NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1328 8.1185 123.5816 52.1442 20.5293 178.5474 *3 A 4.2550 8.0279 124.2304 53.9120 20.7727 179.7498 4 E 3.9118 8.1934 114.6109 59.5150 29.4345 179.3649 5 A 3.9652 8.3334 120.7836 55.0430 18.3901 179.4705 6 A 3.9083 7.9421 118.8491 55.2851 18.4237 179.2749 7 E 3.8128 8.3830 117.9351 59.3394 29.6398 179.2260 8 K 3.6185 8.0433 118.2518 59.1889 32.0897 179.1111 9 A 4.0901 8.1415 120.9194 55.2797 18.2680 179.5630 10 A 3.9717 8.1901 119.3697 55.2057 18.3227 180.0471 11 K 3.8981 8.1764 117.1951 59.7650 32.0949 179.1568 12 Y 4.3480 7.9566 116.9666 61.0942 37.6865 178.6005 13 A 4.0363 8.3344 121.4779 55.1208 18.4267 179.5332 14 A 3.9480 8.4270 119.7189 55.3604 18.4626 179.7696 15 E 3.9220 8.6272 117.2034 59.3757 29.6648 179.4168 16 A 3.9905 8.1474 120.6232 55.1797 18.4750 179.5705 17 A 3.9591 8.3169 119.6211 55.2046 18.3871 179.3861 18 E 3.9019 8.5566 118.2221 59.4094 29.6944 179.2237 19 K 3.9599 8.2044 118.2339 59.4410 31.8923 179.2391 20 A 3.9836 7.7570 119.3890 54.9645 18.3771 179.1650 21 A 4.0945 8.2029 118.7445 55.3865 18.5543 179.7599 22 K 4.1316 8.2855 115.9851 59.2484 32.1278 180.1638 23 A 4.0674 7.7777 117.5526 52.4332 18.2656 177.2177 *25 A 4.0584 8.0307 129.1961 54.0268 19.0387 177.6155 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 A 8.12 4.13 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 *3 A 8.03 4.25 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 4 E 8.19 3.91 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 5 A 8.33 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.94 3.91 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 7 E 8.38 3.81 0.00 2.07 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 2.23 2.31 0.00 8 K 8.04 3.62 0.00 1.89 1.49 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.47 7.81 9 A 8.14 4.09 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 10 A 8.19 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.18 3.90 0.00 1.69 1.75 0.00 1.55 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.54 7.81 12 Y 7.96 4.35 0.00 3.14 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.33 4.04 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 14 A 8.43 3.95 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 15 E 8.63 3.92 0.00 2.21 2.06 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 2.53 2.54 0.00 16 A 8.15 3.99 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 17 A 8.32 3.96 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 18 E 8.56 3.90 0.00 2.10 2.12 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 2.31 2.36 0.00 19 K 8.20 3.96 0.00 2.01 1.85 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.59 7.81 20 A 7.76 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 21 A 8.20 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 4.13 0.00 1.85 1.89 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.55 7.81 23 A 7.78 4.07 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 *25 A 8.03 4.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.