NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 3.8894 8.2127 109.7378 45.4881 0.0000 171.9485 17 N 4.1073 7.7420 120.6327 51.7754 38.3743 173.8189 18 S 4.6061 8.5390 111.7943 57.4002 66.1799 173.8837 19 G 4.2486 8.1173 116.6427 43.6381 0.0000 170.1493 20 S 4.7082 7.4058 112.8249 56.7154 66.0960 173.2681 21 I 4.1267 8.2691 126.3533 62.1109 37.5134 176.7789 22 V 4.4964 7.6524 118.0499 60.8416 32.7425 177.0275 23 Q 4.1147 7.8872 118.3886 59.1042 28.3513 176.7328 24 N 5.1085 7.9723 114.4301 53.1328 39.1177 176.0302 25 F 4.3011 8.3855 123.3173 60.9198 39.5899 174.8317 26 Y 4.0893 8.0315 118.2027 56.0495 38.8262 175.4938 27 M 4.2297 8.1504 125.0155 55.2133 32.6786 176.4310 28 Q 4.6358 8.4173 119.8558 55.6552 26.9526 173.6695 29 Q 4.6665 8.2869 126.8964 57.4734 35.8807 175.0126 30 Y 4.1779 8.6385 114.0407 59.8919 38.2515 176.0536 31 Q 3.8764 7.4988 118.5649 57.8150 29.9126 179.6962 32 N 5.1756 7.9165 122.2688 52.5889 41.0876 172.4698 33 S 4.9899 8.2653 116.8267 58.4008 65.4741 173.0929 34 I 4.7421 7.9042 118.4637 61.0060 42.4272 175.4505 35 D 4.7629 8.5208 121.4178 54.2703 39.4694 177.2085 36 A 4.5196 8.9926 129.5523 54.6818 25.3649 177.5909 *37 D 4.4483 8.0376 118.2274 53.5399 40.5834 177.9578 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 16 G 8.21 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.74 4.11 0.00 2.79 2.77 0.00 0.00 6.74 6.75 0.00 0.00 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 S 8.54 4.61 0.00 3.83 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.41 4.71 0.00 3.81 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.27 4.13 1.88 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 1.48 0.68 0.93 0.00 0.00 22 V 7.65 4.50 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 0.82 0.00 0.00 0.86 0.00 0.00 23 Q 7.89 4.11 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.51 0.00 0.00 0.00 0.00 0.00 2.54 2.39 0.00 24 N 7.97 5.11 0.00 2.78 2.90 0.00 0.00 6.85 7.45 0.00 0.00 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 F 8.39 4.30 0.00 3.08 3.31 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 26 Y 8.03 4.09 0.00 3.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 M 8.15 4.23 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 28 Q 8.42 4.64 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 29 Q 8.29 4.67 0.00 2.44 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 30 Y 8.64 4.18 0.00 3.13 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 7.50 3.88 0.00 2.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.61 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 32 N 7.92 5.18 0.00 2.76 2.69 0.00 0.00 6.76 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 33 S 8.27 4.99 0.00 3.95 3.88 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 34 I 7.90 4.74 1.87 0.00 0.00 0.85 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 0.33 0.92 0.00 0.00 35 D 8.52 4.76 0.00 2.64 1.92 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 0.00 0.00 0.00 0.00 36 A 8.99 4.52 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 D 8.04 4.45 0.00 2.46 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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.