NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2018 8.2649 123.5753 50.9227 19.6602 176.4845 2 P 3.8011 0.0000 0.0000 62.8169 31.8999 176.0078 3 S 4.4548 8.2122 124.3556 56.6086 62.8564 171.5868 4 Y 4.7349 6.3761 116.7559 56.1702 40.6303 174.5337 5 S 4.3518 8.6689 117.0157 57.6581 63.5057 172.9596 6 P 4.6668 0.0000 0.0000 61.0861 32.2512 174.2208 7 P 4.3938 0.0000 0.0000 61.8922 31.7404 174.5937 8 P 4.3763 0.0000 0.0000 61.9513 31.8652 174.3860 9 P 4.3203 0.0000 0.0000 62.1614 31.8341 174.7225 10 P 4.4452 0.0000 0.0000 62.9567 31.5439 175.7603 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 A 8.26 4.20 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 3.80 0.00 1.39 1.10 0.00 3.52 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.03 0.00 3 S 8.21 4.45 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 6.38 4.73 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.67 4.35 0.00 3.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 P 0.00 4.67 0.00 2.19 2.03 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 7 P 0.00 4.39 0.00 2.22 2.13 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 8 P 0.00 4.38 0.00 2.21 2.11 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 9 P 0.00 4.32 0.00 2.06 2.04 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 10 P 0.00 4.45 0.00 2.16 2.02 0.00 3.54 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.07 0.00