NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9573 8.3393 109.7358 45.5453 0.0000 172.9683 2 S 4.4426 8.3175 117.6750 55.7540 66.1967 171.8640 3 S 3.9338 8.6472 115.8727 59.1858 63.4749 176.6044 4 G 3.9908 8.4368 114.0292 43.4134 0.0000 171.1550 5 S 4.7507 8.1415 119.5351 56.8886 65.3565 175.2309 6 S 4.1186 8.7912 118.7168 60.3015 63.2170 172.6815 7 G 3.7759 8.1166 115.3594 45.3916 0.0000 172.7369 8 V 4.5939 7.8541 117.1253 59.1770 35.9063 175.4587 9 K 4.6642 7.9685 119.0211 54.3391 35.8861 175.7334 10 P 4.1563 0.0000 0.0000 64.4138 31.4442 175.7961 11 Y 4.8623 7.4952 117.1648 56.5233 41.7902 175.3183 12 G 4.8482 9.0628 110.7942 44.6776 0.0000 171.3242 13 C 4.0400 8.9996 126.8410 60.3261 32.3818 173.9988 14 S 4.3629 8.7940 118.5221 60.3251 63.0184 174.9915 15 E 3.9726 8.0769 118.4230 59.4630 29.4013 177.8360 16 C 4.3774 8.0771 111.2943 59.9725 31.0141 174.9893 17 G 4.5063 8.2792 107.9211 45.6868 0.0000 172.2968 18 K 4.5795 8.0599 117.4438 54.1689 35.9766 175.5227 19 A 5.0194 7.4613 120.7323 49.4519 22.6025 176.1438 20 F 4.4718 8.7149 117.3816 56.3014 41.7841 174.4851 21 R 4.0244 8.9100 125.3696 59.0469 30.2050 176.6474 22 S 5.0251 7.9863 109.9126 56.0268 66.1787 174.5226 23 K 2.8058 8.1800 125.8700 59.2735 32.0885 178.7033 24 S 3.8854 7.8419 113.0059 61.8060 62.2249 175.4216 25 Y 4.0800 7.1118 116.5271 61.2986 37.6628 178.4906 26 L 2.0000 7.4484 120.5075 57.8730 42.0253 178.5324 27 I 3.4782 7.4942 118.5148 64.8678 36.8344 177.8646 28 I 3.5914 7.5575 119.8033 64.9911 37.2372 177.6918 29 H 4.3061 7.8957 118.0951 59.7149 29.7717 177.0269 30 M 3.8181 8.2418 120.8887 58.6061 31.6687 178.8551 31 R 4.0671 7.9422 119.3000 58.9353 30.4039 178.6866 32 T 3.8018 8.0519 109.4296 65.2488 68.3638 175.9225 33 H 4.2032 7.7863 117.6771 58.5077 29.0137 177.1383 34 T 4.1184 8.2837 111.9406 64.2125 68.3475 174.7155 35 G 3.8771 7.7100 110.6153 43.3900 0.0000 172.6864 36 E 3.8714 8.5388 118.1341 56.8187 30.1720 176.7121 37 K 3.8400 8.5062 115.6346 57.1937 29.2495 174.6601 38 P 4.6603 0.0000 0.0000 64.9380 32.0394 177.0069 39 S 4.6023 8.0315 115.0194 56.3364 63.3283 171.9651 40 G 3.7695 8.7514 117.3853 45.4826 0.0000 171.7725 41 P 4.2108 0.0000 0.0000 64.1372 32.4927 178.5306 42 S 4.4031 7.3518 114.3435 58.2813 60.9952 173.5025 43 S 4.4788 9.3835 122.6860 59.8415 64.3097 174.7860 44 G 3.5176 8.0055 112.4935 45.7188 0.0000 172.1666 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 G 8.34 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 2 S 8.32 4.44 0.00 4.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.65 3.93 0.00 3.87 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.44 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.14 4.75 0.00 3.97 3.85 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 0.00 0.00 0.00 0.00 6 S 8.79 4.12 0.00 3.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.85 4.59 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 0.85 0.00 0.00 0.91 0.00 0.00 9 K 7.97 4.66 0.00 1.76 1.68 0.00 1.63 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.42 7.81 10 P 0.00 4.16 0.00 1.13 1.83 0.00 3.66 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.76 0.00 11 Y 7.50 4.86 0.00 3.36 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 9.06 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 9.00 4.04 0.00 3.41 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 14 S 8.79 4.36 0.00 3.89 3.87 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 0.00 0.00 0.00 0.00 15 E 8.08 3.97 0.00 1.67 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.26 0.00 16 C 8.08 4.38 0.00 3.16 3.22 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 17 G 8.28 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.06 4.58 0.00 1.54 1.17 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.29 1.35 7.81 19 A 7.46 5.02 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.71 4.47 0.00 3.04 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 21 R 8.91 4.02 0.00 1.77 2.04 0.00 3.23 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 22 S 7.99 5.03 0.00 4.18 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 K 8.18 2.81 0.00 1.21 1.53 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.06 7.81 24 S 7.84 3.89 0.00 3.77 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 25 Y 7.11 4.08 0.00 3.38 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.45 2.00 0.00 1.23 1.49 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.49 3.48 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.79 0.83 0.00 0.00 28 I 7.56 3.59 1.96 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.46 0.89 0.00 0.00 29 H 7.90 4.31 0.00 3.36 3.33 0.00 5.82 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 30 M 8.24 3.82 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.87 0.00 31 R 7.94 4.07 0.00 1.85 1.98 0.00 3.10 0.00 0.00 3.39 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 32 T 8.05 3.80 4.15 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 1.17 0.00 0.00 33 H 7.79 4.20 0.00 3.29 3.37 0.00 5.72 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 34 T 8.28 4.12 4.23 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 1.24 0.00 0.00 35 G 7.71 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.54 3.87 0.00 2.06 2.02 0.00 0.00 0.00 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 2.43 0.00 37 K 8.51 3.84 0.00 1.92 1.90 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.41 7.81 38 P 0.00 4.66 0.00 2.25 2.43 0.00 3.37 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 39 S 8.03 4.60 0.00 3.88 3.85 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 0.00 0.00 0.00 0.00 40 G 8.75 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.21 0.00 2.20 2.20 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 42 S 7.35 4.40 0.00 4.11 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 43 S 9.38 4.48 0.00 3.88 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 44 G 8.01 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00