NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.9919 7.8774 117.5578 56.7876 42.1888 174.7043 2 G 3.4867 8.3800 106.0611 44.1969 0.0000 169.8246 3 E 4.3718 7.5884 121.2211 55.2121 31.8617 172.9107 4 T 4.7066 8.1189 111.9682 59.9092 71.4938 173.5873 5 C 5.3002 8.0143 119.8904 53.8397 41.7436 175.7936 6 V 2.7063 7.5414 119.9837 66.3069 31.6889 176.7983 7 G 3.7817 8.1264 107.9553 47.9017 0.0000 173.5380 8 G 3.9418 7.2403 107.0399 45.4298 0.0000 173.1707 9 T 4.7367 7.8011 115.9458 62.3895 72.7196 173.0254 10 C 5.2193 8.4554 119.5673 55.3974 43.0787 173.9810 11 N 4.4685 8.6436 121.6200 56.0119 39.3313 176.2475 12 T 4.0179 7.7834 114.6687 62.6777 69.0940 171.7140 13 P 4.4663 0.0000 0.0000 63.7362 32.0233 176.6181 14 G 3.8738 8.8854 109.3651 46.0068 0.0000 172.6072 15 C 5.2362 7.8437 117.1389 55.7526 41.6946 173.6384 16 T 4.5128 8.8852 114.6092 60.5429 71.0537 173.7486 17 C 4.6424 8.7926 123.7833 55.9694 42.8123 173.5747 18 S 4.5306 7.9863 125.3762 55.8426 60.6647 173.3813 19 W 4.3002 7.9257 131.4706 56.4305 32.0242 173.9729 20 P 2.9700 0.0000 0.0000 63.7545 31.2012 176.1921 21 V 4.4805 7.2329 119.3352 60.7248 34.4388 175.3042 22 C 5.2978 8.5660 118.6344 56.0860 38.5796 173.1963 23 T 4.8092 8.7736 109.4951 60.4922 72.7180 172.8089 24 R 4.6096 8.8447 121.9447 55.0463 32.9998 174.6864 25 N 4.2619 9.2496 122.8113 54.2823 36.7794 174.8362 26 G 3.9282 9.1524 103.5528 45.7616 0.0000 173.8531 27 L 4.6430 8.0951 119.3710 52.0613 45.4576 174.5340 28 P 4.8389 0.0000 0.0000 62.3769 30.1762 176.7086 29 V 3.9603 7.7621 119.0245 62.1474 32.6555 175.3065 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 C 7.88 4.99 0.00 2.97 3.20 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 8.38 3.49 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 7.59 4.37 0.00 1.99 1.79 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 2.31 2.26 0.00 4 T 8.12 4.71 4.16 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 1.11 0.00 0.00 5 C 8.01 5.30 0.00 3.35 3.29 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 V 7.54 2.71 1.97 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 0.92 0.00 0.00 0.50 0.00 0.00 7 G 8.13 3.78 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 8 G 7.24 3.94 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 T 7.80 4.74 4.28 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 1.23 0.00 0.00 10 C 8.46 5.22 0.00 3.11 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 11 N 8.64 4.47 0.00 2.73 3.04 0.00 0.00 7.20 8.71 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 T 7.78 4.02 4.24 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 1.21 0.00 0.00 13 P 0.00 4.47 0.00 2.18 2.06 0.00 3.84 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 14 G 8.89 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 15 C 7.84 5.24 0.00 3.07 3.03 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 16 T 8.89 4.51 4.26 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 17 C 8.79 4.64 0.00 3.07 3.15 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 18 S 7.99 4.53 0.00 3.84 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 19 W 7.93 4.30 0.00 3.25 3.13 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 20 P 0.00 2.97 0.00 1.48 0.61 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 21 V 7.23 4.48 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 0.81 0.00 0.00 0.91 0.00 0.00 22 C 8.57 5.30 0.00 2.95 3.04 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 0.00 0.00 0.00 0.00 23 T 8.77 4.81 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 24 R 8.84 4.61 0.00 1.80 1.90 0.00 3.24 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 25 N 9.25 4.26 0.00 2.93 2.87 0.00 0.00 7.19 7.54 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 26 G 9.15 3.93 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 27 L 8.10 4.64 0.00 1.73 1.51 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.84 0.00 2.17 2.09 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 29 V 7.76 3.96 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 0.83 0.00 0.00 0.98 0.00 0.00