NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 40 R 4.3737 8.1085 119.0806 56.3205 31.7887 177.5045 41 A 4.0828 7.9763 120.5285 54.4733 18.2069 177.0153 42 E 4.0211 8.9342 117.8917 61.4729 30.4281 180.6964 43 R 4.1550 8.1015 119.0928 58.9901 30.1467 178.8671 44 W 4.0669 8.4405 128.0693 60.1496 30.5229 178.0770 45 K 4.1966 8.0899 119.3073 59.3282 31.4478 178.8151 46 A 4.0445 8.3660 123.1364 55.7666 18.4101 179.7401 47 E 3.9641 8.3843 116.0921 61.1170 30.0400 180.3829 48 N 4.4875 7.9957 118.4157 54.8294 38.8835 177.7787 49 Q 4.0281 7.7931 125.5822 61.1657 28.1427 185.0000 50 E 4.3443 8.0542 119.3421 61.0313 29.4748 181.3855 51 G 3.8540 7.9236 106.6873 47.8724 0.0000 175.5596 52 M 4.1750 8.3070 120.8302 58.0954 31.8889 178.7117 53 A 4.0682 7.6977 120.0496 54.9433 18.5220 179.3125 54 E 3.8848 7.8508 117.1973 59.1900 29.5867 179.2784 55 V 3.6928 7.6222 117.2920 65.7373 31.5468 177.6266 56 A 4.0517 7.9170 120.3168 55.4247 18.1230 179.8701 57 R 3.8394 8.6039 116.5878 59.5229 30.1623 178.8795 58 F 4.1101 8.6033 120.7766 61.7231 39.2766 177.2657 59 I 3.6688 8.7638 122.1418 64.6954 36.7145 178.8320 60 E 4.0447 8.2077 118.8704 60.8410 29.5910 181.3207 61 M 4.3671 8.1740 120.1633 59.3411 32.5517 178.1821 62 N 4.2084 7.9422 119.3060 56.2074 38.1631 175.6946 63 G 4.0966 6.4591 108.3236 43.2936 0.0000 172.5618 64 S 4.3734 8.0727 118.8326 57.0905 62.7620 174.0886 65 F 4.1727 9.0842 128.8696 59.7575 39.0915 175.2825 66 A 4.2402 7.9077 124.9026 54.5189 20.1427 179.3755 67 D 4.3772 7.9272 116.2607 55.6950 40.4071 180.8567 68 E 4.0400 7.9243 115.9253 59.8515 29.4711 177.6567 69 N 4.6612 7.0640 112.0528 52.5535 39.2577 175.0045 70 R 4.1416 7.5238 116.0893 55.5169 30.4569 175.8550 71 D 4.8395 8.6329 119.9182 52.5047 40.0239 176.1919 72 W 4.5812 7.4056 122.3846 56.9654 28.3198 174.9487 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 40 R 8.11 4.37 0.00 1.75 2.00 0.00 3.22 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.21 0.00 41 A 7.98 4.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.93 4.02 0.00 1.99 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 2.31 1.97 0.00 43 R 8.10 4.15 0.00 2.06 2.07 0.00 3.09 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 44 W 8.44 4.07 0.00 3.55 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.09 4.20 0.00 2.19 2.04 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.59 7.81 46 A 8.37 4.04 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 47 E 8.38 3.96 0.00 2.03 1.88 0.00 0.00 0.00 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 2.23 0.00 48 N 8.00 4.49 0.00 2.26 2.44 0.00 0.00 7.09 7.34 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 49 Q 7.79 4.03 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 50 E 8.05 4.34 0.00 1.97 1.98 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 2.31 1.94 0.00 51 G 7.92 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 M 8.31 4.18 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.84 0.00 53 A 7.70 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.85 3.88 0.00 2.17 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 0.00 2.32 2.33 0.00 55 V 7.62 3.69 2.14 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 1.05 0.00 0.00 1.00 0.00 0.00 56 A 7.92 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.60 3.84 0.00 2.08 2.03 0.00 3.17 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 58 F 8.60 4.11 0.00 3.13 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.76 3.67 2.10 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.92 1.00 0.00 0.00 60 E 8.21 4.04 0.00 2.06 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 2.26 2.18 0.00 61 M 8.17 4.37 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.41 0.00 62 N 7.94 4.21 0.00 2.85 2.69 0.00 0.00 7.19 8.37 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 63 G 6.46 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 0.00 0.00 0.00 64 S 8.07 4.37 0.00 3.85 3.76 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 65 F 9.08 4.17 0.00 3.12 3.06 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 66 A 7.91 4.24 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 7.93 4.38 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 7.92 4.04 0.00 1.93 1.77 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 2.26 2.30 0.00 69 N 7.06 4.66 0.00 2.12 2.58 0.00 0.00 7.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.52 4.14 0.00 1.64 1.87 0.00 2.21 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.17 0.00 71 D 8.63 4.84 0.00 2.85 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 W 7.41 4.58 0.00 3.47 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