NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3875 8.3193 115.2898 58.1412 63.2783 173.3501 2 Q 4.1955 8.4278 125.9826 53.7563 29.9507 173.8382 3 L 3.9893 9.0497 122.6280 55.1335 43.5419 177.6385 4 K 4.3498 8.4392 125.5865 55.1644 32.8907 176.6572 5 N 4.5317 8.5284 121.5028 52.5903 39.2497 174.4665 6 N 4.2902 8.5996 118.7422 53.7241 39.4061 174.9311 7 A 3.9761 8.6970 127.0505 54.7107 18.5407 177.6252 8 K 4.1435 8.6316 117.8568 55.7762 32.2697 176.6512 9 E 4.3654 8.4883 126.0004 55.0271 30.7214 176.7980 10 I 3.8580 8.3514 119.5574 62.2404 37.1461 176.2056 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 4.39 0.00 3.85 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 2 Q 8.43 4.20 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 3 L 9.05 3.99 0.00 1.61 1.62 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.44 4.35 0.00 1.78 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.45 7.81 5 N 8.53 4.53 0.00 2.71 2.75 0.00 0.00 7.07 8.00 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 N 8.60 4.29 0.00 2.68 2.73 0.00 0.00 6.95 7.96 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 A 8.70 3.98 1.30 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 8 K 8.63 4.14 0.00 1.77 1.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.45 7.81 9 E 8.49 4.37 0.00 1.98 1.87 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 2.30 2.38 0.00 10 I 8.35 3.86 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 1.27 0.73 0.91 0.00 0.00