NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4638 8.3049 118.1948 54.6249 32.0425 174.5395 2 R 3.7566 7.9533 124.7322 58.7886 30.7093 175.1449 3 D 4.7999 8.7666 118.1269 52.8009 43.1648 175.3468 4 R 4.6216 8.3673 123.7053 56.0365 31.3191 177.5106 5 T 3.9014 7.8909 116.9570 67.0376 68.0503 175.7958 6 H 4.2535 8.0907 118.9114 59.3003 30.3315 176.9107 7 E 4.0935 8.1505 118.2921 58.7383 29.0889 177.4747 8 L 3.9577 8.6473 122.2908 53.5593 41.7759 181.7628 9 R 3.1730 6.7306 111.3488 55.4897 31.8285 177.4271 10 Q 4.5754 9.0845 122.3249 56.4507 29.7060 175.6946 11 G 3.7490 7.2515 105.6653 47.3876 0.0000 176.4968 12 D 4.6738 9.4358 120.4403 55.6322 41.9398 178.2066 13 N 4.1584 8.3062 117.2913 56.2624 38.7750 175.0957 14 I 4.3681 7.5591 108.6055 60.6544 39.1892 177.4312 15 S 4.0983 7.8984 117.0217 61.2626 63.5307 176.1097 16 D 4.4524 8.7153 121.2339 57.0078 41.0860 177.0023 17 D 4.6065 7.6240 117.2132 55.3019 40.6030 176.6528 18 E 4.6741 8.3043 110.3199 55.2024 36.0391 178.9603 19 D 4.7807 7.7428 121.3466 55.5948 41.6718 173.3383 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 M 8.30 4.46 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 2 R 7.95 3.76 0.00 1.90 2.07 0.00 3.18 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 3 D 8.77 4.80 0.00 2.62 2.56 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 4 R 8.37 4.62 0.00 1.88 1.88 0.00 3.20 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 5 T 7.89 3.90 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 1.22 0.00 0.00 6 H 8.09 4.25 0.00 3.09 3.35 0.00 5.93 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.15 4.09 0.00 2.22 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 2.46 2.36 0.00 8 L 8.65 3.96 0.00 1.89 1.67 0.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 9 R 6.73 3.17 0.00 1.97 1.51 0.00 3.33 0.00 0.00 3.16 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.77 0.00 10 Q 9.08 4.58 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.01 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 11 G 7.25 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.44 4.67 0.00 2.79 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.31 4.16 0.00 2.68 2.85 0.00 0.00 6.83 7.94 0.00 0.00 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 I 7.56 4.37 1.86 0.00 0.00 0.84 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 1.02 0.90 0.00 0.00 15 S 7.90 4.10 0.00 3.97 4.34 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.72 4.45 0.00 2.92 2.65 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 0.00 0.00 0.00 0.00 17 D 7.62 4.61 0.00 2.80 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.30 4.67 0.00 2.02 1.76 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 2.17 2.15 0.00 19 D 7.74 4.78 0.00 2.72 2.63 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