NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1321 8.3149 120.0946 56.1868 33.5148 174.4969 2 F 4.9133 8.2692 117.4929 55.5889 42.3936 173.9296 3 F 5.2099 8.9561 122.8916 55.8183 43.4653 173.5199 4 E 4.7008 8.8533 124.2307 54.3102 32.5479 174.3472 5 A 4.6901 8.5408 127.0711 50.3173 22.1702 175.0743 6 A 4.6903 8.5075 123.8572 50.2337 22.1832 175.3341 7 A 4.7660 8.4738 124.0503 50.2608 22.1846 175.6391 8 K 4.7916 8.5432 120.6058 54.5686 36.0026 176.1221 9 K 4.9006 8.7635 121.3789 54.7895 35.8593 175.8019 10 F 5.0773 9.0855 120.7254 55.8732 42.6807 174.2315 11 F 4.7999 8.7222 122.4554 55.6924 42.6042 174.3746 12 E 4.1778 8.8341 124.2927 56.4780 29.4775 175.9692 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 K 8.31 4.13 0.00 1.24 1.69 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.33 7.81 2 F 8.27 4.91 0.00 3.02 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 3 F 8.96 5.21 0.00 2.89 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.85 4.70 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 5 A 8.54 4.69 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.51 4.69 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.47 4.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.54 4.79 0.00 1.70 1.80 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.46 7.81 9 K 8.76 4.90 0.00 1.73 1.86 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.50 7.81 10 F 9.09 5.08 0.00 2.85 2.90 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 11 F 8.72 4.80 0.00 2.87 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.83 4.18 0.00 1.94 1.82 0.00 0.00 0.00 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 2.31 0.00