NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3077 8.2644 123.5813 52.6014 18.8449 176.9099 2 C 4.1200 8.3937 121.1188 56.4559 41.3756 171.4595 3 N 4.0420 9.0259 114.8078 53.3542 36.0809 173.2872 4 D 4.6347 8.2313 121.6345 57.0759 41.0445 178.2711 5 R 3.9190 7.8391 118.7990 59.3059 29.8505 177.5354 6 D 4.4715 7.9824 116.4966 56.4357 41.4588 178.6158 7 C 4.3311 8.6320 117.9893 59.8232 36.7593 175.9903 8 S 4.0811 7.9370 115.4968 61.2241 62.8262 176.5170 9 L 3.9311 7.7437 122.1222 57.8162 41.5082 179.2812 10 D 4.3913 7.7332 117.8523 57.4758 40.1929 178.3911 11 C 4.1374 8.0752 116.8334 60.0165 40.0685 176.1983 12 I 3.5972 8.1072 120.3195 64.1296 36.5710 177.7987 13 M 4.2082 7.9617 119.0890 58.3053 31.9320 178.1262 14 K 3.8743 7.7925 117.4506 58.8767 32.2782 176.6814 15 G 3.5153 7.0907 105.5625 45.2807 0.0000 173.4463 16 Y 4.0825 7.7686 118.4641 57.3095 39.4239 174.1002 17 N 4.7372 8.2944 117.2881 54.9257 40.1716 174.6324 18 F 5.0575 6.4113 110.8029 55.9195 41.0274 173.5481 19 G 4.2348 7.7528 108.7792 47.3524 0.0000 172.0522 20 K 4.2557 8.1848 118.4147 56.8177 35.3845 173.0591 21 C 5.3809 8.6004 117.1100 55.8732 39.4929 173.6279 22 V 4.4291 7.8052 122.3113 62.5140 33.9664 175.5273 23 R 3.7916 9.8020 125.6099 57.3561 27.6678 176.3449 24 G 3.8598 8.3578 100.5732 46.7398 0.0000 173.7001 25 S 4.7853 8.4673 117.1174 56.2916 66.0315 172.2549 26 C 4.6486 8.5048 120.0095 55.5103 42.3840 172.9469 27 Q 4.9283 8.5386 125.4254 54.2983 32.1178 174.0959 28 C 5.4235 8.4891 117.1903 55.6749 44.4974 173.2035 29 R 4.9225 9.6537 118.9668 54.4699 34.0447 174.8964 30 R 4.5177 8.4519 120.7898 54.5075 32.4624 175.0548 31 T 4.6624 7.9683 113.8818 60.3268 71.5018 173.0791 32 S 4.4862 7.8550 115.9650 58.9252 66.5720 174.7896 33 G 3.7289 8.5548 109.4711 47.1590 0.0000 172.4177 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 8.26 4.31 1.28 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 2 C 8.39 4.12 0.00 3.09 3.11 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 3 N 9.03 4.04 0.00 2.96 2.78 0.00 0.00 7.15 8.07 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 4 D 8.23 4.63 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 R 7.84 3.92 0.00 1.92 1.91 0.00 3.22 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 6 D 7.98 4.47 0.00 2.74 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 7 C 8.63 4.33 0.00 3.27 3.08 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 0.00 0.00 0.00 8 S 7.94 4.08 0.00 4.11 4.18 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 9 L 7.74 3.93 0.00 1.99 1.75 0.97 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 10 D 7.73 4.39 0.00 2.85 2.68 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 0.00 0.00 0.00 0.00 11 C 8.08 4.14 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.11 3.60 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.67 0.94 0.00 0.00 13 M 7.96 4.21 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 14 K 7.79 3.87 0.00 2.09 2.16 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.52 1.67 7.81 15 G 7.09 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.77 4.08 0.00 3.08 3.03 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 17 N 8.29 4.74 0.00 2.41 1.94 0.00 0.00 7.02 6.80 0.00 0.00 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 F 6.41 5.06 0.00 3.27 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 19 G 7.75 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 0.00 0.00 0.00 0.00 20 K 8.18 4.26 0.00 1.91 1.94 0.00 1.34 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 1.24 7.81 21 C 8.60 5.38 0.00 2.99 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.94 0.00 0.00 23 R 9.80 3.79 0.00 1.92 1.94 0.00 3.35 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 24 G 8.36 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.47 4.79 0.00 3.90 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 26 C 8.50 4.65 0.00 2.84 2.91 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 27 Q 8.54 4.93 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.39 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 28 C 8.49 5.42 0.00 2.36 2.76 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 29 R 9.65 4.92 0.00 1.83 1.61 0.00 3.22 0.00 0.00 3.45 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 30 R 8.45 4.52 0.00 1.29 1.53 0.00 2.95 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.85 0.00 31 T 7.97 4.66 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 32 S 7.85 4.49 0.00 3.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.55 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00