NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9650 8.2127 109.7397 45.5485 0.0000 173.5193 2 I 3.2549 8.3005 117.7587 63.7695 37.8031 174.0032 3 V 3.5449 8.4283 114.1102 64.4930 31.3547 177.8248 4 E 3.9894 8.1013 117.8523 59.1730 28.2248 178.9346 5 Q 3.8880 7.8275 119.7421 58.3660 29.1359 176.2950 6 C 4.6567 8.1526 115.5675 56.1142 41.2458 173.9422 7 C 4.4512 7.9074 117.4010 59.6705 28.8625 174.4718 8 T 4.3057 7.3586 109.2956 62.5766 69.1814 174.7624 9 S 4.6089 7.4045 115.3486 56.2611 65.7379 172.6063 10 I 4.2272 8.1621 125.5816 60.9430 37.2864 176.7234 11 C 4.6956 8.6449 123.9824 56.4562 41.5215 174.5226 12 S 4.5270 8.7441 119.9443 57.6156 65.1443 175.3693 13 L 4.0632 8.4324 121.0437 58.0022 40.9751 179.1673 14 Y 4.2715 7.9797 118.4300 60.9392 38.6244 177.6534 15 Q 3.9558 7.8322 117.9200 58.6845 28.6970 178.6227 16 L 4.1874 8.1180 120.1976 57.9195 41.7260 179.3057 17 E 3.9630 8.3489 118.2962 59.1514 29.0716 178.6852 18 N 4.0542 7.4434 115.5644 56.4673 38.8887 175.3920 19 Y 4.3545 7.8148 115.4685 57.5684 38.6519 175.6747 20 C 4.4450 7.2875 118.0706 59.2747 29.0584 173.4766 21 N 4.5304 8.5652 118.0384 53.7772 38.1629 175.3198 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 8.30 3.25 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 0.73 0.00 0.00 3 V 8.43 3.54 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 0.68 0.00 0.00 0.90 0.00 0.00 4 E 8.10 3.99 0.00 2.21 2.00 0.00 0.00 0.00 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 2.42 0.00 5 Q 7.83 3.89 0.00 2.32 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 6 C 8.15 4.66 0.00 2.85 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 7.91 4.45 0.00 3.20 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 7.36 4.31 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 1.25 0.00 0.00 9 S 7.40 4.61 0.00 4.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.23 1.88 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 1.42 0.92 0.92 0.00 0.00 11 C 8.64 4.70 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 8.74 4.53 0.00 4.14 4.07 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 13 L 8.43 4.06 0.00 1.77 1.82 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.98 4.27 0.00 2.87 3.03 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 15 Q 7.83 3.96 0.00 2.41 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 16 L 8.12 4.19 0.00 1.92 1.77 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.35 3.96 0.00 2.21 2.01 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 2.36 2.36 0.00 18 N 7.44 4.05 0.00 2.38 2.66 0.00 0.00 7.17 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.81 4.35 0.00 3.09 2.96 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 20 C 7.29 4.45 0.00 2.98 2.88 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 0.00 0.00 0.00 21 N 8.57 4.53 0.00 2.72 2.73 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