NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.3435 8.3393 109.6910 44.8539 0.0000 173.4038 2 I 3.8992 6.1737 110.5150 61.2436 41.4883 173.4532 3 V 2.8348 8.1693 106.8697 62.4007 32.5617 179.5217 4 E 4.7628 8.9846 122.2456 56.7021 29.7547 177.9330 5 Q 4.3796 8.5714 117.3442 56.9454 32.5828 175.7189 6 C 4.9057 8.7548 112.0577 56.6322 42.0932 173.5635 7 C 4.3843 7.8167 117.2108 60.5285 33.2990 174.4526 8 T 4.3163 8.6369 116.4860 61.1374 67.2642 173.4908 9 S 5.2972 6.4998 113.6579 56.8556 65.1952 173.4478 10 I 4.5715 7.6428 122.2214 59.9617 39.9797 174.6799 11 C 4.6067 8.5509 115.9228 55.0642 44.1696 172.9606 12 S 3.9624 7.5138 116.6720 62.1019 62.4682 172.7638 13 L 4.5524 9.1406 129.0791 55.7474 38.6437 176.0471 14 Y 4.2625 8.1165 113.9098 61.4895 38.0547 178.7323 15 Q 4.1536 8.3885 118.1418 60.3150 28.8406 179.6556 16 L 3.9183 7.2219 121.3404 56.8539 42.1436 178.3289 17 E 3.6728 8.0447 117.2595 59.9003 29.2036 179.1912 18 N 3.8011 7.7147 118.9296 56.0651 39.0857 174.9840 19 Y 4.5938 6.4781 114.8646 59.4903 40.6703 176.3197 20 C 4.2117 8.9690 113.9062 62.1863 29.6675 173.5051 21 N 4.3035 7.7889 121.2642 52.2256 37.2670 174.2774 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 8.34 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.17 3.90 1.73 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.94 0.49 0.00 0.00 3 V 8.17 2.83 2.02 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 0.74 0.00 0.00 0.84 0.00 0.00 4 E 8.98 4.76 0.00 1.90 1.94 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 2.29 2.32 0.00 5 Q 8.57 4.38 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.61 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 6 C 8.75 4.91 0.00 2.82 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 7 C 7.82 4.38 0.00 2.86 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 8 T 8.64 4.32 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 9 S 6.50 5.30 0.00 3.91 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 4.57 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 0.96 0.00 0.00 11 C 8.55 4.61 0.00 2.88 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 7.51 3.96 0.00 3.77 3.85 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 13 L 9.14 4.55 0.00 1.96 2.20 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.12 4.26 0.00 2.95 2.93 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 15 Q 8.39 4.15 0.00 2.63 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.31 0.00 0.00 0.00 0.00 0.00 2.12 2.29 0.00 16 L 7.22 3.92 0.00 1.96 1.74 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.04 3.67 0.00 2.07 1.88 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 2.33 2.50 0.00 18 N 7.71 3.80 0.00 2.34 1.93 0.00 0.00 6.91 7.11 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 19 Y 6.48 4.59 0.00 3.04 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 8.97 4.21 0.00 3.05 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 21 N 7.79 4.30 0.00 2.78 2.70 0.00 0.00 7.00 7.94 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