NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.4167 8.1133 119.7160 55.9867 32.7875 177.3961 3 R 3.7194 7.9203 117.5245 58.1917 29.9168 177.2871 4 W 4.2464 8.2442 118.6266 59.7405 29.7218 178.0610 5 K 4.1837 8.2505 119.1230 59.3161 31.6988 178.3970 6 K 3.9207 8.3527 120.0414 59.8441 32.1726 178.4857 7 N 4.3616 7.8377 115.3975 56.1585 38.3912 177.2641 8 F 4.3306 8.5618 122.0724 61.3586 39.4947 177.1540 9 I 3.3366 8.2981 119.5868 64.2720 37.0614 178.1761 10 A 3.9552 8.0499 121.4500 55.2914 18.3402 179.8932 11 V 3.5568 7.7952 116.6420 66.2714 31.5104 178.4807 12 S 3.9595 8.1887 115.1524 61.2149 62.4659 176.4135 13 A 3.7074 8.1319 123.6369 55.0736 18.1335 179.5342 14 A 4.2551 7.9176 118.7705 55.3377 18.3793 179.6443 15 N 4.2814 8.0710 114.6699 56.5280 38.6476 177.4656 16 R 3.8188 8.0163 119.5975 59.5735 30.2186 178.7113 17 F 4.3061 8.0998 117.5090 60.7633 38.7447 177.8053 18 K 3.9503 8.0248 117.5875 59.5709 32.1364 178.2751 19 K 4.0216 8.1313 118.7721 59.5583 32.1438 178.5429 20 I 3.8928 8.0129 120.2735 64.3843 36.9862 178.4483 21 S 4.2953 7.9076 112.7871 60.5994 62.7474 174.8839 22 S 4.4304 7.6584 123.7901 58.9249 62.7596 173.5741 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 2 R 8.11 4.42 0.00 1.91 2.07 0.00 3.12 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 3 R 7.92 3.72 0.00 1.80 1.76 0.00 3.05 0.00 0.00 3.30 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 4 W 8.24 4.25 0.00 3.43 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 5 K 8.25 4.18 0.00 1.99 1.92 0.00 1.89 0.00 0.00 1.82 0.00 0.00 3.18 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.69 7.81 6 K 8.35 3.92 0.00 1.89 2.08 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.50 7.81 7 N 7.84 4.36 0.00 3.07 2.91 0.00 0.00 6.73 8.01 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 8 F 8.56 4.33 0.00 3.27 3.38 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 9 I 8.30 3.34 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.74 0.87 0.00 0.00 10 A 8.05 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.80 3.56 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 1.05 0.00 0.00 1.03 0.00 0.00 12 S 8.19 3.96 0.00 3.38 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.13 3.71 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.92 4.26 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.07 4.28 0.00 2.91 2.86 0.00 0.00 7.00 7.22 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 16 R 8.02 3.82 0.00 1.67 1.77 0.00 3.00 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 17 F 8.10 4.31 0.00 3.23 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 18 K 8.02 3.95 0.00 1.92 2.07 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.52 7.81 19 K 8.13 4.02 0.00 1.90 1.93 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.49 7.81 20 I 8.01 3.89 2.14 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.77 0.97 0.00 0.00 21 S 7.91 4.30 0.00 4.06 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 0.00 22 S 7.66 4.43 0.00 4.02 3.83 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