NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4471 8.3349 115.4125 57.6617 64.3887 173.1115 23 S 4.0991 8.2825 116.7614 57.1847 63.4236 172.8525 24 D 4.4535 8.3951 123.2645 53.5541 42.8153 175.3286 25 P 4.3014 0.0000 0.0000 66.0202 31.0889 178.7366 26 L 4.0337 8.3706 118.9315 57.4439 41.3730 179.5338 27 V 3.6196 7.8425 118.5082 65.7340 31.5146 178.2040 28 V 3.5479 7.7710 117.3390 65.9109 31.1677 177.7410 29 A 3.9469 7.6785 118.5456 55.1710 18.3683 179.0619 30 A 4.0846 7.7671 117.9279 55.5051 18.7053 179.6551 31 S 4.2871 8.3019 113.6891 61.6620 62.8323 177.5713 32 I 4.0881 7.8161 119.8425 61.8502 36.5407 178.1887 *34 G 3.9004 8.0600 111.2152 45.8348 0.0000 175.8889 35 I 3.6552 7.9550 121.0440 64.0779 37.1158 177.9413 36 L 3.9443 7.8337 120.9656 58.6341 41.8807 178.4471 37 H 4.2388 8.2738 117.2840 59.5970 29.7544 177.0641 38 L 4.0603 8.3363 120.9544 57.5504 41.3895 179.4842 39 I 3.7476 8.2069 120.3712 64.5529 37.2088 178.4506 40 L 4.0523 8.0524 119.7140 57.3829 41.5084 179.4055 41 W 4.0145 8.3747 128.3732 60.4899 30.5341 178.1556 42 I 3.6771 8.2780 119.9189 64.3310 36.3610 178.2486 43 L 3.9362 7.6464 118.5234 58.0465 41.5669 178.8751 44 D 4.3226 7.6045 116.2058 57.2181 41.2065 177.9167 45 R 3.7114 7.0941 117.2153 58.1183 30.0436 176.1210 46 L 4.0913 7.2710 123.0085 55.1800 41.5686 176.6419 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 4.45 0.00 3.99 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 23 S 8.28 4.10 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.45 0.00 2.67 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 25 P 0.00 4.30 0.00 2.30 2.30 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 26 L 8.37 4.03 0.00 1.83 1.75 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.84 3.62 2.23 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 1.06 0.00 0.00 0.93 0.00 0.00 28 V 7.77 3.55 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 0.99 0.00 0.00 0.97 0.00 0.00 29 A 7.68 3.95 1.36 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 0.00 0.00 30 A 7.77 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.29 0.00 4.02 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 32 I 7.82 4.09 2.01 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 0.80 0.92 0.00 0.00 *34 G 8.06 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 0.00 0.00 0.00 35 I 7.95 3.66 2.04 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 0.81 0.93 0.00 0.00 36 L 7.83 3.94 0.00 1.80 1.71 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.27 4.24 0.00 3.25 3.48 0.00 5.74 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.34 4.06 0.00 1.76 1.70 0.87 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.21 3.75 2.10 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.86 0.94 0.00 0.00 40 L 8.05 4.05 0.00 1.93 1.77 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 41 W 8.37 4.01 0.00 3.41 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 3.68 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.27 0.95 0.00 0.00 43 L 7.65 3.94 0.00 1.74 1.71 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 44 D 7.60 4.32 0.00 2.67 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 7.09 3.71 0.00 0.84 1.57 0.00 3.10 0.00 0.00 2.80 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.49 0.00 46 L 7.27 4.09 0.00 1.77 1.52 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.