NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9140 8.2133 109.7303 45.4876 0.0000 173.8031 3 K 3.9461 8.4631 117.5986 57.8161 32.4668 176.2653 4 G 3.7250 7.8470 106.1794 45.5570 0.0000 173.3109 5 D 4.6621 8.2394 118.6950 56.2521 41.3256 180.3653 6 R 3.6655 8.2879 115.7981 58.2295 33.0895 178.0007 7 R 4.0870 8.2315 107.3813 58.5668 28.4439 179.6168 8 T 3.6068 9.3844 110.8833 62.3436 70.5222 175.0514 9 R 3.1572 8.3396 113.6233 57.1013 30.7475 178.0021 10 R 3.9925 9.6845 124.2538 60.5044 29.6576 177.7649 11 G 4.5435 8.2174 106.4535 47.8288 0.0000 175.5139 12 K 4.0553 8.6641 121.1314 58.2588 31.9589 179.1998 13 I 3.5551 7.7399 118.8798 63.8872 37.8132 176.9904 14 W 4.3686 8.3508 127.4867 60.5072 30.9957 178.2750 15 R 3.2718 8.0843 117.1108 57.8601 29.5221 177.8066 16 G 3.6926 8.1390 105.0606 45.9696 0.0000 172.9194 17 T 4.9134 7.5437 107.4809 59.7830 72.7676 174.6626 18 Y 4.6713 8.3447 118.1820 56.9098 38.8301 180.0417 19 G 3.9194 8.9796 120.1395 47.3257 0.0000 174.5449 20 K 3.9284 8.7974 124.2522 59.2190 32.4606 176.9858 21 Y 4.6688 7.7775 117.6555 54.4149 36.3649 173.3739 22 R 3.8584 8.1263 114.4561 53.8738 31.0687 173.5691 23 P 4.5413 0.0000 0.0000 62.6568 31.9082 177.5473 24 R 3.9028 8.2538 115.3453 56.5697 29.4481 176.9295 25 K 4.1672 8.0177 125.8942 56.5655 34.2726 175.1552 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 2 G 8.21 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 3.95 0.00 1.36 1.28 0.00 1.95 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 1.27 7.81 4 G 7.85 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.24 4.66 0.00 2.76 2.79 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 6 R 8.29 3.67 0.00 2.24 2.48 0.00 2.94 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.68 0.00 7 R 8.23 4.09 0.00 2.39 1.93 0.00 3.11 0.00 0.00 3.36 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.64 0.00 8 T 9.38 3.61 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 -0.03 0.00 0.00 9 R 8.34 3.16 0.00 1.88 1.64 0.00 3.13 0.00 0.00 3.34 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 10 R 9.68 3.99 0.00 2.14 2.25 0.00 2.98 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.90 0.00 11 G 8.22 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.66 4.06 0.00 1.91 1.95 0.00 1.76 0.00 0.00 2.04 0.00 0.00 3.18 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.67 1.55 7.81 13 I 7.74 3.56 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.73 1.04 0.00 0.00 14 W 8.35 4.37 0.00 3.34 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.08 3.27 0.00 1.93 1.90 0.00 3.53 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.08 0.00 16 G 8.14 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.54 4.91 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 1.18 0.00 0.00 18 Y 8.34 4.67 0.00 2.78 2.21 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.98 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.80 3.93 0.00 1.53 1.39 0.00 1.54 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.31 7.81 21 Y 7.78 4.67 0.00 3.04 2.82 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 22 R 8.13 3.86 0.00 1.95 2.20 0.00 3.13 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.39 0.00 23 P 0.00 4.54 0.00 2.27 2.23 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 24 R 8.25 3.90 0.00 1.68 1.68 0.00 2.55 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.34 0.00 25 K 8.02 4.17 0.00 1.81 1.99 0.00 1.88 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.37 7.81