NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4897 8.3349 116.7948 57.8840 65.1003 173.3741 23 S 4.6313 7.5230 114.9136 55.3967 66.6201 173.0995 24 D 4.5145 9.2708 124.3389 53.4853 43.3871 175.4380 25 P 4.2114 0.0000 0.0000 66.0369 31.4179 178.6038 26 L 3.9489 7.8979 118.2439 58.1135 41.9975 179.0862 27 V 3.5738 7.6819 117.7643 65.8417 31.6335 177.8347 28 V 3.5540 7.9455 117.8772 66.0832 31.0808 177.9012 29 A 3.9748 8.1795 119.2976 55.1586 18.3307 179.0986 30 A 4.0836 7.9198 118.1602 55.4629 18.6622 179.7825 31 S 4.2943 8.1267 113.7345 61.5140 62.7956 177.5041 32 I 4.1541 7.8070 121.1364 61.4609 36.7674 178.4216 *34 G 3.9053 8.0626 110.2892 45.8439 0.0000 176.0891 35 I 3.6874 7.9552 121.5422 63.8689 36.9639 178.1364 36 L 3.9485 8.2499 121.5475 58.4438 41.8691 178.2580 37 H 4.1881 8.3291 117.5454 59.4579 29.6882 176.5768 38 L 3.9963 8.0444 121.7739 58.2196 41.8183 178.8751 39 I 3.7612 7.9889 119.7003 64.5747 37.0298 178.3937 40 L 4.0235 8.2903 119.9481 57.4551 41.4383 179.4659 41 W 4.0872 8.4068 128.2777 60.5074 30.7083 177.9165 42 I 3.4726 8.2358 119.8339 64.5041 36.3833 178.3233 43 L 3.9311 7.9326 118.4663 57.7812 41.5095 178.7332 44 D 4.3833 7.9413 116.9705 57.5778 41.2410 178.4220 45 R 3.8080 7.2950 117.0211 58.6080 30.0003 177.2274 46 L 4.2127 7.5702 122.7262 54.9106 41.8035 176.6222 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 22 S 8.33 4.49 0.00 3.88 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.52 4.63 0.00 3.88 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.27 4.51 0.00 2.76 2.58 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 25 P 0.00 4.21 0.00 2.15 2.14 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 26 L 7.90 3.95 0.00 1.75 1.66 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.68 3.57 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.93 0.00 0.00 28 V 7.95 3.55 2.24 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 0.95 0.00 0.00 1.00 0.00 0.00 29 A 8.18 3.97 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 30 A 7.92 4.08 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 31 S 8.13 4.29 0.00 4.06 3.92 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 32 I 7.81 4.15 1.88 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 1.46 0.93 0.92 0.00 0.00 *34 G 8.06 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.96 3.69 2.02 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 1.41 0.72 0.93 0.00 0.00 36 L 8.25 3.95 0.00 1.81 1.70 0.95 0.86 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 37 H 8.33 4.19 0.00 3.24 3.50 0.00 5.75 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 38 L 8.04 4.00 0.00 1.78 1.86 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.99 3.76 2.06 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 1.56 0.73 0.94 0.00 0.00 40 L 8.29 4.02 0.00 1.94 1.80 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 41 W 8.41 4.09 0.00 3.41 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.24 3.47 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.04 0.92 0.00 0.00 43 L 7.93 3.93 0.00 1.83 1.71 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 44 D 7.94 4.38 0.00 2.66 2.64 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 45 R 7.30 3.81 0.00 1.17 1.55 0.00 2.97 0.00 0.00 2.66 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.30 0.00 46 L 7.57 4.21 0.00 1.56 1.52 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.