NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 C 4.8860 8.4549 118.1101 56.9156 40.5664 172.8418 3 V 4.3444 8.6636 114.9820 58.8504 34.7947 173.7443 4 W 4.9307 9.7235 125.5617 56.1690 29.5559 176.2692 5 E 4.3480 9.0784 125.6003 55.2688 27.3923 175.2302 6 G 4.1994 8.3013 113.0146 45.1922 0.0000 171.6714 7 N 5.0916 7.9753 116.0957 51.2217 39.2511 173.7669 8 K 4.7831 8.1140 118.9560 55.1842 36.3919 174.1434 9 L 4.4666 7.7907 125.5536 53.9754 43.4183 175.2098 10 H 4.9288 9.0651 121.7390 54.0974 33.0266 173.3932 11 C 4.5155 8.4781 116.9497 57.2864 42.0274 174.1499 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 2 C 8.45 4.89 0.00 2.78 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 3 V 8.66 4.34 2.24 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 0.68 0.00 0.00 0.99 0.00 0.00 4 W 9.72 4.93 0.00 3.26 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 5 E 9.08 4.35 0.00 2.12 1.94 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 2.21 2.29 0.00 6 G 8.30 4.20 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 0.00 7 N 7.98 5.09 0.00 2.87 2.94 0.00 0.00 5.79 7.20 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 8 K 8.11 4.78 0.00 1.91 1.65 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.20 1.37 7.81 9 L 7.79 4.47 0.00 0.27 0.93 0.12 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 10 H 9.07 4.93 0.00 3.07 3.09 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 C 8.48 4.52 0.00 2.85 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00