NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 K 4.1954 8.3031 121.7884 55.9446 33.2944 175.3751 21 G 3.6863 8.3949 114.3956 44.7729 0.0000 171.5928 22 S 4.4540 8.3396 115.5378 57.4448 64.7540 172.9797 23 V 3.8200 8.1352 122.9013 62.5021 31.9769 175.5134 24 V 4.3396 8.0956 126.1838 60.8543 33.6516 174.8518 25 I 4.0194 8.3122 127.7231 61.3105 36.9216 176.0063 26 V 4.2048 8.0553 117.9345 60.2903 32.1735 175.5274 27 G 3.9897 7.3981 107.6673 46.1105 0.0000 172.4492 28 R 4.6551 8.2487 113.6638 54.8951 31.9402 174.2180 29 I 4.4121 8.1924 119.7103 59.4962 39.7051 175.1119 30 V 4.2761 8.3971 125.0579 61.2563 32.5722 175.0872 31 L 4.4317 8.4423 126.8606 55.6173 42.4311 177.4767 32 S 4.4122 8.0278 111.3946 58.5870 63.5905 174.6612 33 G 3.7917 7.7856 110.5095 45.4895 0.0000 173.0701 34 K 4.6836 8.1044 120.0955 53.0010 35.6221 174.4014 35 P 4.2076 0.0000 0.0000 63.4605 31.6596 175.9213 36 A 4.6927 8.1003 123.7026 50.3435 22.2658 175.3789 37 I 4.0156 8.1996 121.6108 60.2788 37.7538 176.2372 38 I 3.7636 8.3397 127.2250 60.5378 37.1795 174.3812 39 P 4.3852 0.0000 0.0000 62.5171 31.8965 175.7774 40 K 4.4747 8.2770 121.1549 55.2521 33.6326 176.5835 41 K 4.1848 8.2061 121.5681 57.1648 32.6614 176.0197 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 20 K 8.30 4.20 0.00 1.73 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.45 7.81 21 G 8.39 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.34 4.45 0.00 3.87 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 23 V 8.14 3.82 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 0.76 0.00 0.00 0.93 0.00 0.00 24 V 8.10 4.34 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 0.90 0.00 0.00 0.97 0.00 0.00 25 I 8.31 4.02 1.87 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 1.41 0.65 0.96 0.00 0.00 26 V 8.06 4.20 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 0.77 0.00 0.00 0.93 0.00 0.00 27 G 7.40 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 28 R 8.25 4.66 0.00 1.88 1.86 0.00 3.14 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 29 I 8.19 4.41 1.87 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 1.30 0.68 0.91 0.00 0.00 30 V 8.40 4.28 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 0.83 0.00 0.00 0.93 0.00 0.00 31 L 8.44 4.43 0.00 1.67 1.70 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.03 4.41 0.00 3.97 3.97 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 33 G 7.79 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 0.00 0.00 0.00 34 K 8.10 4.68 0.00 1.71 1.68 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.35 7.81 35 P 0.00 4.21 0.00 2.03 2.02 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 36 A 8.10 4.69 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 37 I 8.20 4.02 1.87 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 1.41 0.58 0.91 0.00 0.00 38 I 8.34 3.76 1.87 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 1.47 0.46 0.91 0.00 0.00 39 P 0.00 4.39 0.00 2.17 2.05 0.00 3.75 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 1.98 1.95 0.00 40 K 8.28 4.47 0.00 1.71 1.73 0.00 1.61 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.47 7.81 41 K 8.21 4.18 0.00 1.83 1.68 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.35 7.81