NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3185 8.2549 117.2851 55.7246 30.7741 174.9264 2 R 4.1034 8.2023 117.8975 53.5962 30.8896 175.2424 3 K 4.2657 8.4701 119.3495 56.7865 34.2732 176.1339 4 W 4.3831 8.6748 130.8894 57.7803 30.4267 175.5347 *6 R 2.5100 7.6293 112.5248 55.0048 29.7942 174.2251 7 W 5.1012 7.6706 115.6843 55.6288 32.9881 174.7412 8 H 4.5509 8.7144 119.3848 55.3173 29.0993 175.5955 9 L 4.2233 8.4946 121.3404 55.2479 41.4421 177.1221 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 8.25 4.32 0.00 1.97 2.03 0.00 3.03 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 2 R 8.20 4.10 0.00 1.94 1.91 0.00 3.21 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 3 K 8.47 4.27 0.00 1.94 1.88 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.19 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.36 7.81 4 W 8.67 4.38 0.00 3.34 3.08 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 0.00 0.00 0.00 0.00 *6 R 7.63 2.51 0.00 1.52 1.42 0.00 2.80 0.00 0.00 2.96 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.28 0.00 7 W 7.67 5.10 0.00 3.35 2.97 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 0.00 0.00 0.00 8 H 8.71 4.55 0.00 3.18 3.26 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.49 4.22 0.00 1.67 1.62 0.95 0.87 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 * Residues marked with a * may have inaccurate shift predictions.