NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9773 8.3544 109.7436 45.9718 0.0000 172.3425 2 I 4.0750 7.6918 114.5446 60.3034 43.7094 171.4027 3 V 3.6008 7.8881 119.3047 65.4394 32.1776 176.9513 4 E 3.8980 8.0350 118.0466 59.3639 29.6650 178.4843 5 Q 4.1371 8.0477 115.4820 58.6453 29.2389 177.8646 6 C 4.6380 7.5145 117.8381 58.5001 41.0576 174.6358 7 C 4.2465 8.4822 117.7537 60.8284 31.1840 174.6152 8 T 4.2718 7.6780 113.2896 64.3737 67.3550 175.7461 9 S 4.6003 7.1917 115.2419 58.0637 64.8011 172.0307 10 I 3.5156 7.6804 124.2857 61.2882 37.2150 172.8902 11 C 4.7937 8.3353 120.2811 55.2029 36.7079 173.3867 12 S 4.4974 8.2951 114.9452 57.5699 63.2174 174.5043 13 L 3.8578 8.3940 126.1411 58.6882 41.5249 179.0903 14 Y 4.3185 7.3954 114.4697 60.8837 37.9476 178.0262 15 Q 4.1771 7.9675 119.0383 58.8651 28.7729 178.4809 16 L 4.2829 7.9267 119.6080 57.7819 41.7654 179.0743 17 E 3.9803 8.1384 118.0177 59.2797 29.1220 178.8123 18 N 4.3748 7.6468 115.3188 54.9826 38.6284 175.1665 19 Y 4.6527 7.5135 116.4148 57.6819 39.0041 175.6327 20 C 4.3978 7.5785 120.2961 59.0568 32.3902 172.7502 21 N 4.5898 8.5157 122.0268 53.7680 38.8368 174.0044 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 3.98 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 0.00 0.00 0.00 2 I 7.69 4.08 0.89 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.49 0.68 0.00 0.00 3 V 7.89 3.60 2.03 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 1.03 0.00 0.00 0.85 0.00 0.00 4 E 8.03 3.90 0.00 1.98 1.95 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 2.28 2.31 0.00 5 Q 8.05 4.14 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.02 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 6 C 7.51 4.64 0.00 2.88 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 4.25 0.00 2.93 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 4.27 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 1.30 0.00 0.00 9 S 7.19 4.60 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.52 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 1.29 0.21 0.91 0.00 0.00 11 C 8.34 4.79 0.00 2.98 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 12 S 8.30 4.50 0.00 3.90 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.39 3.86 0.00 1.55 1.07 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.40 4.32 0.00 3.03 2.94 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 15 Q 7.97 4.18 0.00 2.35 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 16 L 7.93 4.28 0.00 1.85 1.79 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.14 3.98 0.00 2.24 2.04 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 2.47 2.56 0.00 18 N 7.65 4.37 0.00 2.02 2.43 0.00 0.00 6.87 7.29 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 19 Y 7.51 4.65 0.00 3.10 2.94 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 20 C 7.58 4.40 0.00 2.97 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 21 N 8.52 4.59 0.00 2.70 2.63 0.00 0.00 6.90 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00