NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0127 8.2127 109.7407 45.7684 0.0000 175.6304 2 I 3.1786 7.5752 118.4737 62.0416 38.3749 173.1270 3 V 3.4730 7.7470 118.8990 66.0603 31.7900 177.0342 4 E 3.8927 8.0619 117.2470 59.1474 29.5354 178.2095 5 Q 4.1277 8.1065 118.9776 59.0209 29.3719 176.7549 6 C 4.9637 7.9598 115.1160 56.1432 40.8632 174.0009 7 C 4.3525 8.1661 117.8718 60.1573 28.5288 173.6493 8 T 4.4021 7.9443 113.9651 64.8316 70.1330 174.2905 9 S 4.7377 7.6322 116.8398 56.7525 64.6734 173.4756 10 I 4.1784 8.1206 124.9740 60.9838 37.5430 176.2987 11 C 4.6909 8.6316 123.6825 56.0862 36.3480 174.5149 12 S 4.5359 8.5859 119.7802 57.6240 65.1794 175.2875 13 L 4.0403 8.4730 121.1030 58.0756 41.0061 178.9349 14 Y 4.4064 7.7058 117.2759 59.9377 39.1702 176.6851 15 Q 3.9711 8.0723 119.7545 58.2717 29.3008 177.4936 16 L 4.3272 7.7133 120.5954 57.7651 41.6820 178.9606 17 E 4.2508 8.3024 118.3523 59.4352 29.0993 179.0277 18 N 4.2829 7.5437 114.4684 55.8951 38.5731 175.8138 19 Y 4.4798 8.1778 115.8706 57.1612 38.5885 175.6492 20 C 4.3925 7.2622 118.2354 59.5241 28.9804 173.5778 21 N 4.5382 8.5793 117.7265 53.8097 38.1204 175.3252 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 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 3.18 1.25 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.93 0.73 0.00 0.00 3 V 7.75 3.47 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 0.88 0.00 0.00 4 E 8.06 3.89 0.00 2.00 1.97 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 2.30 2.32 0.00 5 Q 8.11 4.13 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.63 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 6 C 7.96 4.96 0.00 3.03 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 8.17 4.35 0.00 3.14 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 8 T 7.94 4.40 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 7.63 4.74 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.18 1.88 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 0.47 0.92 0.00 0.00 11 C 8.63 4.69 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 4.54 0.00 4.14 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 8.47 4.04 0.00 1.77 1.82 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.71 4.41 0.00 2.97 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 15 Q 8.07 3.97 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 16 L 7.71 4.33 0.00 1.96 1.76 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.30 4.25 0.00 2.11 2.05 0.00 0.00 0.00 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 2.42 0.00 18 N 7.54 4.28 0.00 2.70 2.50 0.00 0.00 6.98 7.34 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 19 Y 8.18 4.48 0.00 2.81 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 20 C 7.26 4.39 0.00 3.17 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 8.58 4.54 0.00 2.73 2.74 0.00 0.00 6.80 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