NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7597 8.3249 119.3980 57.3362 40.3743 173.9840 2 V 4.2639 8.2187 118.0707 57.9497 34.4060 174.0585 3 N 4.2545 8.9933 121.4500 54.4092 40.4098 175.2378 4 Q 4.0122 8.7935 129.0525 59.5306 29.4531 177.3887 5 H 4.2154 8.3087 118.9216 59.2473 30.0788 177.1482 6 L 4.0078 8.5075 121.0033 57.6070 41.3785 178.9145 7 C 4.2009 8.3921 118.9523 62.4548 31.5774 175.6813 8 G 3.7739 8.4014 107.6581 48.4017 0.0000 175.2257 9 S 3.9864 7.8133 115.2687 61.4099 62.3358 175.9184 10 H 4.1885 8.1070 120.3438 59.2715 29.6096 177.2693 11 L 3.9700 8.2314 121.1997 57.8831 41.4466 179.9746 12 V 3.4780 7.6386 112.3733 64.2226 31.4738 178.5277 13 E 3.9957 7.7737 116.9776 59.2060 29.1961 179.1989 14 A 3.9189 7.8819 120.7841 55.1540 18.4756 179.6024 15 L 3.6071 7.9743 117.8961 57.7919 41.4484 178.9469 16 Y 4.2242 7.8390 119.3579 60.8439 38.4896 178.4005 17 L 3.7305 7.5805 117.8709 57.7626 41.8589 179.4972 18 V 3.6630 7.6361 116.8601 66.3199 31.7738 177.6061 19 C 4.2916 8.7015 116.8849 60.2273 28.5338 175.5117 20 G 3.6529 8.2195 109.4287 46.4427 0.0000 176.4925 21 E 4.1862 8.7899 121.6866 57.9203 29.8231 178.1000 22 R 3.8745 7.7156 118.8905 57.4961 30.2496 178.0023 23 G 4.0292 8.7745 106.0063 45.3776 0.0000 171.9753 24 F 4.9865 7.8569 110.5420 56.3390 39.9053 173.0281 25 F 4.6982 9.1826 120.5689 56.1122 40.8048 175.0114 26 Y 4.8842 8.3088 124.0255 56.2452 41.8213 174.0520 27 T 4.6776 7.4812 121.9922 61.2404 72.4837 172.1347 28 P 4.4441 0.0000 0.0000 62.8585 31.4052 176.2224 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 1 F 8.32 4.76 0.00 3.05 3.06 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 0.00 0.00 0.00 0.00 2 V 8.22 4.26 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 0.69 0.00 0.00 0.97 0.00 0.00 3 N 8.99 4.25 0.00 2.79 2.77 0.00 0.00 6.77 7.31 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 4 Q 8.79 4.01 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.68 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 5 H 8.31 4.22 0.00 3.32 3.52 0.00 5.92 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.51 4.01 0.00 1.88 1.70 0.94 0.66 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 7 C 8.39 4.20 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.40 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 0.00 0.00 0.00 9 S 7.81 3.99 0.00 3.83 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.11 4.19 0.00 3.33 3.48 0.00 5.84 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 11 L 8.23 3.97 0.00 1.84 1.73 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.64 3.48 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.89 0.00 0.00 13 E 7.77 4.00 0.00 2.14 1.96 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 2.27 2.43 0.00 14 A 7.88 3.92 1.28 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 0.00 0.00 15 L 7.97 3.61 0.00 0.99 0.14 0.77 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.84 4.22 0.00 3.28 3.24 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 0.00 17 L 7.58 3.73 0.00 1.81 1.68 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.64 3.66 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 0.79 0.00 0.00 0.92 0.00 0.00 19 C 8.70 4.29 0.00 3.13 3.17 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 20 G 8.22 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 0.00 0.00 0.00 21 E 8.79 4.19 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 22 R 7.72 3.87 0.00 2.03 2.11 0.00 3.26 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 8.77 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 0.00 0.00 0.00 24 F 7.86 4.99 0.00 3.26 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 25 F 9.18 4.70 0.00 3.02 3.08 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 0.00 0.00 0.00 26 Y 8.31 4.88 0.00 3.40 2.88 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 27 T 7.48 4.68 4.17 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 1.21 0.00 0.00 28 P 0.00 4.44 0.00 2.12 2.13 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.32 0.00