NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3463 8.1233 123.5808 52.1739 19.6394 177.2769 2 V 3.4738 8.5813 106.4501 63.8816 31.3293 173.9988 3 A 4.0203 7.4015 126.9659 50.4830 24.4916 175.3562 4 Q 3.5510 7.8789 120.1407 56.6817 28.4380 173.9358 5 S 4.1911 9.0048 122.1245 59.1576 61.1293 176.0840 6 F 5.1678 5.4950 126.0621 58.3517 39.9211 176.1717 7 N 4.1889 8.1112 119.3294 56.7947 38.0963 176.8892 8 M 4.0439 7.8973 118.4645 58.2830 32.1613 178.2032 9 Q 4.0807 7.9877 119.1701 59.3999 29.4810 178.0914 10 Q 3.8989 8.4732 118.9063 58.2789 28.5592 178.0995 11 Q 4.0865 7.9002 120.9983 59.5789 28.7546 179.3313 12 R 4.0225 7.6864 118.4145 59.2355 30.1906 179.1416 13 R 4.0180 8.0222 117.3897 58.8723 30.0711 178.7765 14 F 4.3805 8.8027 121.1656 61.5511 39.3896 176.3764 15 Y 4.0305 8.5128 119.3044 60.7185 38.4918 177.5732 16 E 3.9662 8.7112 120.0297 59.3720 29.5335 178.3962 17 A 3.9727 7.9984 119.3478 55.1993 18.5318 178.9278 18 L 3.8859 7.5775 116.9492 58.7267 42.2263 178.7269 19 H 4.2423 7.9330 114.6032 57.4598 28.8562 175.7037 20 D 4.3721 7.7898 121.2859 53.7054 41.1060 174.2751 21 P 4.3920 0.0000 0.0000 65.1890 32.0919 177.1495 22 N 4.3534 8.3386 117.0558 56.3028 38.9821 175.0789 23 L 4.1864 8.3528 119.2047 54.4536 41.8782 177.5106 24 N 4.6851 9.0679 122.7954 51.8064 39.7104 175.5286 25 E 3.8559 8.6128 119.7632 59.4637 29.4771 178.0750 26 E 3.8936 8.1921 118.5237 59.4245 29.8184 178.3686 27 Q 3.9801 8.4882 118.0532 59.3358 28.7601 178.6479 28 R 3.8581 8.1793 119.4722 59.9567 29.9672 178.0666 29 N 4.2756 8.6948 115.8972 56.1674 38.5819 177.3401 30 A 3.9904 8.2154 122.1800 55.1107 18.4527 179.6977 31 K 3.9205 8.1109 116.7850 59.7581 32.1593 179.3031 32 I 3.9368 8.0029 120.1858 64.5288 37.0203 178.2186 33 K 3.9355 8.3219 120.1874 59.8216 32.0279 178.8247 34 S 4.1361 8.2310 115.3143 61.6912 62.5112 176.9526 35 I 3.9527 7.7798 122.7961 64.0729 36.9979 178.3962 36 R 4.0155 7.9923 117.5874 59.1911 29.9219 178.3294 37 D 4.4101 8.1798 117.2761 57.0913 41.0698 176.0285 38 D 4.4567 8.2990 122.9224 54.4044 41.1057 175.5646 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 A 8.12 4.35 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 2 V 8.58 3.47 2.07 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 0.58 0.00 0.00 0.92 0.00 0.00 3 A 7.40 4.02 1.19 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 0.00 0.00 4 Q 7.88 3.55 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.12 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 5 S 9.00 4.19 0.00 3.63 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 6 F 5.49 5.17 0.00 3.14 2.88 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 0.00 0.00 0.00 7 N 8.11 4.19 0.00 2.88 2.68 0.00 0.00 6.91 7.51 0.00 0.00 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 M 7.90 4.04 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 9 Q 7.99 4.08 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 10 Q 8.47 3.90 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.63 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 11 Q 7.90 4.09 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 12 R 7.69 4.02 0.00 1.97 1.96 0.00 3.29 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 13 R 8.02 4.02 0.00 2.11 2.06 0.00 3.21 0.00 0.00 3.31 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 14 F 8.80 4.38 0.00 2.96 3.20 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 0.00 0.00 0.00 15 Y 8.51 4.03 0.00 3.20 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.71 3.97 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 17 A 8.00 3.97 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 18 L 7.58 3.89 0.00 1.38 1.73 0.74 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 19 H 7.93 4.24 0.00 2.83 3.10 0.00 5.73 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 20 D 7.79 4.37 0.00 2.64 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 21 P 0.00 4.39 0.00 2.20 2.13 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 22 N 8.34 4.35 0.00 2.68 2.99 0.00 0.00 7.38 7.79 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 23 L 8.35 4.19 0.00 1.79 1.61 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.07 4.69 0.00 2.99 2.97 0.00 0.00 6.16 7.21 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 25 E 8.61 3.86 0.00 2.04 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 2.37 2.36 0.00 26 E 8.19 3.89 0.00 2.07 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 0.00 2.38 2.41 0.00 27 Q 8.49 3.98 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 28 R 8.18 3.86 0.00 1.86 2.15 0.00 3.03 0.00 0.00 3.39 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 29 N 8.69 4.28 0.00 2.85 2.86 0.00 0.00 7.29 7.97 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 30 A 8.22 3.99 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 31 K 8.11 3.92 0.00 2.03 1.95 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.66 7.81 32 I 8.00 3.94 2.02 0.00 0.00 0.55 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 0.75 0.98 0.00 0.00 33 K 8.32 3.94 0.00 1.91 2.00 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 34 S 8.23 4.14 0.00 4.09 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 35 I 7.78 3.95 2.20 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.05 0.56 0.00 0.00 36 R 7.99 4.02 0.00 1.96 2.03 0.00 3.30 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.99 0.00 37 D 8.18 4.41 0.00 2.71 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 38 D 8.30 4.46 0.00 2.78 2.53 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