NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 G 3.9238 8.3501 109.7364 45.5348 0.0000 173.1999 -2 A 4.3518 8.1563 124.4314 51.0652 22.9430 175.3771 -1 A 3.8756 9.5131 124.3282 52.7300 16.6553 176.1985 0 S 4.8323 8.5352 112.0044 58.3448 65.4804 173.4828 1 M 4.4540 8.7490 123.3535 56.1903 33.8466 176.8017 2 D 4.8407 7.7879 114.6747 54.0354 42.6687 176.9740 3 A 4.2286 7.8828 119.9970 53.9556 18.0171 179.2471 4 I 3.7081 7.6530 118.8050 64.3630 37.0646 178.4131 5 K 4.0847 7.8859 118.6177 58.6910 30.3513 179.3901 6 K 4.0358 7.9714 120.2334 58.4029 32.0365 177.8169 7 K 4.8181 7.5064 115.9941 56.8206 33.5861 177.3779 8 M 4.5459 7.3938 120.6758 56.4926 34.0979 176.2869 9 Q 4.2106 7.8231 116.9223 58.6030 28.8787 177.1277 10 M 4.4165 7.3541 118.3235 55.6877 32.1951 176.1397 11 L 4.5560 7.6108 119.7938 54.9501 43.9088 176.6546 12 K 4.3851 7.5897 115.9697 56.8443 32.1999 176.9751 13 L 4.5072 7.7439 119.2592 55.2891 42.9222 177.1133 14 D 5.6499 7.8855 117.6371 53.2044 41.7434 176.5361 15 K 4.7047 7.7785 117.2346 57.2365 38.0385 177.8108 16 E 4.0439 8.2539 119.0965 58.9790 29.0768 177.9490 17 N 4.7265 7.6957 113.4878 53.9130 38.4406 176.7264 18 A 4.2829 8.1518 125.0040 54.2886 18.7094 179.2834 19 L 4.4354 7.6475 114.1032 55.4444 42.8844 177.8127 20 D 5.3681 7.7265 119.2502 56.4559 40.2213 177.6260 21 R 4.3198 7.6319 117.7735 56.9498 30.5607 176.3979 22 A 4.6009 7.6789 121.2095 51.6661 19.8062 177.3935 23 E 4.6257 7.7723 118.4865 57.7835 34.5040 177.1690 24 Q 4.0229 7.8606 118.6662 58.3110 28.8031 177.6929 25 L 4.1148 7.2311 115.8614 56.9605 41.8944 178.1751 26 E 4.2760 8.1913 117.9667 57.8040 29.4515 178.1881 27 N 4.3991 7.6283 115.9078 55.5337 38.3539 175.4097 28 E 4.5323 7.9102 117.8899 55.9973 30.0619 177.2939 29 V 4.3248 7.3750 118.9524 63.7457 33.8928 177.4808 30 A 4.0661 8.4821 122.5936 54.2049 18.6103 178.2068 31 R 4.4313 7.8090 111.1638 57.2513 30.8819 178.5916 32 L 3.9941 7.4681 119.4559 57.4331 41.7016 178.4919 33 K 4.2881 7.8204 116.5031 57.4133 32.0105 177.0109 34 K 4.3502 7.8407 117.1868 57.6374 33.4377 176.3676 35 L 4.2470 7.4375 121.7797 55.7189 40.5906 176.2030 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 -3 G 8.35 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 0.00 0.00 0.00 -2 A 8.16 4.35 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 -1 A 9.51 3.88 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 0 S 8.54 4.83 0.00 3.83 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.75 4.45 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 2 D 7.79 4.84 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.88 4.23 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 4 I 7.65 3.71 2.07 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.08 0.91 0.00 0.00 5 K 7.89 4.08 0.00 2.09 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.52 7.81 6 K 7.97 4.04 0.00 1.86 1.79 0.00 1.57 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.65 7.81 7 K 7.51 4.82 0.00 1.79 1.78 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.55 7.81 8 M 7.39 4.55 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 9 Q 7.82 4.21 0.00 2.33 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 10 M 7.35 4.42 0.00 2.13 2.30 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 11 L 7.61 4.56 0.00 1.57 1.64 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.59 4.39 0.00 1.89 1.82 0.00 2.01 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.54 7.81 13 L 7.74 4.51 0.00 1.69 1.69 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 14 D 7.89 5.65 0.00 2.63 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 K 7.78 4.70 0.00 1.88 1.97 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.70 1.46 7.81 16 E 8.25 4.04 0.00 2.00 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 2.37 2.47 0.00 17 N 7.70 4.73 0.00 3.03 2.83 0.00 0.00 6.86 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.15 4.28 1.39 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 0.00 0.00 19 L 7.65 4.44 0.00 1.62 1.72 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.73 5.37 0.00 2.83 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 4.32 0.00 2.02 1.95 0.00 3.33 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.97 0.00 22 A 7.68 4.60 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.77 4.63 0.00 2.10 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.21 0.00 24 Q 7.86 4.02 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 25 L 7.23 4.11 0.00 1.65 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.19 4.28 0.00 2.18 1.98 0.00 0.00 0.00 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 2.48 0.00 27 N 7.63 4.40 0.00 2.97 2.88 0.00 0.00 6.92 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.91 4.53 0.00 2.02 1.94 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 2.33 2.28 0.00 29 V 7.37 4.32 2.08 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 1.02 0.00 0.00 0.93 0.00 0.00 30 A 8.48 4.07 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.81 4.43 0.00 1.99 2.17 0.00 2.97 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 32 L 7.47 3.99 0.00 2.12 1.66 0.94 0.71 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 33 K 7.82 4.29 0.00 1.88 1.82 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.41 7.81 34 K 7.84 4.35 0.00 1.99 1.83 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.17 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.57 7.81 35 L 7.44 4.25 0.00 1.79 1.64 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00