NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3770 8.3231 115.2883 57.5643 63.5270 173.3827 2 G 3.5464 8.6452 116.9268 44.6443 0.0000 169.6009 3 E 4.0183 8.7321 124.5980 55.6568 31.2960 175.2769 4 G 3.7947 8.2947 114.2539 45.4439 0.0000 173.0132 5 S 4.4555 7.9366 114.0952 56.2800 65.2926 174.0255 6 F 4.1648 8.8054 126.8485 57.6346 39.3013 174.1387 7 Q 4.6256 8.5687 125.8648 53.3563 30.4452 173.3520 8 P 4.4726 0.0000 0.0000 62.5456 32.2268 176.4538 9 S 4.3824 8.4397 117.1807 58.5000 63.6231 173.3798 10 Q 4.5610 8.2376 121.4616 53.9880 29.9568 176.0250 11 E 4.0549 8.6781 122.5403 56.4803 30.1845 175.6906 12 N 4.7727 8.3665 120.0657 51.2099 40.1177 173.1987 13 P 4.4308 0.0000 0.0000 63.0162 31.3613 176.1128 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 S 8.32 4.38 0.00 3.84 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 2 G 8.65 3.55 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 3 E 8.73 4.02 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 4 G 8.29 3.79 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 5 S 7.94 4.46 0.00 3.77 3.67 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 F 8.81 4.16 0.00 3.08 2.95 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 7 Q 8.57 4.63 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 8 P 0.00 4.47 0.00 2.23 2.05 0.00 3.85 0.00 0.00 3.70 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 S 8.44 4.38 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 8.24 4.56 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 11 E 8.68 4.05 0.00 1.95 1.89 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 2.32 2.25 0.00 12 N 8.37 4.77 0.00 2.67 2.72 0.00 0.00 7.05 7.69 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 13 P 0.00 4.43 0.00 2.08 1.96 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00