NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8015 8.3249 122.8239 58.2721 40.6988 174.6141 2 V 3.7844 6.4066 118.2748 60.8246 32.6820 177.3236 3 N 4.2814 8.8603 118.8733 57.0948 38.9695 176.2368 4 Q 4.0298 8.0075 118.3978 59.0869 28.3947 177.9954 5 H 4.1438 8.1513 118.8206 59.3804 29.6631 177.2075 6 L 3.9729 7.9058 120.7402 57.6873 41.3937 178.8008 7 C 4.1858 8.5521 119.3100 62.6341 31.4904 175.8477 8 G 3.6639 8.5104 107.5648 47.8913 0.0000 175.5117 9 S 3.9333 7.6370 114.1217 61.5517 62.3697 176.0655 10 H 4.0994 7.8780 118.6740 58.6222 28.3188 177.7268 11 L 3.8903 8.0560 120.9913 58.0230 41.4509 180.1090 12 V 3.1481 7.4545 112.1861 63.9541 31.3780 178.2811 13 E 3.8554 7.8393 118.9901 59.1060 29.4381 178.7005 14 A 3.9419 8.0288 120.8352 55.2059 18.3763 179.5496 15 L 3.6557 7.8450 117.7929 57.8818 41.3018 179.0970 16 Y 4.2742 7.7358 119.4218 60.7844 38.5195 178.3404 17 L 3.8638 7.7738 118.6688 57.7273 41.8505 179.3748 18 V 3.6853 7.8362 117.4370 66.2279 31.7920 177.6290 19 C 4.2893 8.5929 116.9248 60.1405 28.4113 175.2216 20 G 3.6161 8.2608 109.1067 46.3269 0.0000 177.1749 21 E 4.0579 8.8755 123.0676 58.8023 29.4340 178.2801 22 R 3.8927 7.9301 117.7957 57.0036 30.3122 178.1897 23 G 3.9634 8.3698 106.8386 45.3204 0.0000 171.8080 24 F 4.8355 7.6754 112.0438 55.9494 40.2474 172.8783 25 F 4.8749 8.2268 115.9669 55.0625 39.4885 174.0584 26 Y 4.7855 8.9774 126.6496 56.2061 39.1749 175.0068 27 T 4.4675 7.7964 118.0123 58.6839 68.6444 171.7801 28 P 4.1578 0.0000 0.0000 65.3281 32.1366 177.5590 29 K 4.1441 7.6309 122.2962 56.4599 32.9594 175.7382 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 4.80 0.00 2.97 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 2 V 6.41 3.78 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.39 0.00 0.00 3 N 8.86 4.28 0.00 2.83 3.00 0.00 0.00 7.01 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 8.01 4.03 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 8.15 4.14 0.00 3.19 3.42 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 7.91 3.97 0.00 1.77 1.73 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.55 4.19 0.00 3.05 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 8 G 8.51 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 9 S 7.64 3.93 0.00 3.79 3.92 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 10 H 7.88 4.10 0.00 3.34 3.30 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 8.06 3.89 0.00 1.75 1.62 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.45 3.15 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.76 0.00 0.00 13 E 7.84 3.86 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 14 A 8.03 3.94 1.31 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 0.00 0.00 15 L 7.85 3.66 0.00 0.51 0.56 0.61 0.48 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 16 Y 7.74 4.27 0.00 3.24 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 17 L 7.77 3.86 0.00 1.79 1.69 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.84 3.69 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 0.79 0.00 0.00 0.90 0.00 0.00 19 C 8.59 4.29 0.00 3.21 3.21 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 0.00 0.00 0.00 0.00 20 G 8.26 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.88 4.06 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 2.29 2.31 0.00 22 R 7.93 3.89 0.00 2.02 2.04 0.00 3.31 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 23 G 8.37 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 4.84 0.00 2.97 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.87 0.00 3.19 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 26 Y 8.98 4.79 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 7.80 4.47 4.25 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 1.35 0.00 0.00 28 P 0.00 4.16 0.00 2.11 1.91 0.00 3.45 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.84 0.00 29 K 7.63 4.14 0.00 1.68 1.66 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.37 7.81