NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 3.9987 8.3144 121.7885 55.5650 33.3649 172.0506 2 E 3.6432 8.2548 123.7323 53.7242 28.6224 172.1853 3 T 4.1546 8.7529 119.8293 61.3435 69.3224 174.7841 4 A 4.1301 8.8814 127.5776 55.4170 17.9919 179.5270 5 A 4.1148 7.9109 117.9389 55.0539 18.8786 179.1866 6 A 4.1324 8.4976 119.7144 55.0044 18.4401 180.4798 7 K 4.3179 7.1788 114.6645 56.5224 32.4991 178.3093 *9 E 4.2368 8.1247 118.0439 55.9314 31.3245 178.0645 10 R 3.8987 8.2851 117.6723 59.2364 30.1651 177.3229 11 Q 4.2302 7.9475 115.4036 57.4842 29.2031 176.1605 12 H 4.8016 7.9319 110.5891 54.9644 31.0565 172.8627 13 M 4.4014 7.9764 119.8000 54.1269 32.1297 175.7848 14 D 4.7953 8.2282 123.9541 51.9778 41.3926 175.5451 15 S 4.3187 8.1978 118.3889 58.2681 62.8405 174.3224 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 K 8.31 4.00 0.00 1.73 1.87 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.44 7.81 2 E 8.25 3.64 0.00 2.28 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 2.36 0.00 3 T 8.75 4.15 4.24 0.00 0.00 0.00 0.00 0.00 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 4 A 8.88 4.13 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 5 A 7.91 4.11 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.13 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 K 7.18 4.32 0.00 1.81 1.96 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.45 7.81 *9 E 8.12 4.24 0.00 2.24 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 2.31 2.32 0.00 10 R 8.29 3.90 0.00 1.72 2.10 0.00 3.24 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 11 Q 7.95 4.23 0.00 2.11 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.51 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 12 H 7.93 4.80 0.00 3.09 3.27 0.00 5.69 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.98 4.40 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 14 D 8.23 4.80 0.00 2.56 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.20 4.32 0.00 3.90 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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.