NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4743 8.3049 120.3514 55.3807 33.4142 174.4409 2 Q 4.4581 8.5294 122.5405 53.2573 32.7186 172.7922 3 I 4.5605 9.1552 125.0155 59.3532 41.1055 173.5811 4 F 5.0848 9.0607 127.9304 55.9414 41.6183 175.7409 5 V 4.5894 8.3283 113.8401 59.5766 35.6326 174.3499 6 K 4.9585 8.9110 125.8938 54.7019 34.8758 175.0927 7 T 4.7327 8.1348 115.7718 59.5386 71.1479 175.3415 8 L 3.9767 8.4538 123.1519 57.5544 42.0588 178.4183 9 D 4.3721 8.0335 118.2485 57.4811 41.3925 176.0714 10 G 4.0816 6.7443 107.1433 45.9966 0.0000 173.9993 11 K 4.7133 8.1926 116.7174 54.5762 36.5333 176.2619 12 T 4.9210 8.3710 111.9545 60.0282 71.1288 173.1325 13 I 4.5419 8.2804 117.0865 59.6138 41.2661 173.6034 14 T 4.3747 8.0834 118.8982 59.9229 69.9301 172.4076 15 L 4.7873 8.2803 128.2858 53.2347 45.1615 174.8939 16 E 4.7481 8.7243 124.0341 54.5788 33.1573 176.3379 17 V 3.9472 8.3166 114.9805 61.5610 31.9613 175.8815 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 4.47 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 2 Q 8.53 4.46 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 3 I 9.16 4.56 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.41 0.94 0.00 0.00 4 F 9.06 5.08 0.00 2.95 2.98 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 0.00 0.00 0.00 5 V 8.33 4.59 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 0.88 0.00 0.00 0.93 0.00 0.00 6 K 8.91 4.96 0.00 1.78 1.68 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.45 7.81 7 T 8.13 4.73 4.25 0.00 0.00 0.00 0.00 0.00 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 8 L 8.45 3.98 0.00 1.64 1.78 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.03 4.37 0.00 2.65 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 10 G 6.74 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.19 4.71 0.00 1.90 1.65 0.00 1.50 0.00 0.00 1.70 0.00 0.00 3.20 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.40 7.81 12 T 8.37 4.92 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 13 I 8.28 4.54 1.78 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.69 0.87 0.00 0.00 14 T 8.08 4.37 2.69 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 0.00 0.00 0.00 0.65 0.00 0.00 15 L 8.28 4.79 0.00 1.72 1.39 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.72 4.75 0.00 1.81 1.77 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 2.42 2.26 0.00 17 V 8.32 3.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.93 0.00 0.00