NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1618 8.0093 120.7952 61.6389 40.1236 177.6211 2 D 4.0989 8.4306 119.4648 56.4523 40.0626 177.1372 3 V 3.3490 9.6779 118.9252 64.2393 35.8330 177.1476 4 L 3.9441 7.8164 123.0683 57.9422 41.7822 179.6852 5 G 3.5539 9.0261 104.7481 46.5171 0.0000 173.0588 6 W 4.5932 8.7997 118.9261 58.1634 31.1857 177.3434 7 V 3.4873 8.0167 116.8944 66.0121 31.1962 177.7602 8 A 3.9036 7.9214 122.7874 55.3711 19.9475 179.0357 9 L 3.3426 7.9700 120.9388 53.9380 40.7295 181.5310 10 L 3.5248 7.8140 128.7460 58.3408 43.8689 176.4507 11 V 3.3153 7.4810 114.5239 67.2148 31.1088 177.8653 12 V 3.7362 7.9044 117.2051 66.4178 31.4613 178.5757 13 F 4.3518 7.5096 116.6500 60.8407 39.0023 177.0979 14 T 4.3613 8.3438 114.9588 65.1792 68.5154 176.9827 15 W 4.2339 8.1789 130.6348 60.6377 30.9091 177.6297 16 S 4.6031 9.4002 108.8752 59.0694 61.4808 174.1806 17 I 4.3701 7.7687 120.3579 61.5397 38.8856 176.9096 18 A 4.0913 7.7139 123.2514 54.7470 16.5269 179.1535 19 M 3.7502 7.5683 114.0147 58.0305 31.2471 179.0997 20 V 3.5906 7.2672 118.8771 66.1244 31.7861 178.1882 21 V 3.6252 7.8077 112.1334 64.3257 31.3647 178.4040 22 W 4.1611 7.9100 127.6142 60.4149 29.9537 178.0509 23 G 3.1524 8.1194 105.1016 47.5604 0.0000 175.7734 24 R 3.9189 7.3889 119.5874 58.5090 30.2857 177.1765 25 N 4.5146 7.5307 113.7376 54.5210 38.5662 176.5281 26 G 3.5468 7.3424 107.1894 47.0168 0.0000 173.3094 27 L 4.0890 6.0961 124.0633 54.5263 42.2374 176.1411 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 8.01 4.16 1.90 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 1.50 1.37 0.95 0.00 0.00 2 D 8.43 4.10 0.00 3.18 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 9.68 3.35 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 0.98 0.00 0.00 0.96 0.00 0.00 4 L 7.82 3.94 0.00 1.75 1.70 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 5 G 9.03 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 4.59 0.00 3.56 3.24 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 0.00 0.00 0.00 0.00 7 V 8.02 3.49 2.05 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 0.93 0.00 0.00 1.03 0.00 0.00 8 A 7.92 3.90 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.97 3.34 0.00 1.73 0.63 0.84 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 10 L 7.81 3.52 0.00 1.94 1.76 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.48 3.32 2.11 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 0.82 0.00 0.00 0.89 0.00 0.00 12 V 7.90 3.74 2.06 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 1.25 0.00 0.00 0.84 0.00 0.00 13 F 7.51 4.35 0.00 3.26 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 14 T 8.34 4.36 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 15 W 8.18 4.23 0.00 3.29 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 9.40 4.60 0.00 4.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.77 4.37 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.19 0.94 0.00 0.00 18 A 7.71 4.09 1.35 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 0.00 0.00 19 M 7.57 3.75 0.00 1.85 2.12 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.68 0.00 20 V 7.27 3.59 2.16 0.00 0.00 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 0.97 0.00 0.00 21 V 7.81 3.63 2.10 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 0.79 0.00 0.00 1.07 0.00 0.00 22 W 7.91 4.16 0.00 3.49 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 23 G 8.12 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.39 3.92 0.00 1.86 1.89 0.00 3.11 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 25 N 7.53 4.51 0.00 2.75 2.85 0.00 0.00 5.97 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.34 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 6.10 4.09 0.00 0.95 1.18 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00