NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9749 8.3244 119.3848 56.7264 40.1024 174.1892 2 V 3.4670 7.7241 120.6188 62.8906 32.4303 174.1041 3 N 4.6621 9.2603 123.0072 52.0261 39.1345 174.9073 4 Q 4.5637 8.1951 120.1060 53.7371 33.0081 174.4523 5 H 4.6090 8.5973 116.1936 54.7613 28.4691 175.3225 6 L 4.6478 8.4128 125.4491 53.1308 42.9573 175.9877 7 C 4.9793 8.1464 120.6973 58.3240 32.5112 175.6855 8 G 3.7690 8.4642 110.1901 46.6624 0.0000 177.3678 9 S 4.1215 8.5047 116.3420 61.1126 63.3433 176.4537 10 H 4.1264 7.9778 118.6669 58.5958 28.3101 177.3817 11 L 3.8760 7.7549 121.6940 58.2530 42.0350 179.2806 12 V 3.3937 7.2177 110.8541 63.7945 31.3891 178.4428 13 E 3.9693 7.9241 118.2907 59.1991 29.1999 179.0128 14 A 3.9966 7.7612 120.7503 54.7663 18.3411 179.6845 15 L 3.5153 7.4596 117.8278 57.7481 41.3951 179.0844 16 Y 3.9928 7.6158 119.5047 60.4225 38.5579 177.5359 17 L 3.7724 7.6548 119.9915 58.2090 42.2561 178.9434 18 V 3.5419 7.5028 116.6338 66.0899 31.4900 177.3380 19 C 4.2414 8.3043 116.6680 60.8444 28.7464 174.6120 20 G 3.5267 8.5883 111.9755 47.0935 0.0000 177.5934 21 E 4.1855 8.7599 119.5437 58.0234 29.8023 176.9067 22 R 3.9411 7.5127 115.4165 57.8323 30.1929 177.9080 23 G 4.0111 9.2401 105.1036 45.2811 0.0000 171.9096 24 F 4.8713 7.4171 111.7399 55.9772 40.0307 173.1035 25 F 4.9558 8.6450 116.1042 55.1286 39.9296 174.7129 26 Y 4.6839 8.7241 123.0960 56.0420 40.0497 174.5885 27 T 4.3630 8.2089 116.8436 59.0755 71.3156 172.3028 28 P 4.3046 0.0000 0.0000 62.5754 31.3825 176.1676 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 F 8.32 4.97 0.00 3.06 2.98 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 0.00 0.00 0.00 2 V 7.72 3.47 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 0.71 0.00 0.00 0.93 0.00 0.00 3 N 9.26 4.66 0.00 2.79 2.58 0.00 0.00 6.48 7.46 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 4 Q 8.20 4.56 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 5 H 8.60 4.61 0.00 3.14 3.23 0.00 5.65 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.41 4.65 0.00 1.59 1.57 0.88 0.90 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 7 C 8.15 4.98 0.00 2.96 2.80 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 0.00 0.00 0.00 0.00 8 G 8.46 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 0.00 0.00 0.00 9 S 8.50 4.12 0.00 4.08 4.06 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 10 H 7.98 4.13 0.00 3.33 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.75 3.88 0.00 1.76 1.74 0.84 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.22 3.39 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.85 0.00 0.00 13 E 7.92 3.97 0.00 2.29 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 2.29 2.34 0.00 14 A 7.76 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.46 3.52 0.00 0.98 0.13 0.67 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.62 3.99 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.65 3.77 0.00 1.76 1.74 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.50 3.54 2.02 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 0.75 0.00 0.00 0.73 0.00 0.00 19 C 8.30 4.24 0.00 3.14 3.15 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 0.00 0.00 0.00 0.00 20 G 8.59 3.53 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 0.00 0.00 0.00 21 E 8.76 4.19 0.00 2.00 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 2.23 1.90 0.00 22 R 7.51 3.94 0.00 1.98 2.06 0.00 3.18 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 23 G 9.24 4.01 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 0.00 0.00 0.00 24 F 7.42 4.87 0.00 3.08 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 25 F 8.65 4.96 0.00 3.14 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 26 Y 8.72 4.68 0.00 3.05 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 27 T 8.21 4.36 4.26 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 1.40 0.00 0.00 28 P 0.00 4.30 0.00 1.97 1.92 0.00 3.51 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.55 0.00