NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5706 8.2227 120.1908 54.1958 43.6106 177.1747 3 E 3.7394 8.2737 119.6026 58.7567 29.4504 177.1679 4 L 3.9533 8.0423 118.7415 57.9310 42.2358 178.6017 5 E 4.0164 8.2646 121.1480 59.7993 29.7251 179.3440 6 R 3.9727 8.2280 120.9467 61.6895 29.4350 181.3170 7 R 4.2017 8.0656 118.9067 58.9568 29.9247 179.2948 8 I 3.7584 7.8424 119.8991 64.3313 37.0773 178.5517 9 R 4.2248 8.0112 120.2862 58.8061 29.8930 179.0065 10 E 3.9882 8.1691 118.1389 59.2885 29.4166 179.3445 11 L 4.0103 7.9619 119.0869 57.8570 41.4721 179.4020 12 E 3.9627 8.5449 118.5979 59.3846 29.1077 179.3153 13 A 3.9970 8.1744 120.8457 55.1241 18.2013 179.7104 14 R 3.8728 7.8375 116.6662 59.0015 30.3155 177.9066 15 I 4.1344 7.3758 109.5521 61.1144 38.2030 175.6308 16 K 4.1107 7.5839 127.0490 56.7513 32.0346 175.8806 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 D 8.22 4.57 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 E 8.27 3.74 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 4 L 8.04 3.95 0.00 1.73 1.70 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.26 4.02 0.00 2.07 1.94 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 0.00 2.37 2.43 0.00 6 R 8.23 3.97 0.00 1.85 1.93 0.00 3.32 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 7 R 8.07 4.20 0.00 2.01 2.00 0.00 3.31 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 8 I 7.84 3.76 1.99 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 1.52 0.72 0.91 0.00 0.00 9 R 8.01 4.22 0.00 2.03 1.98 0.00 3.13 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 10 E 8.17 3.99 0.00 2.14 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 0.00 2.28 2.58 0.00 11 L 7.96 4.01 0.00 1.88 1.71 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.54 3.96 0.00 2.15 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 2.33 2.41 0.00 13 A 8.17 4.00 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 14 R 7.84 3.87 0.00 1.94 2.12 0.00 3.30 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 15 I 7.38 4.13 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 1.62 0.74 0.91 0.00 0.00 16 K 7.58 4.11 0.00 1.96 1.72 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.37 7.81