NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1705 8.2649 123.5753 52.2308 19.9952 176.1644 2 T 4.1864 8.1192 117.4693 61.8125 69.9187 172.8265 3 C 5.3661 9.0161 124.1285 55.1805 42.9278 173.0036 4 Y 4.8522 8.8446 117.7101 56.4995 41.9383 174.2514 5 C 5.1917 8.9541 121.0213 56.4504 36.1503 173.0766 6 R 4.8901 9.2714 124.2756 54.5036 31.8648 178.2125 7 T 4.1052 8.9686 112.9719 63.9091 69.3864 174.3834 8 G 4.1807 7.6209 109.8535 43.4586 0.0000 172.9111 9 R 4.2121 8.2032 117.5548 55.6584 30.7486 177.4515 10 C 4.4933 8.4823 117.0950 56.8129 41.7015 174.0342 11 A 4.2842 8.9355 126.2713 52.0618 18.7306 178.7531 12 T 3.8401 8.6089 116.7478 67.0205 68.4484 175.3028 13 H 4.5861 8.0045 113.0568 56.0728 29.2988 174.7168 14 E 4.6777 7.7073 120.2282 55.6918 31.3619 175.6208 15 S 4.7427 8.7880 117.5378 56.3881 65.8210 173.5765 16 L 4.4897 8.6923 127.6001 55.5436 42.0334 176.4389 17 S 4.6345 10.3726 121.1860 57.4631 64.8968 175.1895 18 G 3.9205 6.8648 106.0284 45.9067 0.0000 170.6448 19 V 4.8891 7.9473 119.2078 61.4391 34.6489 176.8052 20 C 4.9599 9.2961 125.0450 55.4268 42.6596 172.1327 21 E 5.2187 8.8025 123.7056 54.6066 31.2524 175.1815 22 I 4.5114 8.9010 127.5501 60.9586 40.9901 175.7870 23 S 3.4954 9.9682 123.0471 59.7169 60.1406 173.0596 24 G 3.9781 8.2192 103.9659 45.7319 0.0000 172.8941 25 R 4.5891 7.9157 118.1352 54.0093 33.4413 174.3337 26 L 5.1064 7.9313 120.1509 53.7701 43.6237 175.5220 27 Y 4.8600 8.8802 118.8885 56.1179 42.8817 174.9243 28 R 4.3498 8.7051 121.3281 56.1709 31.8686 175.5593 29 L 4.8667 8.8621 126.1985 54.3873 43.4166 174.4339 30 C 5.4742 9.4396 125.1364 55.4164 41.5545 172.5465 31 C 5.5414 8.9518 121.2407 54.7558 43.4011 174.5096 32 R 4.2655 8.8150 120.7833 56.6225 29.2729 176.6033 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 A 8.26 4.17 1.23 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 0.00 0.00 2 T 8.12 4.19 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 3 C 9.02 5.37 0.00 2.65 2.93 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 4 Y 8.84 4.85 0.00 2.91 2.78 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 5 C 8.95 5.19 0.00 2.70 2.92 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 6 R 9.27 4.89 0.00 1.86 1.91 0.00 3.15 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 7 T 8.97 4.11 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 8 G 7.62 4.18 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 0.00 0.00 0.00 9 R 8.20 4.21 0.00 1.82 1.88 0.00 3.22 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 10 C 8.48 4.49 0.00 2.96 3.02 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 0.00 0.00 0.00 11 A 8.94 4.28 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.61 3.84 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 13 H 8.00 4.59 0.00 3.29 3.43 0.00 5.51 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.71 4.68 0.00 1.95 1.92 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 2.32 1.95 0.00 15 S 8.79 4.74 0.00 3.72 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.69 4.49 0.00 1.65 1.60 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 17 S 10.37 4.63 0.00 3.70 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.86 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 19 V 7.95 4.89 2.10 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 0.92 0.00 0.00 0.94 0.00 0.00 20 C 9.30 4.96 0.00 3.06 3.02 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 0.00 0.00 0.00 21 E 8.80 5.22 0.00 1.98 1.86 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 2.23 2.34 0.00 22 I 8.90 4.51 2.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 0.91 0.00 0.00 23 S 9.97 3.50 0.00 4.01 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.22 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 25 R 7.92 4.59 0.00 2.02 1.33 0.00 3.12 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 26 L 7.93 5.11 0.00 1.40 1.53 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.88 4.86 0.00 2.93 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 8.71 4.35 0.00 1.88 1.89 0.00 3.38 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 29 L 8.86 4.87 0.00 1.80 1.70 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 30 C 9.44 5.47 0.00 2.97 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.95 5.54 0.00 2.84 2.93 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 32 R 8.81 4.27 0.00 1.72 1.92 0.00 3.36 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.91 0.00