NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.6983 8.4549 115.5913 55.5671 44.6704 171.8472 2 K 4.2719 8.1594 118.0654 54.3718 34.9717 173.7896 3 L 5.2031 8.2670 121.4140 52.9194 46.7928 175.7199 4 K 4.0843 8.5390 122.5780 57.9916 32.2761 176.6411 5 G 3.9324 8.7754 114.0485 45.3960 0.0000 172.6215 6 Q 4.5081 7.7827 119.1774 54.1750 30.4261 175.2839 7 S 5.0528 8.9124 118.4707 58.8871 63.1581 172.4863 8 C 4.8534 8.2872 117.3744 53.9864 44.9277 173.2077 9 R 4.0775 8.4138 120.9512 55.6641 30.3275 177.3310 10 K 3.8826 8.5850 123.9715 58.8116 32.3186 176.9848 11 T 4.5324 7.4322 112.8562 61.8642 67.8730 174.5015 12 S 4.4267 7.3810 114.3803 58.7052 64.2883 173.8163 13 Y 3.6789 7.2998 115.5779 58.6387 35.6213 171.8367 14 D 4.4664 8.0859 119.0035 56.5457 42.0456 176.7254 15 C 4.8373 7.7897 116.3092 57.1410 40.8762 173.5558 16 C 4.1632 8.6723 121.4506 60.5570 39.8713 176.2539 17 S 3.8362 7.9970 111.8817 58.8964 63.1166 170.5968 18 G 4.0638 9.2234 117.6312 45.4761 0.0000 171.8371 19 S 4.8339 9.2591 118.2471 60.3235 69.8730 175.7649 20 C 3.9725 6.9794 117.4569 54.4406 39.0079 172.9902 21 G 3.5908 8.1873 120.1320 45.6601 0.0000 172.5132 22 R 4.4335 7.6109 120.1095 56.1743 30.3450 175.9443 23 S 3.8504 8.2171 106.6828 59.2004 60.5399 169.7071 24 G 4.0261 9.4648 105.2963 46.3188 0.0000 173.4041 25 K 4.9111 7.6462 117.9462 54.2110 35.8873 176.5536 26 C 4.8395 8.8311 118.9480 56.8902 41.0649 173.8851 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 C 8.45 4.70 0.00 3.20 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.16 4.27 0.00 1.70 1.93 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.59 7.81 3 L 8.27 5.20 0.00 1.64 1.48 0.93 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.54 4.08 0.00 1.76 1.72 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.40 7.81 5 G 8.78 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 6 Q 7.78 4.51 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 7 S 8.91 5.05 0.00 3.85 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 C 8.29 4.85 0.00 2.92 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 9 R 8.41 4.08 0.00 1.80 1.75 0.00 3.18 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 10 K 8.58 3.88 0.00 1.81 1.88 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.34 7.81 11 T 7.43 4.53 4.23 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 1.18 0.00 0.00 12 S 7.38 4.43 0.00 3.76 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.30 3.68 0.00 3.21 2.96 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 14 D 8.09 4.47 0.00 2.66 2.66 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 0.00 0.00 0.00 0.00 15 C 7.79 4.84 0.00 3.17 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 16 C 8.67 4.16 0.00 2.99 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 17 S 8.00 3.84 0.00 3.99 4.01 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 18 G 9.22 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.26 4.83 0.00 4.03 4.11 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 0.00 0.00 0.00 20 C 6.98 3.97 0.00 2.50 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.61 4.43 0.00 1.84 1.89 0.00 3.34 0.00 0.00 3.39 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 23 S 8.22 3.85 0.00 4.20 4.10 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 0.00 0.00 0.00 0.00 24 G 9.46 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.65 4.91 0.00 1.72 1.74 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.46 7.81 26 C 8.83 4.84 0.00 3.25 2.99 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