NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.4502 8.3444 118.3479 60.0589 29.2177 173.4467 2 R 3.7958 8.6365 121.8829 59.7234 30.3215 176.8494 3 K 3.8780 8.1227 116.7228 57.3456 33.7410 176.3606 4 A 4.1975 6.7711 118.8692 49.5726 21.6506 176.5451 5 G 3.6411 8.4593 109.3561 48.6587 0.0000 175.9748 6 V 3.7520 7.8145 118.9912 62.1252 32.2847 177.1517 7 G 4.2998 6.9783 112.6988 45.0174 0.0000 172.7520 8 Q 4.7178 8.0144 127.4541 53.6435 33.7132 174.8373 *10 W 4.9862 8.9681 122.0445 55.7441 28.7644 176.4425 11 K 3.9544 8.2159 114.8128 55.0911 34.5846 177.4173 12 E 2.9117 5.9000 119.3435 55.7766 28.4241 172.6552 13 N 4.1351 8.3202 113.8655 54.4813 36.7749 173.0453 *15 P 4.7880 0.0000 0.0000 61.7294 32.8159 175.8492 16 L 4.7009 7.1179 116.3001 54.5498 43.5927 175.7854 17 N 4.3856 7.8797 125.7520 53.5910 42.2947 176.6192 18 V 3.6795 8.1379 116.1671 65.3768 31.9690 175.5489 19 S 4.3739 7.9318 117.0648 58.2666 62.2710 173.2460 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 C 8.34 4.45 0.00 2.87 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.64 3.80 0.00 1.79 1.86 0.00 3.19 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 3 K 8.12 3.88 0.00 1.36 1.24 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.32 7.81 4 A 6.77 4.20 0.25 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 5 G 8.46 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.81 3.75 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 0.87 0.00 0.00 0.95 0.00 0.00 7 G 6.98 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.01 4.72 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 *10 W 8.97 4.99 0.00 3.57 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.22 3.95 0.00 1.58 1.79 0.00 1.18 0.00 0.00 1.53 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 0.44 7.81 12 E 5.90 2.91 0.00 1.80 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 13 N 8.32 4.14 0.00 2.73 2.80 0.00 0.00 6.86 7.66 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 *15 P 0.00 4.79 0.00 2.32 2.28 0.00 3.84 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.01 0.00 16 L 7.12 4.70 0.00 1.74 1.62 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 17 N 7.88 4.39 0.00 2.71 2.85 0.00 0.00 6.80 7.64 0.00 0.00 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 V 8.14 3.68 2.09 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 0.72 0.00 0.00 0.94 0.00 0.00 19 S 7.93 4.37 0.00 3.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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.