NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9265 8.2133 109.7289 45.5526 0.0000 176.6952 2 T 3.7427 8.9481 125.6049 65.6595 68.6824 173.7108 3 K 3.9743 8.7073 121.5252 59.0946 32.5492 178.9490 4 Q 3.9612 7.7157 118.1417 58.9451 28.9714 178.1756 5 E 3.5418 8.0856 119.5748 58.6515 29.1909 179.3828 6 K 3.9148 8.0673 120.1755 59.7686 32.2568 179.0781 7 T 3.8662 7.8596 116.0788 66.7044 67.8270 176.7696 8 I 3.7943 7.8000 121.7894 64.0606 36.9508 178.3338 9 L 4.2042 7.8763 120.9595 58.3356 42.2045 178.6945 10 N 4.4142 8.8607 116.8206 56.5031 38.4199 177.4948 11 M 4.1548 8.3875 119.9653 58.4219 31.9225 178.5601 12 A 4.0872 7.7531 120.1688 55.3166 18.6781 179.6580 13 R 3.3934 7.8269 116.9999 59.0369 30.0737 178.4656 14 F 4.4211 8.0515 120.2591 61.0817 39.3719 177.3727 15 I 3.7501 8.2019 121.4288 63.6730 36.6756 178.1446 16 R 3.8122 7.5677 119.4290 59.5320 29.6212 178.5793 17 S 4.0925 7.4049 111.5788 61.4221 61.9157 176.1238 18 Q 3.7467 7.6445 120.5318 58.7416 28.2978 178.5117 19 A 3.9649 8.4647 122.1164 55.2436 18.4113 179.5516 20 L 3.9944 7.5932 115.4448 57.5374 41.7249 179.6877 21 T 3.9254 7.4645 116.3011 66.2507 68.2199 176.9462 22 I 3.6115 7.6550 121.7274 64.2193 37.2542 177.7493 23 L 3.9229 7.9284 121.3394 58.6219 41.9210 179.0468 24 E 3.9527 8.2431 117.9924 59.4605 28.9840 179.6118 25 K 4.2171 8.0511 118.1211 59.0926 32.0495 179.2811 26 A 4.1058 8.7106 121.9709 54.7389 18.3328 179.1917 27 N 4.3201 8.0366 115.9487 56.8423 38.8353 177.0734 28 E 4.0306 7.9746 118.5927 58.6156 29.6106 178.2872 29 L 4.3816 7.4247 115.3226 53.4302 42.4375 175.7557 30 D 4.2725 7.6803 116.9995 55.2800 40.3879 174.8131 31 A 4.4504 8.0702 121.4355 50.4959 17.8568 177.2603 32 D 4.3461 8.2206 123.5852 57.4474 41.2618 178.0909 33 E 3.9888 8.0900 118.7801 59.4854 29.5201 179.2632 34 I 3.7315 7.7348 119.1895 64.0806 37.1603 178.1646 35 A 3.9745 7.7874 121.3148 55.3388 18.2259 179.4542 36 D 4.2933 8.1553 117.3704 57.5790 40.8547 179.1602 37 I 3.7237 7.8100 120.1016 64.0805 37.0172 178.2698 38 A 3.9670 8.3763 122.1950 55.1952 18.2092 179.3000 39 E 3.8362 8.3330 117.8687 59.3918 29.6153 179.0372 40 S 4.0289 7.9738 113.2957 61.4205 62.4812 176.2349 41 I 3.6926 8.1829 123.0059 64.3744 36.7614 177.9314 42 H 4.1080 8.3294 119.3770 59.4229 29.6408 177.1662 43 D 4.4048 8.3181 120.7482 57.6730 40.6815 178.5351 44 H 4.3018 8.7284 117.0736 58.7694 28.6354 177.7569 45 A 4.0609 8.1639 122.7247 55.0800 18.1075 179.1694 46 D 4.3527 8.1705 116.7082 57.5296 41.2532 178.3451 47 E 4.0322 8.0464 118.9645 59.0844 29.3799 179.2802 48 I 3.7564 7.7259 120.0609 64.3192 37.1640 177.7095 49 Y 4.2962 8.4193 120.7051 60.9595 38.6513 178.1787 50 R 3.6350 8.2100 118.9062 59.3774 30.0076 178.9200 51 S 4.0126 8.1472 114.4036 61.9983 63.0793 177.0626 52 A 3.3252 8.3289 123.0411 54.6377 17.8444 179.7230 53 L 3.9362 7.5335 117.1737 57.5717 41.9299 178.9833 54 A 4.1574 7.9460 120.6543 54.8656 18.5917 179.6557 55 R 3.7883 8.6783 116.9420 58.3931 29.9796 177.1933 56 F 5.1076 7.3994 115.3547 56.9194 39.4916 175.7444 57 G 4.0037 7.8315 116.1392 46.2652 0.0000 173.8502 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 8.21 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 0.00 0.00 0.00 2 T 8.95 3.74 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 3 K 8.71 3.97 0.00 1.76 1.82 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.49 7.81 4 Q 7.72 3.96 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 5 E 8.09 3.54 0.00 1.45 1.12 0.00 0.00 0.00 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 2.20 0.00 6 K 8.07 3.91 0.00 2.05 1.87 0.00 1.52 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.41 1.50 7.81 7 T 7.86 3.87 4.37 0.00 0.00 0.00 0.00 0.00 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 8 I 7.80 3.79 2.21 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.37 1.11 0.00 0.00 9 L 7.88 4.20 0.00 2.13 1.85 1.09 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.86 4.41 0.00 2.97 2.85 0.00 0.00 7.11 8.24 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 11 M 8.39 4.15 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.80 0.00 12 A 7.75 4.09 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.83 3.39 0.00 1.25 1.77 0.00 3.04 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.73 0.00 14 F 8.05 4.42 0.00 3.21 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 15 I 8.20 3.75 1.84 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.33 0.86 0.00 0.00 16 R 7.57 3.81 0.00 1.90 1.94 0.00 3.01 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 17 S 7.40 4.09 0.00 3.94 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 18 Q 7.64 3.75 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 1.82 1.33 0.00 19 A 8.46 3.96 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.59 3.99 0.00 1.83 1.68 0.87 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.46 3.93 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 22 I 7.65 3.61 2.01 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.00 0.89 0.00 0.00 23 L 7.93 3.92 0.00 1.83 1.85 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.24 3.95 0.00 2.00 1.96 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 2.54 2.48 0.00 25 K 8.05 4.22 0.00 1.99 1.84 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.51 7.81 26 A 8.71 4.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.04 4.32 0.00 3.02 2.80 0.00 0.00 7.10 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.97 4.03 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.61 0.00 29 L 7.42 4.38 0.00 1.64 1.69 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.68 4.27 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 4.45 1.27 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 0.00 0.00 0.00 32 D 8.22 4.35 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.09 3.99 0.00 2.00 1.99 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 2.39 2.39 0.00 34 I 7.73 3.73 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.64 0.89 0.00 0.00 35 A 7.79 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.16 4.29 0.00 2.85 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 3.72 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.78 0.89 0.00 0.00 38 A 8.38 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.33 3.84 0.00 2.07 2.11 0.00 0.00 0.00 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 2.36 0.00 40 S 7.97 4.03 0.00 3.89 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 41 I 8.18 3.69 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.87 0.88 0.00 0.00 42 H 8.33 4.11 0.00 3.15 3.46 0.00 5.59 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 43 D 8.32 4.40 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.73 4.30 0.00 3.14 3.33 0.00 5.64 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 45 A 8.16 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.17 4.35 0.00 2.91 2.83 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 47 E 8.05 4.03 0.00 2.16 1.97 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 2.57 2.49 0.00 48 I 7.73 3.76 2.12 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.96 0.99 0.00 0.00 49 Y 8.42 4.30 0.00 3.07 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.21 3.63 0.00 1.86 1.90 0.00 3.32 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 51 S 8.15 4.01 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.33 3.33 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.53 3.94 0.00 1.66 1.59 0.49 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.95 4.16 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 55 R 8.68 3.79 0.00 1.36 1.59 0.00 3.08 0.00 0.00 3.04 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.61 0.00 56 F 7.40 5.11 0.00 3.29 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 57 G 7.83 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 0.00 0.00 0.00