NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8083 8.3249 115.8595 56.3276 39.7831 175.1964 2 V 3.5790 7.0538 113.8521 61.8908 32.4669 175.1381 3 N 4.6015 7.5046 119.8129 50.4275 37.7959 172.4124 4 Q 4.4001 6.9827 116.3193 55.6494 31.5322 173.7960 5 H 4.3667 8.7249 115.7419 55.4520 28.8608 175.0718 6 L 4.7457 8.5247 124.6913 53.1427 43.6611 175.6819 7 C 4.9552 8.1927 120.7875 58.5995 32.9387 175.2654 8 G 3.7725 8.4335 110.9535 46.4974 0.0000 177.4242 9 S 4.1135 8.6208 117.6177 61.2165 63.3271 176.3174 10 H 4.1954 8.2326 118.4525 58.5849 28.3181 177.4850 11 L 3.9188 7.7879 121.7524 58.0947 42.1122 178.8920 12 V 3.2399 7.4551 118.1547 65.7705 31.3083 177.6121 13 E 3.9303 8.3544 118.9240 59.1338 29.4250 178.5352 14 A 4.1794 7.8941 120.6716 55.3815 18.3975 179.5543 15 L 3.6361 7.7173 117.3561 57.8662 41.3736 179.1709 16 Y 4.2866 7.6860 119.3228 60.8416 38.5620 178.2495 17 L 3.8171 7.9561 118.7413 57.6103 41.8059 179.4055 18 V 3.7770 7.8916 117.5671 66.2598 31.8796 177.7068 19 C 4.3175 8.5433 116.7425 60.8217 28.4540 174.8977 20 G 3.6274 8.3212 109.8851 46.4488 0.0000 176.3858 21 E 4.1732 8.8289 122.3587 58.4524 29.6256 178.2556 22 R 3.9106 7.7486 117.7575 57.1169 30.2681 177.7772 23 G 3.8995 9.3891 105.7010 45.3198 0.0000 171.2729 24 F 4.8966 7.3650 112.3808 56.1827 40.1008 172.8404 25 F 4.9424 8.5650 115.1391 55.0849 39.9497 173.6442 26 Y 4.6784 9.0214 125.6345 56.4263 39.2221 175.1450 27 T 4.3602 7.8599 125.1356 60.4193 69.1312 172.1808 28 P 4.0312 0.0000 0.0000 65.1433 31.4902 178.2494 29 K 4.2290 7.6250 120.3901 54.0726 30.7844 176.4101 30 A 4.3151 8.0106 124.8476 51.9661 19.1820 176.3485 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 4.81 0.00 3.14 3.21 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 0.00 0.00 0.00 0.00 2 V 7.05 3.58 1.81 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 -0.21 0.00 0.00 0.66 0.00 0.00 3 N 7.50 4.60 0.00 2.66 2.73 0.00 0.00 6.77 7.69 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 4 Q 6.98 4.40 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.98 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 5 H 8.72 4.37 0.00 3.19 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.52 4.75 0.00 1.59 1.59 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.19 4.96 0.00 2.88 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 8 G 8.43 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 8.62 4.11 0.00 4.00 4.13 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 0.00 0.00 0.00 0.00 10 H 8.23 4.20 0.00 3.32 3.39 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.79 3.92 0.00 1.84 1.81 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.46 3.24 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 0.89 0.00 0.00 0.26 0.00 0.00 13 E 8.35 3.93 0.00 2.12 2.18 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 2.34 2.38 0.00 14 A 7.89 4.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 3.64 0.00 0.92 0.25 0.76 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.69 4.29 0.00 3.21 3.19 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 17 L 7.96 3.82 0.00 1.96 1.79 0.75 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.89 3.78 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 0.78 0.00 0.00 0.88 0.00 0.00 19 C 8.54 4.32 0.00 3.27 3.24 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 20 G 8.32 3.63 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 0.00 0.00 0.00 21 E 8.83 4.17 0.00 1.98 2.04 0.00 0.00 0.00 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 2.28 0.00 22 R 7.75 3.91 0.00 2.10 2.06 0.00 3.26 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 23 G 9.39 3.90 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 0.00 0.00 0.00 24 F 7.37 4.90 0.00 3.08 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 25 F 8.56 4.94 0.00 3.19 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 9.02 4.68 0.00 3.17 3.13 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 0.00 0.00 0.00 0.00 27 T 7.86 4.36 4.27 0.00 0.00 0.00 0.00 0.00 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 28 P 0.00 4.03 0.00 2.08 1.88 0.00 3.47 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.89 0.00 29 K 7.62 4.23 0.00 1.71 1.79 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.47 7.81 30 A 8.01 4.32 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00