NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0410 8.3544 109.7428 44.3601 0.0000 174.0594 2 I 3.9032 7.6182 115.6364 60.3531 41.1643 172.4591 3 V 3.4677 7.8382 119.4122 66.0605 32.2053 177.0378 4 E 4.1918 8.0575 117.3027 58.4868 29.5585 177.7295 5 Q 4.2119 7.7986 118.2181 58.4075 29.7800 177.1486 6 C 4.6708 8.5810 116.4498 57.2804 40.6684 174.2315 7 C 4.6929 8.3165 120.5623 59.3130 31.2901 173.6879 8 T 4.4906 7.9146 108.7634 62.7177 69.9192 176.1899 9 S 4.4770 7.7587 115.3492 57.6165 64.5199 169.9211 10 I 3.4677 7.8323 127.8278 60.3038 37.0054 174.6908 11 C 4.6723 8.5202 121.7041 56.3098 39.1156 173.5965 12 S 4.7575 8.4482 116.5804 57.3677 64.7776 175.3561 13 L 3.8944 8.4678 124.8371 58.9237 41.7338 178.6908 14 Y 4.1267 8.0421 115.9586 61.0593 37.3747 178.1351 15 Q 4.2297 8.1792 118.6772 58.9705 28.8882 178.6209 16 L 4.3895 8.1638 120.2134 57.7886 41.5440 179.1824 17 E 4.0306 8.0318 118.4819 59.5075 29.1274 178.9653 18 N 4.1334 7.6422 114.6293 56.2505 38.6557 175.5612 19 Y 4.2951 7.6638 113.6126 58.7744 38.5713 175.5530 20 C 4.2009 7.9154 120.4504 59.4975 32.2406 172.8771 21 N 4.5171 8.5674 120.9076 53.8298 38.5742 174.7982 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 G 8.35 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.62 3.90 1.37 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.46 0.77 0.00 0.00 3 V 7.84 3.47 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.88 0.00 0.00 4 E 8.06 4.19 0.00 1.99 1.97 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 2.29 2.36 0.00 5 Q 7.80 4.21 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 6 C 8.58 4.67 0.00 2.92 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.32 4.69 0.00 2.82 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.91 4.49 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 1.24 0.00 0.00 9 S 7.76 4.48 0.00 3.84 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 10 I 7.83 3.47 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 1.43 1.18 0.92 0.00 0.00 11 C 8.52 4.67 0.00 2.98 3.11 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 12 S 8.45 4.76 0.00 4.13 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 13 L 8.47 3.89 0.00 1.53 1.38 0.79 0.29 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 14 Y 8.04 4.13 0.00 3.19 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 15 Q 8.18 4.23 0.00 2.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 16 L 8.16 4.39 0.00 1.89 1.78 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.03 4.03 0.00 2.23 2.02 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 2.31 2.29 0.00 18 N 7.64 4.13 0.00 2.25 2.46 0.00 0.00 6.89 7.29 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 19 Y 7.66 4.30 0.00 3.17 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 20 C 7.92 4.20 0.00 2.98 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 21 N 8.57 4.52 0.00 2.74 2.68 0.00 0.00 6.88 7.57 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