NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9994 8.3393 109.7425 45.6832 0.0000 173.1431 2 C 4.6688 9.6087 113.8087 55.8668 42.1386 173.2389 3 L 5.1020 7.6509 119.5305 53.0834 45.7894 176.5089 4 E 4.3221 8.0491 123.9774 54.6297 30.9097 175.1220 5 F 4.4882 8.4279 122.1975 59.2901 39.7261 173.8935 6 W 2.7921 6.4899 135.0000 57.5734 29.8388 173.7774 7 W 4.7387 7.4725 124.8472 56.1197 28.1365 175.3808 8 K 4.2109 8.5800 124.9789 56.6323 32.6655 173.7837 9 C 5.2096 8.0978 117.4060 54.0823 45.1977 172.4505 10 N 5.3537 8.4271 114.0485 50.9576 42.2816 174.1375 11 P 4.4626 0.0000 0.0000 64.2131 32.0744 176.7065 12 N 4.6807 8.1618 116.3205 54.7007 39.5953 175.3534 13 D 4.6240 7.9544 114.9179 52.2172 41.3432 172.5211 14 D 4.5688 8.2626 125.8550 53.2966 42.7225 173.1815 15 K 4.4727 8.4860 122.1957 56.2739 34.0947 176.9639 16 C 4.5501 7.8393 116.5335 57.0050 39.2999 172.3333 17 C 4.4729 8.0306 123.2913 57.4601 40.2729 175.5506 18 R 4.1151 7.7699 118.8326 55.4574 30.1161 175.7680 19 P 4.2264 0.0000 0.0000 64.7431 31.4263 176.9601 20 K 4.2178 7.5200 116.1074 56.0362 33.6601 175.9464 21 L 4.6860 7.3050 118.0089 54.4019 42.4901 176.5172 22 K 4.1065 8.2454 118.3921 55.7099 35.4837 173.6313 23 C 4.6080 9.2707 128.1569 57.5397 41.5106 172.7070 24 S 4.7593 8.7458 120.0353 56.8691 63.6798 174.3836 25 K 4.3041 8.5813 122.1591 57.2245 33.1052 177.5173 26 L 3.8874 7.2447 121.5573 58.0644 41.7589 178.8581 27 F 4.7939 7.9211 107.5574 57.3799 37.6151 173.5784 28 K 3.9967 8.3983 118.2982 58.0578 29.4051 175.2065 29 L 4.8346 7.7302 115.7176 52.9174 47.0915 177.2755 30 C 4.8046 8.1882 118.5617 57.7463 33.9727 173.0693 31 N 5.4102 8.8040 123.2179 52.7616 40.5396 175.3394 32 F 4.6523 9.1897 124.6320 57.9793 41.0971 173.6369 33 S 4.4921 8.3222 112.3131 59.5982 63.8349 174.5180 34 F 4.5836 7.9359 122.0841 57.9076 38.6149 174.8112 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 8.34 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.61 4.67 0.00 3.21 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 5.10 0.00 2.21 2.02 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.05 4.32 0.00 1.27 1.12 0.00 0.00 0.00 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 2.19 0.00 5 F 8.43 4.49 0.00 3.26 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 6 W 6.49 2.79 0.00 3.42 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 W 7.47 4.74 0.00 3.84 3.14 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 0.00 0.00 0.00 0.00 8 K 8.58 4.21 0.00 1.69 1.75 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.67 7.81 9 C 8.10 5.21 0.00 3.08 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 8.43 5.35 0.00 2.71 2.73 0.00 0.00 6.60 8.03 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 11 P 0.00 4.46 0.00 2.18 2.17 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 12 N 8.16 4.68 0.00 2.71 2.90 0.00 0.00 6.84 8.06 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 13 D 7.95 4.62 0.00 2.74 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.26 4.57 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.49 4.47 0.00 1.82 1.90 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.53 7.81 16 C 7.84 4.55 0.00 3.08 3.14 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 0.00 0.00 0.00 0.00 17 C 8.03 4.47 0.00 3.14 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.77 4.12 0.00 1.86 1.77 0.00 3.18 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 19 P 0.00 4.23 0.00 1.94 2.08 0.00 3.55 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 20 K 7.52 4.22 0.00 1.29 1.40 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.51 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.69 0.62 7.81 21 L 7.31 4.69 0.00 1.77 1.60 1.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.25 4.11 0.00 1.76 1.58 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.28 7.81 23 C 9.27 4.61 0.00 3.03 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 24 S 8.75 4.76 0.00 3.94 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.58 4.30 0.00 1.86 1.89 0.00 1.48 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.44 7.81 26 L 7.24 3.89 0.00 1.27 0.55 0.45 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.92 4.79 0.00 2.83 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.40 4.00 0.00 2.04 1.98 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.42 7.81 29 L 7.73 4.83 0.00 0.74 1.05 0.53 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.19 4.80 0.00 3.04 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.80 5.41 0.00 2.85 2.78 0.00 0.00 6.61 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 9.19 4.65 0.00 3.01 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.32 4.49 0.00 3.72 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 34 F 7.94 4.58 0.00 3.23 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00