NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4836 8.1933 116.7948 58.2534 64.2249 174.0329 2 S 4.0264 8.3777 116.0012 60.6813 62.2216 175.0361 3 D 4.1823 8.7519 121.9113 56.8922 41.7473 176.0970 4 P 4.2710 0.0000 0.0000 65.3362 31.2613 178.7460 5 L 3.9957 7.9961 118.2817 57.7646 41.6233 179.7969 6 V 3.6196 7.2824 118.9867 64.6948 31.2228 178.4931 7 V 3.5177 7.6083 118.7204 65.7025 31.4205 177.7031 8 A 3.9778 8.0462 120.1625 55.2459 18.2193 179.3839 9 A 3.9413 8.1259 119.1225 55.3889 18.4498 179.9553 10 S 4.0719 8.0966 113.5402 61.9110 62.9329 177.0388 11 I 3.7254 7.8111 122.2814 64.3767 36.8531 178.4926 12 I 3.7995 7.9816 120.7521 64.3930 37.0011 178.6163 13 G 3.6862 8.1854 106.4079 47.9045 0.0000 175.6901 14 I 3.7411 7.8714 122.2820 64.0571 37.1675 178.4274 15 L 4.0115 8.0537 119.7930 58.1361 41.4972 179.0563 16 H 4.2628 8.3199 118.0116 59.2098 29.7954 176.9516 17 L 3.9683 8.0147 121.9967 58.2490 41.9611 178.9025 18 I 3.7477 7.8952 119.6393 64.4441 37.0979 178.2702 19 L 4.0373 8.0862 119.6534 57.6104 41.5231 179.3644 20 W 4.2246 8.4321 128.0779 60.6923 30.6503 177.9224 21 I 3.6602 8.0324 119.6703 64.3881 36.3151 178.1623 22 L 3.9413 7.8253 120.0019 58.2236 41.9612 178.4728 23 D 4.3828 7.8632 117.9946 57.3926 40.7886 178.6863 24 R 3.8084 7.4565 117.6275 58.7077 30.0653 177.0564 25 L 4.2008 7.6177 123.8506 55.3080 42.2501 176.2613 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 S 8.19 4.48 0.00 3.90 3.90 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 2 S 8.38 4.03 0.00 3.94 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.75 4.18 0.00 2.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.19 2.08 0.00 3.65 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 5 L 8.00 4.00 0.00 1.70 1.71 0.95 0.87 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 6 V 7.28 3.62 2.08 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 0.87 0.00 0.00 0.93 0.00 0.00 7 V 7.61 3.52 2.21 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 1.00 0.00 0.00 0.93 0.00 0.00 8 A 8.05 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.13 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.10 4.07 0.00 4.05 3.93 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 11 I 7.81 3.73 2.01 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 1.53 0.71 0.92 0.00 0.00 12 I 7.98 3.80 2.01 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 1.46 1.03 0.91 0.00 0.00 13 G 8.19 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.87 3.74 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.05 0.93 0.00 0.00 15 L 8.05 4.01 0.00 1.88 1.75 0.93 0.86 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 16 H 8.32 4.26 0.00 3.21 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.01 3.97 0.00 1.89 1.85 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.90 3.75 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.85 0.94 0.00 0.00 19 L 8.09 4.04 0.00 2.01 1.83 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 20 W 8.43 4.22 0.00 3.47 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.03 3.66 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.83 0.92 0.00 0.00 22 L 7.83 3.94 0.00 1.73 1.89 0.91 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 23 D 7.86 4.38 0.00 2.51 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.46 3.81 0.00 1.73 1.82 0.00 3.15 0.00 0.00 2.79 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.39 0.00 25 L 7.62 4.20 0.00 1.71 1.66 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00