NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 G 3.7914 8.3501 109.7365 46.1100 0.0000 172.8296 14 A 3.4370 8.4101 119.4658 52.7082 14.7074 178.2406 15 N 3.5072 8.5379 114.8170 59.4623 40.7007 172.4249 16 D 4.4294 8.1500 117.6421 54.4055 42.0046 176.1670 17 E 4.4634 8.5378 122.0801 55.1246 31.3196 175.6920 18 L 4.5631 8.0930 120.0107 53.7513 43.4428 175.9441 19 I 4.3158 8.0087 120.4219 59.5863 39.3176 175.5246 20 S 4.5406 8.1070 120.6998 57.0142 63.9189 173.6029 21 F 4.8831 8.7460 125.9413 56.4349 42.1063 176.5027 22 K 4.6883 8.3348 125.5364 53.5417 32.2570 176.1663 23 D 4.6905 7.8078 120.7349 53.4603 40.1094 174.9445 24 E 4.0218 8.3874 126.2242 57.2131 30.6968 175.5815 25 G 3.7873 7.1230 103.1035 43.9798 0.0000 173.3869 *40 D 4.4273 8.3545 113.8135 53.4251 40.5449 175.7445 41 L 4.4269 7.4703 117.4820 55.6564 43.4732 179.1563 42 A 4.0486 8.0152 122.2474 55.2914 18.3223 179.0762 43 D 4.4939 7.9713 114.1755 56.2222 41.5561 178.8506 44 V 3.7818 7.6059 118.0929 65.7071 31.9433 177.6355 45 K 4.1603 8.6267 118.9619 59.3773 31.8903 179.5518 46 S 4.1860 7.9166 115.0394 61.0766 62.7038 175.8150 47 S 4.4819 7.3904 115.1384 58.9182 63.3125 175.0269 48 L 4.2589 7.6257 123.7171 56.7748 42.1418 177.9207 49 V 4.1034 7.6939 113.2306 63.7047 32.5272 176.1212 50 N 4.5632 8.1296 118.8798 52.4126 37.5505 176.4038 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 13 G 8.35 3.79 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 0.00 0.00 0.00 14 A 8.41 3.44 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.54 3.51 0.00 2.70 2.70 0.00 0.00 7.25 8.47 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 16 D 8.15 4.43 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.54 4.46 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 18 L 8.09 4.56 0.00 1.65 1.65 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.01 4.32 1.80 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.32 0.00 0.00 20 S 8.11 4.54 0.00 3.70 3.71 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 21 F 8.75 4.88 0.00 2.98 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.33 4.69 0.00 1.70 1.55 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.25 0.98 7.81 23 D 7.81 4.69 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.39 4.02 0.00 1.98 1.97 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 2.30 2.32 0.00 25 G 7.12 3.79 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 0.00 0.00 0.00 *40 D 8.35 4.43 0.00 2.82 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 41 L 7.47 4.43 0.00 1.72 1.73 0.92 0.75 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 42 A 8.02 4.05 1.30 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 0.00 0.00 0.00 43 D 7.97 4.49 0.00 2.80 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 44 V 7.61 3.78 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 0.87 0.00 0.00 1.00 0.00 0.00 45 K 8.63 4.16 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.73 7.81 46 S 7.92 4.19 0.00 4.00 4.12 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 47 S 7.39 4.48 0.00 4.09 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 48 L 7.63 4.26 0.00 1.82 1.91 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.69 4.10 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 0.81 0.00 0.00 1.04 0.00 0.00 50 N 8.13 4.56 0.00 2.74 2.58 0.00 0.00 6.97 7.08 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 * Residues marked with a * may have inaccurate shift predictions.