NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 R 4.4769 8.2393 119.0729 55.8885 31.5794 175.2565 8 P 4.7949 0.0000 0.0000 60.5584 31.3372 179.7137 *9 F 3.5119 8.9399 116.5035 57.5638 36.5284 174.7530 10 S 4.8796 8.4153 116.5768 58.3000 64.8032 171.0142 11 D 4.5249 8.5528 121.2523 54.8635 40.0878 177.9144 12 I 4.4724 8.0624 121.7940 59.6877 37.3658 175.3499 13 I 4.8136 7.9293 118.2203 62.0253 43.1126 179.1685 14 T 4.4686 7.5305 112.1555 60.7411 69.9874 177.0086 15 S 4.5869 8.5653 123.4359 60.4865 64.3366 178.2530 16 V 4.0816 7.8074 120.6174 60.4693 32.9539 176.9121 17 R 4.1758 9.0180 126.9272 56.4366 28.4078 173.3722 *18 Y 4.2383 8.8905 123.1654 57.4146 38.5617 179.7635 *19 W 3.2925 8.6852 118.7077 57.9116 27.2744 182.8502 20 V 3.3431 7.9911 118.9448 63.2904 29.4095 178.6802 21 I 3.9583 8.7807 118.0994 61.9690 36.7737 178.6407 *22 H 4.5873 8.8523 115.1885 57.4741 25.3421 176.8081 23 S 4.7399 7.7796 122.1883 63.9164 63.2328 180.6786 24 I 4.2091 7.6911 125.6713 65.0507 35.4146 180.4266 25 T 4.1682 7.9542 116.1907 66.4804 68.0511 181.5058 26 I 4.1335 7.4873 123.5084 65.0847 35.3313 180.7115 27 P 4.8157 0.0000 0.0000 64.9463 31.1152 179.6966 28 A 4.8766 7.4179 119.3998 53.7607 20.7106 178.5026 29 L 4.3895 7.8122 122.7633 58.8083 41.5816 185.0000 *30 F 4.2823 7.8756 119.3142 60.4033 38.2919 181.2057 31 I 3.9827 7.7115 117.9260 61.4478 35.5365 178.6185 32 A 4.3688 7.3837 119.5612 53.5368 18.6843 177.8710 33 G 4.1148 8.0362 104.4736 45.1935 0.0000 173.6175 *34 W 4.3778 8.0843 121.5672 58.3968 30.3793 183.6163 35 L 4.1812 7.6037 120.7675 56.4303 40.5696 181.5488 *36 F 4.3548 8.1659 117.4105 60.2239 38.6424 183.5654 37 V 4.2550 7.3066 119.2816 61.3671 31.2959 179.2178 38 S 4.5242 7.9709 118.6484 61.2352 64.9790 179.4949 39 T 4.4094 7.4328 108.7938 60.1752 69.0585 176.4529 40 G 4.4335 7.3165 109.8261 47.0424 0.0000 174.2703 41 L 4.2370 7.8926 122.0722 54.3523 41.0682 178.6392 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 7 R 8.24 4.48 0.00 1.85 1.84 0.00 3.23 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 8 P 0.00 4.79 0.00 2.25 1.52 0.00 3.85 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 *9 F 8.94 3.51 0.00 2.49 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.42 4.88 0.00 3.60 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.55 4.52 0.00 2.69 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.06 4.47 1.87 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 1.27 1.16 0.91 0.00 0.00 13 I 7.93 4.81 1.87 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 1.27 0.93 0.91 0.00 0.00 14 T 7.53 4.47 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 15 S 8.57 4.59 0.00 3.60 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.81 4.08 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 0.87 0.00 0.00 0.93 0.00 0.00 17 R 9.02 4.18 0.00 1.81 1.58 0.00 3.22 0.00 0.00 3.26 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.16 0.00 *18 Y 8.89 4.24 0.00 2.23 2.32 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 *19 W 8.69 3.29 0.00 2.68 2.28 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 0.00 20 V 7.99 3.34 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 0.78 0.00 0.00 0.93 0.00 0.00 21 I 8.78 3.96 1.87 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 1.27 0.54 0.91 0.00 0.00 *22 H 8.85 4.59 0.00 3.09 3.05 0.00 7.14 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.78 4.74 0.00 3.54 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.69 4.21 1.87 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 1.50 0.55 0.91 0.00 0.00 25 T 7.95 4.17 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 26 I 7.49 4.13 1.87 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 1.38 0.54 0.91 0.00 0.00 27 P 0.00 4.82 0.00 2.16 1.97 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.64 0.00 28 A 7.42 4.88 1.26 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 0.00 0.00 0.00 29 L 7.81 4.39 0.00 1.64 1.67 0.92 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 *30 F 7.88 4.28 0.00 2.21 2.32 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 31 I 7.71 3.98 1.87 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 1.35 0.54 0.91 0.00 0.00 32 A 7.38 4.37 1.42 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 0.00 0.00 33 G 8.04 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 *34 W 8.08 4.38 0.00 2.41 2.25 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 35 L 7.60 4.18 0.00 1.70 1.70 0.92 1.11 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 *36 F 8.17 4.35 0.00 2.19 2.31 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 0.00 37 V 7.31 4.25 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 0.83 0.00 0.00 0.93 0.00 0.00 38 S 7.97 4.52 0.00 3.58 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.43 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 1.21 0.00 0.00 40 G 7.32 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 41 L 7.89 4.24 0.00 1.68 1.44 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.