NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 3.9268 8.0249 114.2622 61.0072 39.0925 174.6065 2 L 2.9457 7.9815 120.0256 52.9344 37.6939 172.0234 3 P 3.8249 0.0000 0.0000 61.8837 34.2992 176.6997 4 W 5.3309 8.0085 115.6042 56.5153 29.7205 175.5740 5 K 4.7215 8.0918 113.0181 55.5438 33.7181 177.0108 6 W 4.1499 8.3050 129.1176 56.7330 31.3367 174.2845 7 P 4.2781 0.0000 0.0000 63.1340 33.0964 176.4469 8 W 4.0160 7.3037 108.1052 57.5163 25.2966 173.7577 9 W 4.4671 8.6809 134.0683 56.8084 30.9652 173.8534 10 P 3.9561 0.0000 0.0000 61.0600 30.8499 174.6660 11 W 5.2590 7.0089 122.8189 54.7116 31.1980 175.6658 12 R 4.3430 8.8380 115.9596 56.3288 28.4060 176.9251 13 R 4.5168 7.7663 122.5166 57.0025 30.0079 175.6096 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 I 8.02 3.93 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.04 0.87 0.00 0.00 2 L 7.98 2.95 0.00 1.45 1.29 0.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 3 P 0.00 3.82 0.00 2.07 1.95 0.00 3.44 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.89 0.00 4 W 8.01 5.33 0.00 3.26 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 5 K 8.09 4.72 0.00 1.78 1.82 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.52 7.81 6 W 8.31 4.15 0.00 3.47 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.28 0.00 1.13 1.57 0.00 2.20 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 8 W 7.30 4.02 0.00 3.56 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.68 4.47 0.00 3.66 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.96 0.00 1.68 1.57 0.00 2.20 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.32 0.00 11 W 7.01 5.26 0.00 3.62 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.84 4.34 0.00 1.96 2.13 0.00 3.34 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 13 R 7.77 4.52 0.00 1.57 1.62 0.00 3.43 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00