NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 T 4.3361 8.1593 117.3795 63.2619 70.8791 173.7117 22 T 4.4636 7.6351 111.3670 59.7312 71.0659 172.1914 23 N 5.7003 9.4640 122.5171 51.7682 43.0385 174.0619 24 Y 4.9514 8.9685 118.9055 56.2959 42.1888 174.8474 25 V 5.0153 8.7031 121.3959 60.4419 35.7396 174.0977 *27 T 4.6106 8.1663 117.4116 63.6523 69.7924 174.1444 28 T 4.7784 8.5387 116.8439 60.0403 70.7653 175.8908 29 K 3.8170 8.8781 124.6833 59.3897 32.2465 177.1728 30 N 4.6633 8.1505 114.0853 52.6321 37.2784 175.7845 31 G 3.9346 8.2831 106.7030 45.6041 0.0000 174.1081 32 Q 4.3819 8.0922 118.9370 55.6465 30.5352 175.0600 33 T 4.8028 8.3866 117.8878 61.9387 70.9972 173.5450 34 I 4.5581 8.2086 126.6991 59.3397 40.8475 174.5691 35 V 4.4647 8.4892 126.9370 62.0493 32.6525 174.9912 36 T 4.9809 9.1873 117.8808 59.9980 72.1588 173.0229 37 Q 4.6006 8.9354 123.2778 56.0788 29.3171 177.0187 38 G 4.1086 9.0505 109.9415 44.9083 0.0000 172.4815 39 K 3.0253 8.1092 120.5331 54.7406 32.6426 175.1090 40 P 4.5982 0.0000 0.0000 62.9769 32.5668 175.6415 41 Q 4.5406 8.9267 121.5090 54.1191 30.9568 174.6095 42 L 4.5035 8.5269 126.8973 54.3419 43.6271 175.4371 43 D 4.7270 8.5429 125.7406 52.3860 42.0108 176.3860 44 K 4.0200 8.8891 126.7987 59.2881 32.2970 178.1208 45 E 4.2225 8.2495 117.7111 57.9053 30.0924 176.9269 46 T 4.1209 8.2148 114.6133 63.4903 69.9471 174.8109 47 G 3.5651 8.3896 108.8790 45.9247 0.0000 173.1187 *49 T 4.6683 7.3923 113.9068 63.3115 70.8177 174.8355 50 S 5.4523 9.1501 121.2533 56.9171 65.8976 172.7132 51 Y 5.2379 8.7612 120.0704 56.1726 42.4282 173.4494 52 T 5.0061 8.4934 115.8267 61.7625 71.3996 174.8943 53 D 5.2542 8.6590 127.0611 52.5986 41.0908 176.8860 54 Q 4.2273 8.6174 116.8564 58.6454 28.7120 177.0373 55 E 4.2821 8.5114 115.9629 56.1490 29.6929 177.0878 56 G 3.9635 8.0877 107.3881 44.9981 0.0000 173.5603 57 N 4.6022 7.9937 117.4836 52.9618 40.0308 174.0879 58 Q 4.6862 8.4596 121.9579 55.3977 29.9238 175.3398 59 R 4.6176 8.8020 121.8311 54.4061 35.0084 173.8909 60 E 5.2312 8.4634 118.4367 54.8855 33.3452 175.1008 61 I 4.7633 8.9151 122.7665 58.8912 41.8315 174.4507 62 N 4.5557 8.7900 126.3119 53.7237 39.4412 176.1764 63 S 4.2673 9.1994 121.9807 61.4074 63.1442 176.3285 64 N 4.4443 8.2963 116.5301 55.6247 38.6810 175.4262 65 D 4.5248 8.0334 116.9702 54.5201 41.3465 175.9090 66 V 4.1778 7.2625 120.4562 61.8226 31.8053 175.3491 67 A 4.2898 9.1719 131.5958 54.5734 19.0072 177.1089 68 Q 4.6240 7.5333 111.1445 54.6756 33.2805 175.2876 69 L 4.7206 8.4693 123.1150 53.9157 43.8532 174.3307 70 I 4.5965 8.7520 126.7879 58.6802 40.0475 175.1039 71 K 3.3300 8.5088 127.9950 56.0856 32.5659 176.1096 72 A 4.4115 8.3466 129.4983 51.3942 19.7958 176.3774 73 D 4.8376 8.3283 119.6274 52.1972 43.1096 176.6853 74 L 4.0617 8.5392 125.0395 57.9145 42.1127 176.3773 75 E 4.6840 7.5428 112.8310 54.9656 32.3101 173.6524 76 H 4.4475 8.7638 115.4982 55.3637 28.9381 174.4089 77 H 4.8473 9.5156 119.5633 52.5606 30.7650 173.0789 78 H 4.1693 8.9336 120.1183 56.3565 29.2982 174.5873 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 21 T 8.16 4.34 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 1.22 0.00 0.00 22 T 7.64 4.46 4.31 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 1.25 0.00 0.00 23 N 9.46 5.70 0.00 2.65 2.72 0.00 0.00 6.91 7.48 0.00 0.00 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 Y 8.97 4.95 0.00 2.91 2.83 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 25 V 8.70 5.02 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 1.34 0.00 0.00 0.92 0.00 0.00 *27 T 8.17 4.61 4.23 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 1.20 0.00 0.00 28 T 8.54 4.78 4.31 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 1.17 0.00 0.00 29 K 8.88 3.82 0.00 1.69 1.89 0.00 1.79 0.00 0.00 1.88 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.39 7.81 30 N 8.15 4.66 0.00 2.87 2.89 0.00 0.00 6.20 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 31 G 8.28 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 32 Q 8.09 4.38 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 33 T 8.39 4.80 4.23 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 1.20 0.00 0.00 34 I 8.21 4.56 1.69 0.00 0.00 0.78 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 0.75 0.86 0.00 0.00 35 V 8.49 4.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.94 0.00 0.00 36 T 9.19 4.98 4.39 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 1.06 0.00 0.00 37 Q 8.94 4.60 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.68 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 38 G 9.05 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.11 3.03 0.00 1.27 1.47 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.96 0.21 7.81 40 P 0.00 4.60 0.00 1.89 1.99 0.00 3.26 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.09 0.00 41 Q 8.93 4.54 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 42 L 8.53 4.50 0.00 1.64 1.55 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.54 4.73 0.00 2.74 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 44 K 8.89 4.02 0.00 1.78 1.88 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.39 7.81 45 E 8.25 4.22 0.00 1.92 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 0.00 2.26 2.32 0.00 46 T 8.21 4.12 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 1.21 0.00 0.00 47 G 8.39 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *49 T 7.39 4.67 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 50 S 9.15 5.45 0.00 3.79 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 51 Y 8.76 5.24 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.49 5.01 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 53 D 8.66 5.25 0.00 3.03 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 54 Q 8.62 4.23 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.04 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 55 E 8.51 4.28 0.00 2.06 1.98 0.00 0.00 0.00 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 2.40 0.00 56 G 8.09 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.99 4.60 0.00 2.94 2.68 0.00 0.00 7.07 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.46 4.69 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 59 R 8.80 4.62 0.00 0.67 1.43 0.00 3.30 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.00 60 E 8.46 5.23 0.00 1.77 1.80 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 2.17 2.21 0.00 61 I 8.92 4.76 2.05 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 1.15 0.92 1.05 0.00 0.00 62 N 8.79 4.56 0.00 2.85 2.69 0.00 0.00 7.11 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 9.20 4.27 0.00 3.88 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.30 4.44 0.00 2.72 2.88 0.00 0.00 6.93 8.06 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 65 D 8.03 4.52 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.26 4.18 2.22 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 0.72 0.00 0.00 0.90 0.00 0.00 67 A 9.17 4.29 1.25 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 68 Q 7.53 4.62 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 69 L 8.47 4.72 0.00 1.57 1.56 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 70 I 8.75 4.60 1.86 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 1.12 0.76 0.87 0.00 0.00 71 K 8.51 3.33 0.00 1.19 1.46 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.08 0.78 7.81 72 A 8.35 4.41 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.33 4.84 0.00 2.70 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.54 4.06 0.00 1.55 1.68 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 75 E 7.54 4.68 0.00 2.08 1.88 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 2.13 2.19 0.00 76 H 8.76 4.45 0.00 3.26 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 9.52 4.85 0.00 3.18 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 H 8.93 4.17 0.00 3.27 3.30 0.00 5.73 0.00 0.00 0.00 0.00 6.91 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.