NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3586 8.2876 118.7970 56.0571 31.9162 177.5065 2 I 3.5904 7.6088 113.9444 63.0543 37.3558 176.1918 3 A 4.0853 8.3830 124.0098 54.3346 18.7197 180.0347 4 A 4.1267 7.9987 119.4031 54.4861 18.6954 179.7516 5 L 3.9709 7.7004 116.9382 57.8605 41.9998 178.9314 6 E 4.1268 8.2522 117.6714 59.0780 29.1496 179.0578 7 K 3.9768 7.7995 120.8195 59.1668 32.1570 178.4302 8 E 4.0417 8.2674 119.6413 58.7316 29.3791 178.6342 9 I 3.6522 7.4351 120.1167 64.5469 37.1410 178.0952 10 A 3.9648 7.7640 119.8266 54.7110 18.0547 179.5864 11 A 3.9076 8.0731 119.8584 55.5809 18.6720 179.9723 12 L 4.0496 7.8361 116.5327 57.4148 41.4981 179.2298 13 E 3.9626 8.0996 119.4081 58.9850 29.9045 178.3167 14 K 4.1176 8.3546 120.1182 59.2411 32.2174 178.7342 15 E 3.9616 8.2087 119.1750 59.3746 29.3952 179.0864 16 I 3.8110 7.8178 118.0921 63.8216 38.0488 177.7051 17 A 4.0660 7.9347 121.3138 54.7014 17.8879 179.3195 18 A 4.0409 8.1681 119.5917 54.7118 18.4598 178.5961 19 L 4.0118 7.5604 117.5864 59.0467 40.5353 178.6078 20 E 4.0088 8.1073 118.6753 58.6043 30.0217 175.9348 21 K 4.1338 7.7245 122.5534 56.6129 32.1546 176.2622 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 E 8.29 4.36 0.00 2.13 2.28 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 2.26 2.25 0.00 2 I 7.61 3.59 1.87 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 1.57 0.50 0.91 0.00 0.00 3 A 8.38 4.09 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.00 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 3.97 0.00 1.74 1.74 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.25 4.13 0.00 2.26 2.20 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 2.35 2.48 0.00 7 K 7.80 3.98 0.00 1.80 2.03 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.58 7.81 8 E 8.27 4.04 0.00 2.19 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 0.00 2.30 2.35 0.00 9 I 7.44 3.65 2.04 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 1.69 0.74 0.93 0.00 0.00 10 A 7.76 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 3.91 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.84 4.05 0.00 1.74 1.73 0.94 0.81 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 13 E 8.10 3.96 0.00 2.17 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 0.00 2.32 2.35 0.00 14 K 8.35 4.12 0.00 2.04 1.78 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 15 E 8.21 3.96 0.00 2.23 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 2.31 2.47 0.00 16 I 7.82 3.81 2.00 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 1.45 1.35 0.93 0.00 0.00 17 A 7.93 4.07 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.17 4.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.56 4.01 0.00 1.76 1.99 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.11 4.01 0.00 1.95 2.00 0.00 0.00 0.00 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 2.29 0.00 21 K 7.72 4.13 0.00 1.78 1.67 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.38 7.81