NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9020 8.2127 109.7327 45.3251 0.0000 175.6146 2 I 3.2149 7.1325 115.3893 60.0100 38.1551 173.7710 *4 E 3.9427 8.4796 121.6257 55.1907 32.0400 176.1432 5 Q 4.3569 7.6475 118.5563 56.7123 29.8394 175.6777 6 C 4.7605 9.0720 114.0377 56.7284 40.6867 173.5492 7 C 4.4909 7.9337 119.1636 59.2396 33.2039 174.3163 8 T 4.5874 7.4983 105.9306 61.5342 70.9639 174.7444 9 S 4.6406 7.3210 115.2712 58.4528 62.8330 176.8322 10 I 4.5158 8.3934 128.0257 61.6693 40.8469 173.3444 11 C 5.1640 8.3863 118.1562 54.7524 42.6860 174.2025 12 S 4.9906 8.2437 115.0724 55.8934 66.8327 174.9663 13 L 3.9148 8.6219 123.9469 58.6138 39.9492 178.1653 14 Y 4.3348 7.8509 119.4364 59.3437 39.5258 177.1637 15 Q 4.0195 8.0964 117.8815 58.7007 29.0451 177.9844 16 L 4.4958 8.8211 120.2322 56.9776 41.6260 178.6500 17 E 3.8987 7.3840 117.1208 58.5377 29.6202 177.7494 18 N 4.1969 7.8265 116.8694 55.6126 38.6139 174.8568 19 Y 4.5148 6.9430 117.2552 58.3048 38.2246 175.2319 20 C 4.2944 7.4846 117.6418 60.1921 29.1153 173.5678 21 N 4.4719 8.7436 120.2059 54.2609 39.5347 173.7668 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 G 8.21 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.13 3.21 1.23 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.17 0.66 0.00 0.00 *4 E 8.48 3.94 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 5 Q 7.65 4.36 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 6 C 9.07 4.76 0.00 2.84 3.02 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 0.00 0.00 0.00 7 C 7.93 4.49 0.00 2.84 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.50 4.59 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 1.27 0.00 0.00 9 S 7.32 4.64 0.00 4.14 3.06 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 0.00 0.00 0.00 10 I 8.39 4.52 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.17 0.93 0.00 0.00 11 C 8.39 5.16 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.24 4.99 0.00 4.08 3.97 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 13 L 8.62 3.91 0.00 1.94 2.03 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.85 4.33 0.00 3.11 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 15 Q 8.10 4.02 0.00 2.35 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 16 L 8.82 4.50 0.00 1.75 1.77 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.38 3.90 0.00 2.07 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 18 N 7.83 4.20 0.00 2.63 2.23 0.00 0.00 6.58 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 6.94 4.51 0.00 3.02 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 20 C 7.48 4.29 0.00 2.88 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.74 4.47 0.00 2.80 2.73 0.00 0.00 6.89 7.57 0.00 0.00 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.