NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2350 8.4444 118.7899 56.4252 30.9878 174.7936 2 C 4.7617 7.8358 117.6802 54.5590 46.8129 172.5841 3 C 4.8046 8.7740 121.0370 55.8269 40.6615 171.0718 4 N 5.2595 7.6705 119.0502 50.8238 43.3831 174.4601 5 P 4.2132 0.0000 0.0000 65.5068 31.6097 179.1572 6 A 4.0816 7.9379 120.2467 55.1549 18.6751 178.8059 7 C 4.5150 8.1725 111.9156 57.5429 40.3008 175.6558 8 G 3.8157 7.6223 109.8087 48.7434 0.0000 175.5432 9 R 4.2492 8.1639 117.9560 58.5163 30.5648 177.3280 10 H 5.0392 8.0681 112.0830 55.0733 28.8303 173.1913 11 Y 4.1376 8.1251 119.5911 59.1198 39.8062 174.7236 12 S 4.6928 6.5808 113.4183 57.0087 64.9514 174.0479 13 C 4.2587 6.9338 118.7355 55.5420 41.8555 174.7644 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 E 8.44 4.24 0.00 2.10 1.98 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 2.11 2.21 0.00 2 C 7.84 4.76 0.00 2.94 2.86 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 3 C 8.77 4.80 0.00 2.77 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 4 N 7.67 5.26 0.00 2.83 2.68 0.00 0.00 7.00 8.04 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 P 0.00 4.21 0.00 2.18 2.08 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 6 A 7.94 4.08 1.31 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 7 C 8.17 4.52 0.00 3.33 3.12 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 G 7.62 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.16 4.25 0.00 1.94 2.04 0.00 3.34 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 10 H 8.07 5.04 0.00 3.24 3.30 0.00 5.56 0.00 0.00 0.00 0.00 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.13 4.14 0.00 2.97 2.84 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 12 S 6.58 4.69 0.00 3.71 3.56 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 13 C 6.93 4.26 0.00 2.93 2.85 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 0.00 0.00 0.00