NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3445 8.3344 115.2916 58.1919 64.0039 173.9040 2 L 4.0078 8.3058 129.1439 54.0210 40.5163 174.5049 3 K 3.6703 8.5829 121.4817 56.2131 33.1410 173.8165 4 G 3.0023 9.9555 104.5540 46.4543 0.0000 173.6065 5 F 3.4068 7.8101 122.2499 58.0646 38.8619 175.7088 6 R 4.4248 7.9853 117.2883 57.6395 30.4695 177.8111 7 L 4.0677 8.1764 118.8097 58.0437 41.4148 179.3141 8 V 3.7867 8.0172 116.8824 65.2134 31.0972 177.2099 9 L 4.0999 8.2767 118.5203 56.6529 41.5665 178.2682 10 F 4.0838 8.4682 120.7566 60.2943 39.1653 177.7847 11 V 4.0810 7.8668 118.8775 64.6254 31.4882 177.4931 12 K 4.0964 7.6198 117.9744 57.0767 31.9539 178.5088 13 R 4.0027 7.3505 118.2545 59.7457 30.4815 177.9785 14 Y 4.2159 7.5802 115.7592 59.2342 38.3750 177.5098 15 V 3.3189 6.6974 119.6128 64.4258 30.2646 177.3972 16 R 4.0737 7.3337 117.8386 57.9933 29.8101 177.6730 17 K 4.1851 7.7314 118.7980 58.4047 32.0110 178.4586 18 M 4.0349 7.3499 117.3914 58.7045 32.3262 177.6141 19 R 4.3440 7.0573 115.9022 57.7616 30.5009 177.0935 20 K 4.2317 7.1895 119.1719 54.2219 33.6486 175.2957 21 L 4.3919 8.3317 128.5592 54.0326 43.7424 176.7153 22 K 4.1934 9.0212 126.0720 57.2510 31.0078 177.0732 23 L 4.0761 8.9204 127.2550 56.0767 42.5133 174.7818 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 S 8.33 4.34 0.00 3.86 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 2 L 8.31 4.01 0.00 1.71 1.60 0.93 0.35 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 3 K 8.58 3.67 0.00 1.94 1.84 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.43 7.81 4 G 9.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.81 3.41 0.00 3.05 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 6 R 7.99 4.42 0.00 1.73 1.83 0.00 3.11 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 7 L 8.18 4.07 0.00 1.98 1.82 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.02 3.79 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.01 0.00 0.00 9 L 8.28 4.10 0.00 1.95 1.79 0.96 0.91 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 10 F 8.47 4.08 0.00 3.33 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 11 V 7.87 4.08 2.24 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 0.99 0.00 0.00 1.18 0.00 0.00 12 K 7.62 4.10 0.00 1.99 1.79 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.59 7.81 13 R 7.35 4.00 0.00 1.95 1.75 0.00 3.20 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 14 Y 7.58 4.22 0.00 3.16 3.13 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 0.00 15 V 6.70 3.32 1.62 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 0.85 0.00 0.00 -0.83 0.00 0.00 16 R 7.33 4.07 0.00 1.92 1.86 0.00 3.11 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 17 K 7.73 4.19 0.00 2.10 1.78 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.46 7.81 18 M 7.35 4.03 0.00 2.28 2.25 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 2.63 2.64 0.00 19 R 7.06 4.34 0.00 1.89 1.99 0.00 3.31 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.77 0.00 20 K 7.19 4.23 0.00 1.58 1.65 0.00 1.68 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.40 7.81 21 L 8.33 4.39 0.00 1.64 1.58 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 22 K 9.02 4.19 0.00 1.77 1.37 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.46 7.81 23 L 8.92 4.08 0.00 1.59 1.50 0.92 0.77 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