NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7913 8.3249 122.8260 57.9743 41.2532 175.6885 2 V 3.6370 6.5785 118.0393 59.9834 28.7642 175.9841 3 N 4.3892 8.7632 121.4992 57.0898 39.3956 176.8820 4 Q 4.0245 7.9854 118.4246 59.1703 28.3986 178.1925 5 H 4.1463 8.1290 118.7994 59.3423 29.7844 177.2181 6 L 3.9512 7.8092 120.5285 57.6071 41.4126 178.6808 7 C 4.1527 8.5261 119.3466 62.7427 31.4406 176.0262 8 G 3.6348 8.2728 107.0726 47.7895 0.0000 175.4939 9 S 3.9471 7.6353 114.5696 61.6013 62.3945 176.0744 10 H 4.2405 7.9583 118.8232 58.4553 28.3956 177.6400 11 L 3.9387 8.2266 121.3554 58.0824 41.4974 180.1147 12 V 3.3155 7.6744 112.0441 64.0912 31.4422 178.5728 13 E 4.0009 7.7343 117.5570 59.0914 29.1851 179.1645 14 A 3.9644 8.0440 120.9002 55.0361 18.4905 179.4915 15 L 3.6280 7.8950 117.9234 57.9670 41.4079 178.9076 16 Y 4.3696 7.6991 119.2239 61.0730 38.4668 178.5435 17 L 3.8298 7.5655 117.6163 57.6831 41.8226 179.4171 18 V 3.6965 7.7383 117.3610 66.2401 31.9530 177.6379 19 C 4.3194 8.8405 116.7818 60.0750 28.4400 175.1951 20 G 3.6585 8.2923 109.2359 46.5234 0.0000 177.1903 21 E 4.1034 8.8402 123.1383 58.5963 29.4856 178.2053 22 R 3.9140 7.8619 117.4544 56.9694 30.4362 178.2446 23 G 4.0036 7.9986 106.4266 45.9546 0.0000 171.9378 24 F 4.8428 7.7293 111.6868 56.1988 40.1512 172.7555 25 F 4.9829 9.1352 123.0822 56.6325 40.8398 173.5224 26 Y 4.6318 8.7685 129.8548 56.1466 39.1841 175.2079 27 T 3.9843 7.3016 117.7000 58.6552 69.1644 171.7258 28 P 4.0145 0.0000 0.0000 65.4601 31.6411 178.4735 29 K 3.9993 7.4848 118.3468 59.4657 32.4901 176.8929 30 T 3.9966 7.5391 119.3165 63.9725 68.2923 174.3886 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 F 8.32 4.79 0.00 2.91 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 2 V 6.58 3.64 1.86 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 0.73 0.00 0.00 0.21 0.00 0.00 3 N 8.76 4.39 0.00 2.79 2.97 0.00 0.00 6.99 7.74 0.00 0.00 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 Q 7.99 4.02 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 5 H 8.13 4.15 0.00 3.19 3.35 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.81 3.95 0.00 1.81 1.75 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.53 4.15 0.00 3.04 3.16 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 8 G 8.27 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.64 3.95 0.00 3.77 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 10 H 7.96 4.24 0.00 3.30 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.23 3.94 0.00 1.76 1.64 1.02 0.77 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 12 V 7.67 3.32 2.07 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 0.16 0.00 0.00 0.85 0.00 0.00 13 E 7.73 4.00 0.00 2.20 1.99 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 2.41 2.39 0.00 14 A 8.04 3.96 1.32 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 0.00 0.00 15 L 7.89 3.63 0.00 0.64 0.35 0.71 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.70 4.37 0.00 3.32 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 17 L 7.57 3.83 0.00 1.80 1.69 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.74 3.70 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 0.81 0.00 0.00 0.90 0.00 0.00 19 C 8.84 4.32 0.00 3.20 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 20 G 8.29 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.84 4.10 0.00 1.96 2.03 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 0.00 2.30 2.31 0.00 22 R 7.86 3.91 0.00 2.01 2.04 0.00 3.33 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 23 G 8.00 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 24 F 7.73 4.84 0.00 3.24 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 25 F 9.14 4.98 0.00 2.85 3.08 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 0.00 0.00 0.00 0.00 26 Y 8.77 4.63 0.00 3.23 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.30 3.98 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 28 P 0.00 4.01 0.00 2.09 1.96 0.00 3.40 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.88 0.00 29 K 7.48 4.00 0.00 1.68 1.81 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.34 7.81 30 T 7.54 4.00 4.13 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 1.20 0.00 0.00