NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.0629 8.2649 123.5818 51.9535 19.8178 176.5124 *4 I 3.6593 7.9247 119.1111 61.6551 36.9525 171.5977 5 V 3.3902 8.2290 132.5749 62.1102 33.4269 170.7360 6 K 4.1109 8.7034 127.7998 56.9019 30.1126 179.7415 *9 I 3.8822 8.7454 127.4554 61.7755 38.0930 175.4240 10 K 4.0208 8.5357 124.5295 56.5396 32.8563 172.9477 11 A 3.5245 8.3473 131.5761 51.7847 17.1616 177.6264 *13 K 4.3389 8.5532 121.5250 56.9228 34.1005 177.2166 14 K 4.1405 7.6662 120.6575 56.3547 30.1189 176.3009 15 L 3.9155 8.3266 118.8828 54.8435 39.2914 174.5824 16 C 4.8834 7.5904 112.0572 58.1438 30.0233 175.4656 17 R 4.1096 8.1550 118.0743 57.1507 30.0882 178.3722 18 G 4.1231 7.7068 107.3745 45.8189 0.0000 174.5446 19 F 4.3723 7.6383 122.3543 56.9117 37.5062 174.7386 *21 L 4.0228 7.7710 126.6029 54.4160 43.2807 177.7296 *23 C 4.4567 8.0920 111.0184 57.5571 31.7483 175.0117 24 G 3.9485 7.6271 110.5155 43.7059 0.0000 173.3246 25 C 4.4484 7.3929 111.4184 56.7076 33.1985 174.0267 26 H 4.7152 7.3604 122.5556 55.4247 29.0455 173.6659 27 F 4.3631 7.2789 118.5059 59.3190 39.8809 176.7918 *29 G 3.8382 7.5485 112.4494 44.9826 0.0000 172.1069 30 K 4.5980 7.6948 117.5698 54.4450 35.7406 175.5437 31 K 4.1849 8.5509 122.0565 56.6933 32.1512 176.8154 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 2 A 8.26 4.06 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.92 3.66 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.59 0.91 0.00 0.00 5 V 8.23 3.39 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 6 K 8.70 4.11 0.00 1.78 1.17 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.45 7.81 *9 I 8.75 3.88 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.48 0.91 0.00 0.00 10 K 8.54 4.02 0.00 1.75 1.73 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.43 7.81 11 A 8.35 3.52 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 *13 K 8.55 4.34 0.00 1.77 1.94 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.50 7.81 14 K 7.67 4.14 0.00 1.84 1.72 0.00 1.74 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.53 7.81 15 L 8.33 3.92 0.00 1.86 1.79 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 16 C 7.59 4.88 0.00 3.12 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.16 4.11 0.00 1.98 2.05 0.00 3.19 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 18 G 7.71 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.64 4.37 0.00 2.99 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.77 4.02 0.00 1.64 1.65 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 *23 C 8.09 4.46 0.00 3.03 2.92 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 24 G 7.63 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.39 4.45 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.36 4.72 0.00 2.89 3.00 0.00 5.72 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.28 4.36 0.00 3.11 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *29 G 7.55 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.69 4.60 0.00 1.65 1.62 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.45 7.81 31 K 8.55 4.18 0.00 1.78 1.70 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.42 7.81 * Residues marked with a * may have inaccurate shift predictions.