NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8659 8.2133 109.7221 45.2329 0.0000 174.0250 3 K 3.4644 8.6134 118.9591 58.0387 32.0840 175.7046 4 G 3.4592 7.6574 106.3683 45.3276 0.0000 172.9324 5 D 4.4281 8.4645 121.3615 53.3145 40.6386 177.0005 6 R 4.1949 8.4442 126.9875 58.9721 30.3302 177.2536 7 R 3.6459 7.4054 116.5786 56.2914 30.6223 176.3241 8 T 4.7265 7.2581 106.8142 59.0820 73.4936 173.0860 9 R 4.0608 8.4793 119.8607 59.6478 30.0326 178.1752 10 R 4.0515 8.1034 117.2296 59.3767 30.1752 178.8129 11 G 4.4350 7.9040 106.5973 47.2748 0.0000 175.7326 12 K 3.9783 7.9903 120.6041 59.1141 32.0889 179.2764 13 I 3.5870 7.9387 120.3039 64.3365 36.8600 177.7808 14 W 4.0764 8.7393 128.0223 60.8999 30.6197 177.6604 15 R 4.2401 8.2583 114.4443 55.9867 29.4647 176.9722 16 G 3.8002 7.8514 107.0640 46.3787 0.0000 173.9005 17 T 4.3841 7.4122 110.3959 60.0758 71.0453 172.5217 18 Y 5.0261 8.6516 117.7157 56.4619 42.4813 174.9659 19 G 3.9256 8.8946 106.8145 44.8562 0.0000 172.7487 20 K 3.6278 8.5317 120.7612 59.9864 31.7963 177.8757 21 Y 4.2604 7.7615 111.9798 58.3330 38.2930 175.7656 22 R 4.4615 8.1993 116.1323 55.6214 32.0763 171.8050 23 P 4.9184 0.0000 0.0000 61.2119 33.1459 177.4552 24 R 3.7544 7.9554 120.0829 56.1041 28.1112 177.0959 25 K 3.4925 7.6322 121.6380 56.6957 32.0040 176.5782 *26 K 4.1215 8.4054 118.7673 55.3624 32.3269 171.5459 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 G 8.21 3.87 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 0.00 0.00 0.00 3 K 8.61 3.46 0.00 1.42 1.28 0.00 1.73 0.00 0.00 1.98 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.46 7.81 4 G 7.66 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.46 4.43 0.00 2.56 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.44 4.19 0.00 1.79 1.97 0.00 3.25 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 7 R 7.41 3.65 0.00 1.33 0.76 0.00 2.88 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.34 0.00 8 T 7.26 4.73 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 9 R 8.48 4.06 0.00 2.00 1.99 0.00 3.41 0.00 0.00 3.41 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 10 R 8.10 4.05 0.00 1.90 2.02 0.00 3.21 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 11 G 7.90 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.99 3.98 0.00 2.23 1.85 0.00 1.60 0.00 0.00 1.98 0.00 0.00 3.36 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.56 7.81 13 I 7.94 3.59 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.84 0.92 0.00 0.00 14 W 8.74 4.08 0.00 3.34 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.26 4.24 0.00 1.91 2.04 0.00 3.48 0.00 0.00 3.33 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 16 G 7.85 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.41 4.38 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 Y 8.65 5.03 0.00 2.95 2.88 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 19 G 8.89 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.53 3.63 0.00 1.57 1.58 0.00 1.62 0.00 0.00 1.44 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.58 1.21 7.81 21 Y 7.76 4.26 0.00 3.09 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 22 R 8.20 4.46 0.00 1.83 1.87 0.00 3.04 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 23 P 0.00 4.92 0.00 2.06 1.94 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.23 0.00 24 R 7.96 3.75 0.00 1.53 1.53 0.00 3.12 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.50 0.00 25 K 7.63 3.49 0.00 1.83 1.80 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.41 7.81 *26 K 8.41 4.12 0.00 1.52 1.62 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.