NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 39 E 4.3618 8.2876 118.7970 56.1158 30.8121 175.8023 40 Q 3.7859 8.4926 115.6269 57.8601 28.6502 176.3263 41 S 4.3704 8.1530 110.0819 58.9894 64.4555 176.0668 42 E 4.1803 8.0120 122.8268 59.1087 29.7087 177.9373 43 R 3.8739 7.8532 118.2057 59.3365 30.2156 178.0909 44 R 3.9206 7.6109 117.1525 59.8153 30.1491 179.2635 45 R 3.9681 7.9426 116.7864 59.1560 29.9801 178.9574 46 R 3.9309 7.7690 118.5621 58.7935 29.9482 178.3726 47 L 4.0478 7.8937 120.5987 57.8199 42.0849 178.3860 48 L 4.6948 7.9036 121.6577 57.6495 42.0052 178.4236 49 E 3.9055 8.3043 119.2180 59.3563 29.4572 178.6797 50 L 3.9722 7.5806 118.7801 58.1525 42.1909 178.7823 51 Q 3.9824 8.2560 118.1507 59.1665 28.6945 179.2466 52 K 4.0883 8.4690 119.6158 59.3319 32.1406 179.7339 53 S 4.1677 8.0848 115.8330 61.2169 62.8368 176.0479 54 K 4.2212 8.3997 121.3907 57.9204 31.9207 178.8642 55 R 3.9946 7.6860 118.8952 59.6191 30.0987 177.6823 56 L 3.9539 7.8554 120.0778 58.5401 41.9115 178.4060 57 D 4.4565 7.7466 116.8931 57.7388 41.0515 178.4556 58 Y 4.0004 7.7502 118.2360 60.8399 38.6351 177.9879 59 V 3.8065 8.3391 119.4050 66.0971 31.0640 177.6847 60 N 4.3949 8.7368 116.7477 56.1732 38.0907 176.6673 61 H 4.2696 7.9670 118.8914 58.4515 30.0681 176.4089 62 A 4.1733 7.7533 120.1839 53.4805 18.7036 178.6185 63 R 4.2397 7.3650 115.6147 57.3890 30.7310 176.6713 64 R 4.1807 7.4923 120.2790 56.2650 30.9727 174.9448 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 39 E 8.29 4.36 0.00 2.13 2.20 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 2.34 2.25 0.00 40 Q 8.49 3.79 0.00 2.30 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 41 S 8.15 4.37 0.00 4.00 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 42 E 8.01 4.18 0.00 2.08 2.04 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 2.26 2.45 0.00 43 R 7.85 3.87 0.00 1.91 1.91 0.00 3.26 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 44 R 7.61 3.92 0.00 1.91 1.98 0.00 3.18 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 1.66 1.93 0.00 45 R 7.94 3.97 0.00 2.00 1.98 0.00 3.12 0.00 0.00 3.48 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 46 R 7.77 3.93 0.00 1.82 2.07 0.00 3.09 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 47 L 7.89 4.05 0.00 1.81 1.83 0.92 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.90 4.69 0.00 1.93 1.73 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.30 3.91 0.00 2.28 1.94 0.00 0.00 0.00 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 2.33 0.00 50 L 7.58 3.97 0.00 1.85 1.81 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.26 3.98 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 52 K 8.47 4.09 0.00 1.78 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.71 7.81 53 S 8.08 4.17 0.00 4.06 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 54 K 8.40 4.22 0.00 1.98 1.80 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.47 7.81 55 R 7.69 3.99 0.00 2.08 2.11 0.00 3.16 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 56 L 7.86 3.95 0.00 1.92 1.68 0.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 57 D 7.75 4.46 0.00 2.77 2.77 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 58 Y 7.75 4.00 0.00 3.31 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 8.34 3.81 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.06 0.00 0.00 60 N 8.74 4.39 0.00 2.98 2.86 0.00 0.00 6.55 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 H 7.97 4.27 0.00 3.05 3.25 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 7.75 4.17 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.36 4.24 0.00 1.94 1.98 0.00 3.11 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 64 R 7.49 4.18 0.00 1.75 1.73 0.00 3.18 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 1.53 1.51 0.00