NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4725 8.3049 118.1949 55.1692 32.9725 176.4389 2 K 3.7940 8.0659 117.7504 56.2957 32.0593 171.0713 3 V 3.3670 7.9213 112.1754 63.7388 29.7259 173.0671 4 R 3.9349 8.1148 124.1905 58.0696 30.9631 176.8866 5 A 4.3984 7.7844 121.6603 52.7217 16.1331 177.5505 6 S 4.2501 7.7615 116.1385 59.7068 64.0620 176.1895 7 V 3.8821 7.5393 120.0783 61.2177 32.3488 173.1789 8 K 3.7732 8.4822 125.0616 55.4337 31.7749 176.0004 9 K 3.9448 8.4300 121.6624 57.4803 32.3895 179.4439 10 L 3.6352 8.0673 116.8808 55.5381 42.0579 173.1536 11 C 4.9404 7.7815 116.7644 57.2608 34.1298 173.8977 12 R 4.1073 8.6085 123.3296 58.7421 29.7771 177.3419 13 N 4.8075 7.6658 110.3166 53.2383 38.6127 175.8154 14 C 3.6762 7.0556 117.7515 59.9673 29.0130 171.7123 15 K 4.1594 8.5389 125.2909 55.2401 31.2501 177.4521 16 I 3.7941 8.3849 127.5500 61.8480 39.2009 175.4523 17 V 3.2379 7.8329 119.6895 63.9403 29.3918 173.9798 18 K 4.1106 7.7560 120.3772 58.5034 32.9912 177.5732 19 R 4.0119 7.5195 114.3910 59.5240 29.1832 177.5553 20 D 4.5339 7.8304 121.7043 52.2868 39.7842 175.6298 21 G 4.2778 8.6107 115.5909 45.6752 0.0000 170.9808 22 V 4.4566 7.1397 109.7691 59.7335 35.6526 174.1060 23 I 4.5172 8.0740 113.5896 60.6869 39.1932 175.5973 24 R 4.9360 8.6870 119.8559 55.0298 32.2157 174.9531 25 V 4.3256 9.0964 117.3549 60.9951 33.2908 175.2762 26 I 4.8109 8.5505 117.0864 59.6520 41.3993 174.0339 27 C 5.4782 8.4469 118.5217 57.0727 32.1807 173.3760 28 S 4.2560 8.2368 113.6914 61.8927 62.6206 176.1765 29 A 4.1494 7.9157 120.9802 54.9517 18.5182 177.7235 30 E 4.8404 7.5932 114.1302 55.4009 30.8872 173.6661 31 P 4.2743 0.0000 0.0000 62.8382 31.9923 178.2746 32 K 3.7415 7.5315 120.4560 59.7881 32.1414 176.6905 33 H 4.6492 8.0178 112.1693 55.4919 28.6307 176.5079 34 K 3.9546 7.4418 117.3734 56.7547 32.4343 176.4304 35 Q 3.6772 8.4903 116.3970 56.1844 26.6973 175.2520 36 R 4.1109 7.4755 114.4985 57.3846 30.0477 176.6368 37 Q 3.8846 7.8188 117.8966 59.4975 29.1912 177.0079 38 G 4.3815 8.0629 109.6616 46.0208 0.0000 172.5724 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 M 8.30 4.47 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 2 K 8.07 3.79 0.00 1.92 1.89 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.49 7.81 3 V 7.92 3.37 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 0.95 0.00 0.00 1.01 0.00 0.00 4 R 8.11 3.93 0.00 1.81 1.95 0.00 3.30 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 5 A 7.78 4.40 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 6 S 7.76 4.25 0.00 3.99 4.02 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 7 V 7.54 3.88 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 0.75 0.00 0.00 0.93 0.00 0.00 8 K 8.48 3.77 0.00 1.92 1.91 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.40 7.81 9 K 8.43 3.94 0.00 1.79 1.80 0.00 1.86 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.43 7.81 10 L 8.07 3.64 0.00 1.78 1.75 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 11 C 7.78 4.94 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.61 4.11 0.00 1.84 1.98 0.00 3.36 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 13 N 7.67 4.81 0.00 2.75 2.84 0.00 0.00 6.03 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.06 3.68 0.00 3.00 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 15 K 8.54 4.16 0.00 1.88 1.84 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.37 7.81 16 I 8.38 3.79 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.32 0.91 0.00 0.00 17 V 7.83 3.24 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 0.87 0.00 0.00 0.99 0.00 0.00 18 K 7.76 4.11 0.00 1.73 1.82 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.49 7.81 19 R 7.52 4.01 0.00 2.08 2.06 0.00 3.10 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 20 D 7.83 4.53 0.00 2.63 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.61 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.14 4.46 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 0.80 0.00 0.00 0.93 0.00 0.00 23 I 8.07 4.52 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 1.40 0.84 0.91 0.00 0.00 24 R 8.69 4.94 0.00 1.76 1.89 0.00 3.05 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 25 V 9.10 4.33 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 0.89 0.00 0.00 0.97 0.00 0.00 26 I 8.55 4.81 1.84 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 1.30 0.79 0.83 0.00 0.00 27 C 8.45 5.48 0.00 2.99 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 S 8.24 4.26 0.00 3.71 3.96 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 0.00 0.00 0.00 29 A 7.92 4.15 1.29 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 0.00 0.00 0.00 30 E 7.59 4.84 0.00 1.99 1.84 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 2.31 2.32 0.00 31 P 0.00 4.27 0.00 2.17 2.00 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.24 0.00 32 K 7.53 3.74 0.00 1.72 1.90 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.57 7.81 33 H 8.02 4.65 0.00 3.33 3.51 0.00 5.54 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.44 3.95 0.00 1.80 2.01 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.38 7.81 35 Q 8.49 3.68 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 36 R 7.48 4.11 0.00 1.58 1.94 0.00 3.34 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 37 Q 7.82 3.88 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 38 G 8.06 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00