NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.4500 8.0132 117.2316 56.4206 31.7187 172.9278 2 V 4.5516 8.3432 111.5623 59.4434 33.6803 174.0387 3 R 4.4117 9.9245 127.4628 55.4422 31.5500 174.3411 4 C 5.3809 8.7266 123.8399 56.0257 40.7193 173.1654 5 R 4.7214 9.1939 121.3520 54.8265 33.7832 174.2795 6 Q 4.5418 8.7494 124.7156 55.6205 28.9161 175.4553 7 R 4.4482 8.9753 125.0196 55.4137 33.6758 175.1551 8 K 3.7124 9.4228 123.4108 57.7253 29.3218 177.9610 9 G 3.8733 8.1041 105.1141 46.2639 0.0000 173.1413 10 R 4.7306 8.2490 120.0417 54.3985 33.3212 175.0897 11 R 4.9288 8.4065 120.0069 54.9102 30.5695 175.6572 12 I 4.2795 9.1772 119.4900 60.1255 39.3371 174.3225 13 C 5.4873 8.7601 122.1061 55.3662 41.8182 173.2016 14 I 4.6700 8.9633 122.4729 59.0144 39.9825 175.1858 15 R 3.9304 8.8767 123.9314 58.9255 29.3298 174.2295 16 I 4.4892 9.4112 122.2177 61.2171 39.6807 173.8607 *18 P 4.1653 0.0000 0.0000 63.4184 31.6639 176.2881 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 R 8.01 4.45 0.00 1.90 2.29 0.00 3.07 0.00 0.00 3.30 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 2 V 8.34 4.55 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 0.56 0.00 0.00 0.93 0.00 0.00 3 R 9.92 4.41 0.00 1.84 1.80 0.00 3.07 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 4 C 8.73 5.38 0.00 2.89 2.98 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 5 R 9.19 4.72 0.00 1.79 1.69 0.00 3.09 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 6 Q 8.75 4.54 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.47 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 7 R 8.98 4.45 0.00 1.65 1.73 0.00 3.41 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 8 K 9.42 3.71 0.00 1.97 1.83 0.00 1.87 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.36 7.81 9 G 8.10 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.25 4.73 0.00 1.89 1.76 0.00 3.13 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 11 R 8.41 4.93 0.00 1.85 2.10 0.00 3.08 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 12 I 9.18 4.28 1.87 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 1.23 0.95 0.91 0.00 0.00 13 C 8.76 5.49 0.00 2.85 3.01 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 14 I 8.96 4.67 1.87 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 1.28 1.11 0.91 0.00 0.00 15 R 8.88 3.93 0.00 1.81 1.98 0.00 2.98 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 16 I 9.41 4.49 2.00 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 1.40 0.94 0.91 0.00 0.00 *18 P 0.00 4.17 0.00 2.21 1.99 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 * Residues marked with a * may have inaccurate shift predictions.