NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.1013 8.0093 114.2459 60.2702 39.1510 175.6587 3 S 4.1547 8.1893 116.8616 57.9696 64.9173 173.7824 4 N 4.3362 9.0341 122.0463 56.4683 38.8622 178.7222 5 A 4.0357 7.9652 121.7266 55.1635 18.4560 179.6629 6 K 4.0508 8.0880 116.5713 59.3068 32.1376 179.7197 7 I 3.7216 7.7443 120.1544 64.1972 36.9194 178.2043 8 A 3.9930 8.0619 121.6437 55.2178 18.1486 179.6743 9 R 3.8280 7.9227 116.8974 59.5426 30.1013 178.7237 10 I 4.0197 7.8636 121.0656 64.0181 37.1298 178.1995 11 N 4.3291 8.2698 117.2176 56.1285 38.4346 177.3282 12 E 3.9521 8.4759 120.3400 59.6293 29.6427 179.5626 13 L 4.0304 8.2413 118.8689 57.5290 41.5813 179.4306 14 A 3.9631 8.2345 120.8481 55.0227 18.3119 179.5299 15 A 3.9311 8.0797 119.2918 55.3214 18.4097 180.0824 16 K 3.9602 8.0666 116.5336 59.2720 32.0307 179.5918 17 A 3.9418 8.0493 121.2755 55.1241 18.1556 179.6710 18 K 3.9245 8.0291 116.6732 59.2580 32.3625 178.0810 19 A 4.3138 8.0268 118.6598 51.7772 18.5916 177.6100 20 G 3.8252 7.8290 105.1711 46.4618 0.0000 174.6818 21 V 4.2736 7.8058 116.2963 61.7802 32.3147 175.5065 22 I 3.9559 7.6273 119.1590 61.6717 38.4803 176.0747 23 T 4.4135 9.0683 118.7296 60.6315 71.4700 175.9816 24 E 3.9428 8.5031 120.3001 59.5758 29.3598 179.4947 25 E 3.9612 8.0939 118.0715 59.5484 29.6180 179.0928 26 E 3.9650 8.2192 118.5873 59.1922 29.4459 179.5943 27 K 3.9263 8.3054 118.6410 59.4885 32.2481 179.1818 28 A 4.0004 8.1598 121.0485 55.0592 18.2746 179.2870 29 E 3.8645 8.4167 118.1604 59.5078 29.6127 178.8504 30 Q 3.9831 8.5300 120.0281 59.1998 29.0688 178.1625 31 Q 4.0314 8.2446 119.1199 58.9239 28.8073 179.0304 32 K 3.9749 7.9698 119.1632 59.5748 32.0417 179.4816 33 L 4.0673 8.0535 119.1873 57.8124 41.5484 179.7581 34 R 3.9828 8.5244 118.5312 59.4510 29.9451 179.1802 35 Q 4.1160 8.2249 117.8918 58.9600 28.7613 178.5670 36 E 4.0079 8.2284 119.7270 59.2532 29.2087 178.6602 37 Y 4.0978 8.0871 119.1758 60.7431 39.2242 177.9498 38 L 4.3046 8.1281 119.6487 57.9125 41.9156 179.4962 39 K 4.2533 8.4304 119.4645 59.2293 31.7916 178.5319 40 G 3.5753 7.6668 104.1253 46.4544 0.0000 173.9772 41 F 4.5057 8.2354 119.5925 57.2366 39.4478 177.6094 42 R 4.0116 7.9165 122.3525 59.6861 30.2535 178.2108 43 S 4.2929 8.0443 113.3488 61.6940 63.0680 176.3739 44 S 4.4266 7.6439 115.2950 58.6270 62.0338 176.2594 *46 K 4.2569 8.0996 121.6023 57.0122 34.1100 176.7627 47 N 4.4508 8.0526 115.7164 55.5995 38.7479 175.1254 48 T 4.1759 7.4862 119.3629 63.6146 68.6168 174.4266 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 I 8.01 4.10 1.91 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.18 0.97 0.00 0.00 3 S 8.19 4.15 0.00 4.15 4.03 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 4 N 9.03 4.34 0.00 2.76 2.91 0.00 0.00 6.72 7.37 0.00 0.00 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 A 7.97 4.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.09 4.05 0.00 2.02 1.90 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.49 7.81 7 I 7.74 3.72 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.13 0.94 0.00 0.00 8 A 8.06 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.92 3.83 0.00 1.98 2.09 0.00 3.15 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 10 I 7.86 4.02 2.03 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 1.51 1.40 0.81 0.00 0.00 11 N 8.27 4.33 0.00 2.89 2.85 0.00 0.00 7.06 7.00 0.00 0.00 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 E 8.48 3.95 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 13 L 8.24 4.03 0.00 1.80 1.70 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.23 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 3.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.07 3.96 0.00 2.01 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.62 7.81 17 A 8.05 3.94 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 3.92 0.00 1.75 1.98 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.45 7.81 19 A 8.03 4.31 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.83 3.83 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 0.00 0.00 0.00 21 V 7.81 4.27 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 0.80 0.00 0.00 0.99 0.00 0.00 22 I 7.63 3.96 1.85 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 1.47 1.05 0.91 0.00 0.00 23 T 9.07 4.41 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 1.26 0.00 0.00 24 E 8.50 3.94 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 25 E 8.09 3.96 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 26 E 8.22 3.96 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 27 K 8.31 3.93 0.00 2.01 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.73 7.81 28 A 8.16 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.42 3.86 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 30 Q 8.53 3.98 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 31 Q 8.24 4.03 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 32 K 7.97 3.97 0.00 2.02 1.87 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.64 7.81 33 L 8.05 4.07 0.00 1.86 1.74 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.52 3.98 0.00 2.00 2.02 0.00 3.10 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 35 Q 8.22 4.12 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 36 E 8.23 4.01 0.00 2.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 37 Y 8.09 4.10 0.00 3.06 3.25 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 38 L 8.13 4.30 0.00 1.99 1.78 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.43 4.25 0.00 1.90 1.84 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.48 7.81 40 G 7.67 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.24 4.51 0.00 3.09 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 7.92 4.01 0.00 1.95 1.97 0.00 3.27 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 43 S 8.04 4.29 0.00 3.89 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 44 S 7.64 4.43 0.00 4.23 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 *46 K 8.10 4.26 0.00 1.89 1.99 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.52 7.81 47 N 8.05 4.45 0.00 2.93 2.93 0.00 0.00 7.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 7.49 4.18 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.