NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.8105 8.4549 115.5914 55.2461 41.5544 172.1000 2 K 4.4540 8.5801 117.2767 53.8686 35.2209 175.3054 3 G 4.0035 8.7044 112.4804 44.9342 0.0000 171.7831 4 K 4.2454 8.2977 120.7970 57.3610 32.3859 176.3463 5 G 4.0253 8.9661 115.2438 45.2560 0.0000 173.5936 6 A 4.5753 7.8740 121.1320 50.5790 20.3718 176.6707 7 K 4.2333 8.4065 118.4908 56.5335 33.5077 174.1512 8 C 5.1501 8.6059 115.4055 54.0071 44.1076 173.3530 9 S 4.5642 8.3086 113.2882 56.4086 64.6945 175.3362 10 K 3.5193 8.8602 126.2407 58.5314 32.1261 177.6788 11 L 4.4350 6.9660 118.5283 54.6125 40.7867 175.2758 12 M 4.0723 7.0248 121.1546 56.1183 38.3761 173.6358 13 Y 3.6919 8.0173 115.1520 59.4115 36.1794 170.3783 14 D 4.7287 7.6859 118.0037 54.5375 39.9394 179.8081 15 C 5.1815 7.7203 115.4199 55.8190 41.6225 176.5606 16 C 3.9569 9.0065 123.0615 59.1606 40.0747 175.3805 17 T 4.4920 8.4965 109.8293 58.5242 67.1818 172.6892 18 G 3.7347 6.8337 111.4522 44.9537 0.0000 168.7566 19 S 4.7979 8.0069 117.2181 57.0852 66.7103 173.5269 20 C 4.4991 8.8162 120.0872 57.4011 38.3040 174.6088 21 R 4.3759 8.5142 125.2573 55.9826 30.4308 174.5270 22 S 4.0100 9.2497 119.6887 58.8280 60.9782 171.8289 23 G 4.0841 8.6134 108.6784 44.2272 0.0000 174.0186 24 K 4.7733 7.5589 118.4251 54.1707 34.5756 175.7504 25 C 4.8237 9.6638 119.7285 56.8891 41.1913 173.8042 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 C 8.45 4.81 0.00 3.12 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 2 K 8.58 4.45 0.00 2.09 1.70 0.00 1.57 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.50 7.81 3 G 8.70 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 4 K 8.30 4.25 0.00 1.73 1.74 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.38 7.81 5 G 8.97 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.87 4.58 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 7 K 8.41 4.23 0.00 1.77 1.86 0.00 1.54 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.44 7.81 8 C 8.61 5.15 0.00 2.99 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 9 S 8.31 4.56 0.00 3.77 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 10 K 8.86 3.52 0.00 1.70 1.90 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.43 7.81 11 L 6.97 4.44 0.00 1.61 1.61 0.86 0.46 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 12 M 7.02 4.07 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 13 Y 8.02 3.69 0.00 3.20 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 14 D 7.69 4.73 0.00 2.68 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 15 C 7.72 5.18 0.00 3.07 3.06 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 0.00 0.00 0.00 0.00 16 C 9.01 3.96 0.00 2.83 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.50 4.49 4.24 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 1.23 0.00 0.00 18 G 6.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.01 4.80 0.00 3.81 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.82 4.50 0.00 3.01 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 21 R 8.51 4.38 0.00 1.86 1.92 0.00 3.27 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 22 S 9.25 4.01 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.61 4.08 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 0.00 0.00 0.00 24 K 7.56 4.77 0.00 1.85 1.70 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.58 7.81 25 C 9.66 4.82 0.00 3.14 3.03 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 0.00 0.00 0.00