NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.3887 8.1914 115.6531 59.3106 30.8501 174.2209 2 G 3.7662 8.9286 109.4104 45.4197 0.0000 172.6624 3 L 4.5520 7.8236 122.2013 51.9550 42.2831 173.3455 4 R 4.0211 8.7205 121.1293 55.8122 29.3711 176.3637 5 P 4.2821 0.0000 0.0000 65.3528 31.4860 177.6653 6 L 3.8456 7.8682 114.7749 54.7703 41.5652 176.2388 7 F 4.5762 7.1512 115.1698 58.1571 42.3158 176.5782 8 E 4.0357 8.4172 119.5594 60.0755 30.1918 179.6606 9 K 3.8769 8.1898 117.3137 59.7623 32.1803 179.0544 10 K 3.9747 7.2850 115.2308 57.4634 32.5957 176.2668 11 Q 3.6681 8.5356 117.2105 55.9133 25.3217 173.4816 12 V 4.5760 8.5439 116.2598 60.0797 35.1691 175.5368 13 Q 4.7476 8.6093 121.2604 54.8395 30.4015 175.3452 14 D 4.8961 8.8676 121.2244 52.3472 40.7327 177.1896 14A Q 3.8394 8.4514 118.5827 59.8525 29.1692 179.0906 14B T 4.2433 7.9078 105.1427 62.2283 69.8466 176.2809 14C E 3.8938 8.3123 123.2442 59.6843 29.3943 178.6680 14D K 3.9625 8.2576 118.9852 59.9622 32.0739 177.9486 14E E 3.9189 8.0174 117.9517 59.5467 29.1608 179.1987 14F L 3.4542 7.3221 117.3565 57.9187 41.9555 179.4042 14G F 4.7221 7.6024 116.7993 60.6093 38.7655 177.1145 14H E 4.0204 8.5126 118.7611 59.4607 29.4869 178.8658 14I S 4.2350 8.1531 113.2657 60.9837 63.2387 174.2882 14J Y 4.5908 7.4216 124.5224 58.3523 37.7616 175.5909 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 C 8.19 4.39 0.00 3.13 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 2 G 8.93 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 0.00 0.00 0.00 3 L 7.82 4.55 0.00 1.63 1.66 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.72 4.02 0.00 2.22 2.11 0.00 3.12 0.00 0.00 3.57 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 5 P 0.00 4.28 0.00 2.20 2.12 0.00 3.64 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 6 L 7.87 3.85 0.00 1.32 1.29 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.15 4.58 0.00 3.07 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.42 4.04 0.00 2.41 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 2.48 2.50 0.00 9 K 8.19 3.88 0.00 1.92 1.91 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.68 1.61 7.81 10 K 7.29 3.97 0.00 1.78 1.82 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.55 7.81 11 Q 8.54 3.67 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.62 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 12 V 8.54 4.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.99 0.00 0.00 13 Q 8.61 4.75 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 14 D 8.87 4.90 0.00 2.61 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 0.00 0.00 0.00 14A Q 8.45 3.84 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.06 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 14B T 7.91 4.24 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 14C E 8.31 3.89 0.00 2.33 2.25 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 2.41 2.49 0.00 14D K 8.26 3.96 0.00 1.91 1.88 0.00 1.70 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.67 7.81 14E E 8.02 3.92 0.00 2.14 1.91 0.00 0.00 0.00 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 2.41 0.00 14F L 7.32 3.45 0.00 1.41 0.97 0.63 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 14G F 7.60 4.72 0.00 3.17 3.24 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 0.00 14H E 8.51 4.02 0.00 2.15 2.17 0.00 0.00 0.00 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 2.35 0.00 14I S 8.15 4.24 0.00 3.89 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 14J Y 7.42 4.59 0.00 3.32 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