NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9717 8.3549 109.7331 45.1013 0.0000 174.0862 2 L 3.8418 8.5079 122.4828 56.3122 41.8899 176.4157 3 L 4.0918 8.6017 121.8226 55.0529 43.3530 176.4102 4 C 4.5304 8.5567 123.6038 55.8245 43.0023 171.9509 5 Y 5.2343 7.9709 119.5116 55.4823 41.6607 173.1945 6 C 5.4220 9.1555 119.9045 56.2183 40.3470 172.6954 7 R 4.9582 9.2082 125.2929 54.7056 33.5084 174.3237 8 K 3.3268 8.2010 125.6914 57.9392 33.0122 176.0111 9 G 3.9806 9.8159 117.2639 43.6690 0.0000 173.9044 10 H 4.3671 7.0731 112.9836 54.4749 30.3862 174.1579 11 C 4.5281 8.6047 117.3994 56.3987 41.9478 173.7221 12 K 4.2601 8.4047 121.6306 56.2569 32.5402 176.7304 13 R 4.5925 8.1517 124.2829 53.6478 27.3799 175.4354 14 G 3.9684 7.8174 117.8248 45.4964 0.0000 170.6868 15 D 4.5846 7.6819 121.5586 53.8296 42.3011 174.3282 16 R 4.5989 8.3724 118.5850 54.5826 32.9676 176.0391 17 V 3.9406 8.4687 124.1904 61.9851 31.9647 175.7522 18 R 4.3164 9.2584 122.5744 56.3389 31.9614 176.8361 19 G 4.0827 7.3873 106.3881 46.6785 0.0000 171.3994 20 T 4.7387 8.4503 112.4236 60.8119 70.7500 174.6434 21 C 4.7440 9.0230 122.8221 57.6559 46.9282 173.6167 22 G 3.7297 7.3595 106.4280 45.5451 0.0000 172.0732 23 I 4.0056 8.4616 123.5467 62.6648 36.6127 175.3850 24 R 4.0449 8.8831 124.5585 57.0383 27.5457 175.7225 25 F 5.2764 8.4686 115.6871 55.7244 42.6897 174.2794 26 L 5.2760 9.4249 122.2751 53.1657 45.5844 174.7275 27 Y 5.2156 9.1310 123.6162 56.8015 40.3219 173.9116 28 C 5.1200 8.8708 123.0415 55.5879 46.6538 172.0486 29 C 4.9683 8.7982 117.6660 53.9449 42.7192 172.5269 30 P 4.9833 0.0000 0.0000 62.2001 31.4387 176.0443 31 R 3.8957 8.9403 123.4055 59.5919 30.2566 176.3632 32 R 4.0916 7.8115 120.5972 56.4953 30.1192 175.8382 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 8.35 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 0.00 0.00 0.00 2 L 8.51 3.84 0.00 1.73 1.74 0.91 0.66 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 3 L 8.60 4.09 0.00 1.61 1.62 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 4 C 8.56 4.53 0.00 2.49 2.23 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 5 Y 7.97 5.23 0.00 2.97 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 6 C 9.16 5.42 0.00 3.24 3.24 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 0.00 7 R 9.21 4.96 0.00 2.18 1.84 0.00 3.35 0.00 0.00 3.53 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 8 K 8.20 3.33 0.00 0.99 0.74 0.00 1.48 0.00 0.00 1.59 0.00 0.00 2.58 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.08 1.18 7.81 9 G 9.82 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 10 H 7.07 4.37 0.00 3.20 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 C 8.60 4.53 0.00 2.92 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.40 4.26 0.00 1.98 1.93 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.37 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.47 7.81 13 R 8.15 4.59 0.00 1.79 1.84 0.00 3.33 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 14 G 7.82 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 0.00 0.00 0.00 15 D 7.68 4.58 0.00 2.83 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.37 4.60 0.00 1.59 1.72 0.00 3.04 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.45 0.00 17 V 8.47 3.94 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 0.63 0.00 0.00 1.01 0.00 0.00 18 R 9.26 4.32 0.00 1.77 2.11 0.00 3.43 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.31 0.00 19 G 7.39 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 20 T 8.45 4.74 4.30 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 0.00 0.00 1.26 0.00 0.00 21 C 9.02 4.74 0.00 3.07 3.36 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 0.00 0.00 0.00 0.00 22 G 7.36 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 23 I 8.46 4.01 1.92 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 1.43 0.56 0.96 0.00 0.00 24 R 8.88 4.04 0.00 2.16 2.05 0.00 3.27 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 25 F 8.47 5.28 0.00 3.03 2.98 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 0.00 0.00 0.00 26 L 9.42 5.28 0.00 1.63 1.67 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 9.13 5.22 0.00 2.98 2.87 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 28 C 8.87 5.12 0.00 2.56 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.80 4.97 0.00 2.58 2.73 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 30 P 0.00 4.98 0.00 2.40 2.25 0.00 3.22 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 31 R 8.94 3.90 0.00 1.84 2.00 0.00 3.29 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 32 R 7.81 4.09 0.00 1.80 1.80 0.00 3.37 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00