 18.2651 179.4701 15 A 3.9379 8.2795 119.4765 55.2276 18.2537 179.9256 16 L 3.9195 7.8019 116.8832 58.0272 41.8765 179.4922 17 L 4.1595 7.8605 118.9106 57.8612 41.3130 179.2046 18 E 3.9753 8.2106 118.6496 59.1740 29.6751 178.5795 19 S 4.3371 7.8448 112.5036 58.9910 63.2924 174.7053 20 G 4.0074 7.6880 109.3825 45.1647 0.0000 173.9791 21 L 4.0280 7.5639 123.1680 54.5513 42.6573 177.5084 22 S 4.3888 8.4909 121.0158 58.0957 65.0598 175.3546 23 K 3.9754 8.4948 122.1250 59.5239 31.7612 179.2077 24 E 3.8839 8.1674 118.9203 59.3327 29.6500 178.6230 25 A 4.2883 8.3124 122.4718 54.3455 18.3519 179.3559 26 L 3.8677 8.0418 118.9532 58.4125 42.1173 179.2655 27 I 3.7090 7.9567 120.0792 64.3157 36.7277 178.2063 28 Q 3.9608 8.4636 118.6958 59.5232 28.0066 178.8916 29 A 4.0150 7.8823 121.5777 53.9038 18.6330 178.6316 30 L 4.6486 7.9355 114.4888 54.6915 43.2088 176.9943 31 G 3.7419 8.2465 112.9696 45.6920 0.0000 173.4739 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 1 M 8.29 4.53 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 V 7.82 3.69 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 0.87 0.00 0.00 0.93 0.00 0.00 3 S 8.67 4.66 0.00 4.05 3.94 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 4 K 8.61 3.93 0.00 1.82 1.91 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.50 7.81 5 L 7.86 3.97 0.00 1.75 1.66 0.92 0.90 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 6 S 8.25 4.46 0.00 4.08 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.23 3.92 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 8 L 7.83 3.95 0.00 1.67 1.89 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.38 4.15 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 10 T 8.06 3.95 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 1.21 0.00 0.00 11 E 7.95 3.85 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 *13 L 7.91 4.18 0.00 1.86 1.75 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.09 3.95 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 15 A 8.28 3.94 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.80 3.92 0.00 1.85 1.72 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.86 4.16 0.00 1.83 1.72 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.21 3.98 0.00 1.96 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 0.00 2.32 2.32 0.00 19 S 7.84 4.34 0.00 4.08 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.69 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.56 4.03 0.00 1.55 1.69 0.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.49 4.39 0.00 4.09 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 23 K 8.49 3.98 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.50 7.81 24 E 8.17 3.88 0.00 2.03 1.94 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 2.38 2.38 0.00 25 A 8.31 4.29 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 L 8.04 3.87 0.00 1.95 1.74 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.96 3.71 2.03 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 1.58 0.63 0.91 0.00 0.00 28 Q 8.46 3.96 0.00 2.24 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 29 A 7.88 4.01 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 30 L 7.94 4.65 0.00 1.67 1.70 0.92 0.80 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 31 G 8.25 3.74 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.