NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9668 8.2127 109.7382 45.4429 0.0000 174.0220 2 I 2.9048 8.1014 117.7487 63.0839 37.6267 173.8136 3 V 3.4866 7.7379 119.0615 65.8827 31.8669 177.0255 4 E 3.8972 8.0478 118.5836 59.3796 29.3192 178.5700 5 Q 4.0851 7.8327 116.7064 58.0704 29.0396 176.7316 6 C 4.8102 8.4968 115.3958 56.8277 42.0666 174.8026 7 C 4.3957 7.7404 118.2530 61.6048 32.1960 175.2152 8 T 4.0090 7.8822 115.9397 65.5730 68.3711 174.7488 9 S 4.7289 7.4213 114.1891 56.7049 65.3601 173.2739 10 I 4.3005 7.9969 122.2144 60.2633 38.0409 174.5735 11 C 5.1373 8.3922 118.7063 53.2083 39.6323 174.1735 12 S 4.4997 8.6230 116.8110 57.3820 65.1138 175.0818 13 L 3.9685 8.3593 123.0619 58.5044 41.5473 178.3990 14 Y 4.4503 7.8140 117.5137 59.3808 38.4324 177.6176 15 Q 3.6733 7.1065 119.7083 58.5630 28.8167 178.3304 16 L 4.2403 7.7689 121.1593 58.3849 42.2043 178.8847 17 E 4.0639 8.4387 118.4273 59.2242 29.1150 178.6482 18 N 4.4659 7.6451 115.6039 55.9890 39.0872 175.7250 19 Y 4.2576 7.4923 116.1149 58.2789 38.4684 175.3866 20 C 4.4655 7.4849 119.3790 59.2962 29.0558 173.4103 21 N 4.6065 8.5536 120.2387 53.0604 37.0928 174.0807 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 8.21 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.10 2.90 0.77 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.52 0.66 0.00 0.00 3 V 7.74 3.49 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 1.01 0.00 0.00 0.86 0.00 0.00 4 E 8.05 3.90 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 5 Q 7.83 4.09 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.67 2.71 0.00 6 C 8.50 4.81 0.00 2.88 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 7.74 4.40 0.00 2.90 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 7.88 4.01 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 9 S 7.42 4.73 0.00 4.08 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 8.00 4.30 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 1.46 0.51 0.91 0.00 0.00 11 C 8.39 5.14 0.00 3.16 3.25 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 0.00 12 S 8.62 4.50 0.00 4.11 4.03 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 13 L 8.36 3.97 0.00 1.77 1.77 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.81 4.45 0.00 3.11 3.09 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 0.00 0.00 0.00 0.00 15 Q 7.11 3.67 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.05 1.58 0.00 16 L 7.77 4.24 0.00 2.01 1.71 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.44 4.06 0.00 2.27 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 0.00 2.36 2.57 0.00 18 N 7.65 4.47 0.00 2.78 2.48 0.00 0.00 7.24 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.49 4.26 0.00 3.24 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 7.48 4.47 0.00 3.01 2.89 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 21 N 8.55 4.61 0.00 2.79 2.75 0.00 0.00 6.00 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