NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0321 8.2548 109.1314 45.3511 0.0000 172.7388 2 R 3.9658 8.2386 118.1995 55.7942 31.3381 174.4806 3 L 5.0468 9.6280 123.7392 53.0698 46.6621 175.0826 4 F 5.0103 9.2242 121.9703 55.8258 41.6311 174.8758 5 K 4.9475 8.9812 125.1296 54.8661 33.7256 174.8119 6 I 5.0676 8.6106 121.4522 59.3755 41.2288 174.6644 7 T 5.0436 8.6245 118.7691 62.0479 72.7315 173.0208 8 A 4.7685 7.8635 126.1151 50.7214 23.8611 174.2045 9 C 4.8893 8.7422 118.7280 57.6097 34.5287 172.7860 10 V 4.6979 8.7988 126.7707 60.5832 33.6202 173.8737 11 P 4.5644 0.0000 0.0000 61.9190 33.0298 174.6729 12 S 4.6332 8.4652 113.0473 56.9032 62.8410 173.2827 13 Q 4.5208 8.7003 125.5620 56.2394 29.8445 176.1830 14 T 4.3917 7.9205 107.7194 62.4806 70.5083 174.4111 15 R 4.6331 7.4389 118.7527 54.4065 33.2301 174.9548 16 I 4.1169 8.0213 123.9525 59.7866 35.7354 174.5937 17 R 3.9826 8.1622 122.7848 56.5320 30.3843 176.8992 18 T 4.2347 8.4346 116.7997 62.4973 68.1659 174.2349 19 Q 4.2443 7.7179 121.3498 54.7744 30.1044 174.4368 20 R 3.8546 8.5014 123.2512 57.4079 29.5661 176.1178 21 E 4.5404 8.5114 124.6629 55.8477 29.8647 176.4818 22 L 3.9891 7.9426 119.8240 59.2025 41.8134 178.5824 23 Q 4.1577 8.1064 116.8309 58.2167 28.8758 177.0341 24 N 4.7797 8.1241 115.3131 54.3115 39.2841 176.3078 25 T 4.4161 7.7667 117.3662 64.4553 69.4068 172.7833 26 Y 4.9014 7.9193 122.1741 56.0530 40.1045 174.3676 27 F 5.1650 7.9706 120.6983 55.7621 42.2216 173.4566 28 T 5.3252 8.4345 115.4973 61.9514 71.8462 173.3779 29 K 4.5482 9.3067 123.9591 56.0917 36.4935 174.1903 30 L 4.9343 8.4066 121.1978 53.8284 43.1679 176.4625 31 V 4.4537 8.8675 123.1456 60.2700 34.6681 173.2234 32 P 4.6606 0.0000 0.0000 62.8186 32.3601 176.2834 33 Y 4.4963 9.2448 124.9220 61.1281 38.6130 178.3914 34 E 4.4718 8.6412 113.4228 57.7772 29.8682 176.5147 35 N 5.0210 8.6690 116.7166 52.8477 41.1122 176.3690 36 W 4.5949 8.3907 128.4797 60.4041 30.7505 177.4329 37 F 3.4288 8.0544 120.0830 61.2360 38.9516 176.9638 38 R 3.9409 7.9705 117.7954 59.2082 29.9719 177.9624 39 E 3.8543 8.1890 119.1655 59.1783 29.7454 178.2579 40 Q 3.0961 7.2454 119.8691 59.1889 28.8129 178.6013 41 Q 3.7593 7.3312 118.3799 58.6564 28.1172 178.7653 42 R 3.8369 7.6258 119.4288 59.6053 30.1252 178.6749 43 I 3.7720 7.6716 119.4109 64.3907 36.9635 178.3319 44 Q 3.9196 8.0138 118.8455 59.1553 28.3840 179.4077 45 K 4.0533 7.9270 117.6238 59.0646 32.0183 177.7207 46 M 4.3074 7.3567 116.7223 55.0030 31.6766 176.8267 47 G 3.8947 7.8666 106.0714 46.0524 0.0000 174.7391 48 G 3.8111 7.8553 108.0984 44.6800 0.0000 173.3476 49 K 4.5072 9.0026 122.8127 54.3144 34.6351 175.0117 50 I 4.2159 8.3222 128.6178 60.9089 37.1683 175.6996 51 V 3.9639 8.4964 128.3332 64.8084 32.5106 176.3740 52 K 4.6688 7.6054 120.0813 54.9630 35.7984 174.9862 53 V 4.7540 8.3124 125.7919 61.3854 34.3885 174.0566 54 E 4.7599 9.1017 125.9455 54.6621 34.5892 174.7227 55 L 4.3673 8.3598 123.9268 53.4890 42.0014 176.6891 56 A 3.9469 8.8437 131.1216 55.3011 18.4422 178.7042 57 T 4.0145 7.7236 102.7073 61.8921 69.4687 175.0947 58 G 4.1106 7.8258 115.9728 46.1783 0.0000 174.4785 59 K 3.9026 7.8758 121.5616 56.1220 32.0843 176.3259 60 Q 4.4933 8.5089 122.4066 55.4133 30.4978 175.3117 61 G 3.7633 8.5919 107.2090 46.7993 0.0000 173.9414 62 I 3.9123 7.6813 119.9762 60.9503 37.9896 176.2181 63 N 4.5678 8.7740 122.7682 55.2747 39.2036 175.7040 64 T 4.4531 7.7638 110.4053 61.4117 70.8630 173.6714 65 G 4.2835 8.8270 118.1024 46.5762 0.0000 173.7924 66 L 4.2595 7.7075 116.8558 54.9831 43.2447 177.6022 67 A 4.1625 7.8650 126.0800 52.3346 18.3444 177.1028 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 G 8.25 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 2 R 8.24 3.97 0.00 1.83 1.76 0.00 2.71 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 3 L 9.63 5.05 0.00 1.53 1.44 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 4 F 9.22 5.01 0.00 2.71 2.31 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 5 K 8.98 4.95 0.00 1.78 1.63 0.00 1.43 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.35 7.81 6 I 8.61 5.07 1.59 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.96 -0.37 0.00 0.00 7 T 8.62 5.04 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 0.92 0.00 0.00 8 A 7.86 4.77 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.74 4.89 0.00 3.02 2.73 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 10 V 8.80 4.70 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.07 0.00 0.00 11 P 0.00 4.56 0.00 2.23 2.09 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 12 S 8.47 4.63 0.00 3.85 3.81 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 13 Q 8.70 4.52 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.63 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 14 T 7.92 4.39 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 15 R 7.44 4.63 0.00 1.73 1.78 0.00 3.23 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 16 I 8.02 4.12 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.94 0.92 0.00 0.00 17 R 8.16 3.98 0.00 1.81 1.90 0.00 3.21 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 18 T 8.43 4.23 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 19 Q 7.72 4.24 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 20 R 8.50 3.85 0.00 1.82 1.91 0.00 3.27 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 21 E 8.51 4.54 0.00 2.27 1.91 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 2.31 2.43 0.00 22 L 7.94 3.99 0.00 1.82 1.70 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.11 4.16 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 24 N 8.12 4.78 0.00 2.83 2.89 0.00 0.00 7.04 7.65 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 25 T 7.77 4.42 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 26 Y 7.92 4.90 0.00 2.97 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.97 5.17 0.00 3.09 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 28 T 8.43 5.33 4.28 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 1.21 0.00 0.00 29 K 9.31 4.55 0.00 1.75 1.88 0.00 1.22 0.00 0.00 1.40 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.45 7.81 30 L 8.41 4.93 0.00 1.55 1.63 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.87 4.45 2.06 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 1.33 0.00 0.00 1.00 0.00 0.00 32 P 0.00 4.66 0.00 2.33 2.06 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 33 Y 9.24 4.50 0.00 3.12 3.10 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 34 E 8.64 4.47 0.00 2.24 2.26 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 2.41 2.38 0.00 35 N 8.67 5.02 0.00 2.95 2.94 0.00 0.00 6.57 7.52 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 36 W 8.39 4.59 0.00 3.18 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 F 8.05 3.43 0.00 2.98 2.85 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 38 R 7.97 3.94 0.00 1.96 1.93 0.00 3.25 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 39 E 8.19 3.85 0.00 2.30 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 0.00 2.63 2.65 0.00 40 Q 7.25 3.10 0.00 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 1.89 1.78 0.00 41 Q 7.33 3.76 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 42 R 7.63 3.84 0.00 2.02 2.11 0.00 3.09 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 43 I 7.67 3.77 1.99 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.60 0.93 0.00 0.00 44 Q 8.01 3.92 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 45 K 7.93 4.05 0.00 1.70 1.85 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.63 7.81 46 M 7.36 4.31 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.48 0.00 47 G 7.87 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.86 3.81 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 0.00 0.00 0.00 49 K 9.00 4.51 0.00 1.72 1.63 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.52 7.81 50 I 8.32 4.22 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.66 1.08 0.00 0.00 51 V 8.50 3.96 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 0.74 0.00 0.00 0.87 0.00 0.00 52 K 7.61 4.67 0.00 1.85 1.52 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.47 7.81 53 V 8.31 4.75 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.05 0.00 0.00 54 E 9.10 4.76 0.00 1.89 1.74 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 2.21 2.21 0.00 55 L 8.36 4.37 0.00 1.62 1.48 0.43 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.84 3.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.72 4.01 4.19 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 1.25 0.00 0.00 58 G 7.83 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 0.00 0.00 0.00 59 K 7.88 3.90 0.00 1.69 1.75 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.47 7.81 60 Q 8.51 4.49 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 61 G 8.59 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 0.00 0.00 0.00 62 I 7.68 3.91 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.95 0.00 0.00 63 N 8.77 4.57 0.00 2.69 2.85 0.00 0.00 6.78 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 64 T 7.76 4.45 4.22 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 0.00 0.00 1.19 0.00 0.00 65 G 8.83 4.28 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 0.00 66 L 7.71 4.26 0.00 1.67 1.62 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.86 4.16 1.23 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