NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9642 8.2127 109.7407 45.3651 0.0000 173.2225 2 I 3.1611 8.2975 117.6129 63.4021 37.3795 173.4688 3 V 3.5096 8.4140 119.9624 66.0201 31.8063 177.3273 4 E 3.9399 8.0378 117.6872 59.4663 29.2157 179.0451 5 Q 4.0208 8.1017 116.8820 58.9588 28.9660 177.6317 6 C 4.7909 8.5864 114.5533 56.9419 41.8207 174.2308 7 C 4.4344 7.7589 118.4090 61.4751 32.3780 174.8448 8 T 3.9195 8.0210 115.2456 66.6232 68.2908 175.5408 9 S 4.5492 8.1281 115.2369 57.1512 64.4355 172.7776 10 I 4.6455 8.0515 112.3609 59.3777 39.7718 173.2850 11 C 5.1570 8.2286 115.0177 52.9842 43.9119 174.2083 12 S 4.6671 9.2317 116.5984 57.5809 65.1872 175.3439 13 L 3.9829 8.2704 122.0697 58.0190 41.0337 179.4090 14 Y 4.1416 7.5630 115.6581 61.1825 38.1705 178.0330 15 Q 4.2042 8.2293 118.9687 59.0869 28.8585 178.9068 16 L 4.2792 8.1352 119.8701 57.8935 41.6724 179.3085 17 E 4.0950 8.1034 118.2716 58.8752 29.0702 178.7827 18 N 4.2105 7.9330 116.1566 55.5084 38.4468 175.1736 19 Y 4.5652 7.3699 115.4398 57.6842 38.3694 175.6110 20 C 4.4359 7.5963 118.2209 59.3497 28.9585 173.5845 21 N 4.5420 8.6120 118.7918 53.7423 38.1618 175.1986 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 3.96 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 8.30 3.16 0.66 0.00 0.00 0.39 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 0.29 0.65 0.00 0.00 3 V 8.41 3.51 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 1.08 0.00 0.00 0.87 0.00 0.00 4 E 8.04 3.94 0.00 2.23 1.99 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 2.40 2.46 0.00 5 Q 8.10 4.02 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.72 0.00 6 C 8.59 4.79 0.00 2.93 3.10 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 7 C 7.76 4.43 0.00 2.88 3.10 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 8 T 8.02 3.92 4.40 0.00 0.00 0.00 0.00 0.00 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 8.13 4.55 0.00 3.80 4.06 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 0.00 0.00 0.00 10 I 8.05 4.65 1.88 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 1.48 0.85 0.92 0.00 0.00 11 C 8.23 5.16 0.00 3.21 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 9.23 4.67 0.00 4.21 4.14 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 13 L 8.27 3.98 0.00 1.37 1.56 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.56 4.14 0.00 2.99 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 8.23 4.20 0.00 2.39 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 16 L 8.14 4.28 0.00 1.96 1.80 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.10 4.10 0.00 2.20 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 2.33 2.50 0.00 18 N 7.93 4.21 0.00 2.02 2.22 0.00 0.00 6.89 7.06 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 19 Y 7.37 4.57 0.00 3.03 3.01 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 20 C 7.60 4.44 0.00 3.07 2.87 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 0.00 0.00 0.00 21 N 8.61 4.54 0.00 2.72 2.74 0.00 0.00 6.81 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