NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9617 8.3544 109.7454 45.7865 0.0000 174.1449 2 I 4.0940 5.8396 123.8187 60.0582 38.7281 170.9615 3 V 3.6572 7.8401 121.1175 65.7542 32.5198 176.6220 4 E 4.2571 8.1764 117.6472 57.4060 29.4875 176.5217 5 Q 4.5790 7.9898 115.4501 56.8119 31.6334 177.6212 6 C 4.9257 8.1573 113.0799 58.0054 41.6464 174.8133 7 C 4.1681 7.8434 118.6796 62.5456 31.4265 174.9677 8 T 4.0444 8.0168 108.4446 64.1757 69.1548 174.5234 9 S 4.7130 7.3448 117.6341 55.7108 65.7536 173.8970 10 I 3.9831 8.0312 123.2801 60.4606 35.8072 175.0997 11 C 4.6104 8.3807 121.2885 54.6225 42.2916 172.6498 12 S 4.6620 8.1708 114.2148 56.5921 64.4926 174.2904 13 L 4.1473 8.2319 120.4838 57.2131 42.3233 177.7662 14 Y 4.4082 8.0047 118.7362 60.6870 38.5220 177.0597 15 Q 3.9926 7.7264 117.5049 58.1537 29.1556 177.4307 16 L 4.4910 7.5083 117.2061 55.4242 42.0320 178.5386 17 E 3.9705 7.6847 119.6908 59.4078 29.2043 178.6308 18 N 4.4563 7.8918 114.3604 55.3670 38.5676 174.9090 19 Y 4.3041 7.5817 117.6904 57.9302 37.9754 174.7947 20 C 4.9317 7.5744 116.8057 57.7386 31.2639 173.7820 21 N 4.4728 8.6418 119.4682 53.9767 38.5797 174.8140 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 G 8.35 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 5.84 4.09 2.33 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.59 0.48 0.00 0.00 3 V 7.84 3.66 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.92 0.00 0.00 4 E 8.18 4.26 0.00 1.96 1.96 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 0.00 2.30 2.40 0.00 5 Q 7.99 4.58 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.52 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 6 C 8.16 4.93 0.00 3.06 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 4.17 0.00 2.93 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.02 4.04 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 9 S 7.34 4.71 0.00 3.72 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 10 I 8.03 3.98 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 1.47 0.48 0.91 0.00 0.00 11 C 8.38 4.61 0.00 3.11 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 12 S 8.17 4.66 0.00 4.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 4.15 0.00 1.71 1.74 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.00 4.41 0.00 3.15 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.73 3.99 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 16 L 7.51 4.49 0.00 1.72 1.66 0.80 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.68 3.97 0.00 1.74 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 2.31 2.42 0.00 18 N 7.89 4.46 0.00 2.54 2.65 0.00 0.00 6.66 7.36 0.00 0.00 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 Y 7.58 4.30 0.00 3.20 2.98 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 0.00 0.00 0.00 20 C 7.57 4.93 0.00 3.10 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.64 4.47 0.00 2.68 2.69 0.00 0.00 6.88 7.56 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