NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3031 8.1576 119.9897 56.5903 34.1103 175.9688 2 W 4.3487 8.3355 115.1886 57.5215 27.8367 175.5528 3 A 4.1700 7.2019 120.6216 53.5919 18.3399 179.3086 4 S 5.2172 8.0994 110.2728 57.6549 63.3409 174.9903 5 L 5.1637 8.1500 120.2970 55.9485 42.2564 177.8169 6 W 4.5757 8.3959 116.8195 58.4159 29.0357 178.0066 7 N 3.1815 7.4016 116.4064 53.9900 36.7971 176.0397 8 W 4.5635 7.9294 114.5695 56.8024 30.1127 177.5799 9 F 2.8283 7.3895 120.3911 59.8941 38.5010 175.3475 10 N 4.7892 8.0807 116.7199 53.8276 38.2227 177.2546 11 I 2.8983 7.5502 120.9891 63.9171 37.2542 177.7243 12 T 3.8495 7.2438 107.9188 63.0397 68.6193 175.2132 13 N 4.5261 7.5000 119.5087 55.4442 39.2825 176.4401 14 W 4.8144 7.5690 117.1751 58.5723 29.1701 178.2027 15 L 3.9348 7.4793 121.1719 58.4525 39.4331 179.1880 16 W 3.9847 8.3011 127.7208 60.1752 30.7089 176.7247 17 Y 4.3903 8.2496 119.0554 60.2192 38.3288 177.1805 18 I 3.5029 7.5870 119.9005 63.8884 37.4411 175.9384 19 K 4.0158 7.8975 122.6701 56.5597 31.8592 176.6977 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 8.16 4.30 0.00 1.70 1.96 0.00 0.96 0.00 0.00 0.75 0.00 0.00 2.62 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.18 7.81 2 W 8.34 4.35 0.00 3.71 3.41 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 3 A 7.20 4.17 1.09 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 0.00 0.00 4 S 8.10 5.22 0.00 4.06 3.98 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 0.00 0.00 0.00 0.00 5 L 8.15 5.16 0.00 2.18 2.16 1.02 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.40 4.58 0.00 3.64 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 7.40 3.18 0.00 2.63 2.46 0.00 0.00 5.91 9.03 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 8 W 7.93 4.56 0.00 3.53 3.31 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 9 F 7.39 2.83 0.00 3.07 3.05 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 0.00 0.00 0.00 0.00 10 N 8.08 4.79 0.00 3.26 3.43 0.00 0.00 7.51 7.35 0.00 0.00 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 I 7.55 2.90 1.84 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.70 -0.06 0.00 0.00 12 T 7.24 3.85 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 13 N 7.50 4.53 0.00 3.08 3.00 0.00 0.00 7.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 W 7.57 4.81 0.00 3.82 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 7.48 3.93 0.00 1.67 1.39 1.02 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 16 W 8.30 3.98 0.00 3.53 3.21 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 17 Y 8.25 4.39 0.00 3.08 3.32 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 18 I 7.59 3.50 2.01 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.21 0.89 0.00 0.00 19 K 7.90 4.02 0.00 1.43 1.41 0.00 1.47 0.00 0.00 1.57 0.00 0.00 2.54 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.32 1.19 7.81