NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 F 4.1887 8.3244 122.8186 58.8457 39.4125 175.0640 6 E 3.4773 8.1998 127.0962 55.3008 29.9182 171.5342 7 I 4.4790 7.7567 119.8748 58.6288 40.0808 173.6713 8 P 4.5539 0.0000 0.0000 62.6904 32.7048 175.7221 9 D 4.8404 8.1769 114.4936 53.1082 40.3858 172.7038 10 D 4.7805 7.3779 116.9190 54.1245 44.6271 176.5607 11 V 4.5253 7.4875 120.8259 59.5996 35.2679 174.2305 12 P 4.2494 0.0000 0.0000 65.2768 31.6224 176.4254 13 L 4.4094 7.3175 117.5019 50.9968 44.9960 176.0462 14 P 4.4757 0.0000 0.0000 62.2814 32.6111 175.6685 15 A 4.2475 8.5824 120.6171 53.3188 19.2592 178.2748 16 G 4.2077 8.8634 105.0743 45.8791 0.0000 172.9176 17 W 4.9713 7.7251 118.1105 54.7155 32.0915 175.8485 18 E 4.6781 9.2573 122.6560 54.2762 32.0762 174.1989 19 M 3.8151 8.7692 122.0699 55.5534 31.9071 175.3792 20 A 4.5580 7.3953 127.0436 49.9358 22.9193 173.9597 21 K 5.1872 8.8251 112.9979 55.7243 35.3431 175.5782 22 T 4.4149 8.5456 116.2191 62.1712 70.2415 174.4177 23 S 3.8413 9.2104 113.3130 59.4864 63.0898 173.3685 24 S 4.8203 6.7381 110.5131 59.9648 70.0800 176.4384 25 G 4.3079 7.7627 108.4782 44.3362 0.0000 172.3241 26 Q 4.7819 7.9774 117.6100 53.7051 32.9974 175.6965 27 R 4.7886 8.9240 122.9138 56.0836 31.1377 175.5753 28 Y 4.8598 8.7765 123.0732 55.3055 41.8686 174.4778 29 F 4.5452 9.4749 117.4020 55.1659 41.9064 174.5070 30 L 4.3796 8.3682 127.0852 55.1613 42.7915 175.7117 31 N 3.1748 9.1828 127.9837 52.8889 38.2627 174.9488 32 H 4.0593 9.0645 128.4376 58.0052 30.5732 177.3354 33 I 3.6618 7.5202 112.3149 63.4413 37.1034 176.0918 34 D 4.6479 9.1337 117.7762 52.5619 41.7494 174.4960 35 Q 3.1856 7.3444 116.9172 55.8256 25.8106 172.4224 36 T 4.3606 8.0246 111.6214 61.1695 73.0579 172.3412 37 T 5.0269 8.3023 111.1028 60.4485 71.2094 173.1333 38 T 4.5528 8.9220 121.1829 59.7655 70.0294 175.0641 39 W 4.5674 8.9858 127.7736 59.3737 29.4427 176.4776 40 Q 4.4312 8.1355 115.8590 54.2338 30.3286 174.0847 41 D 4.2404 7.5881 118.3659 50.8782 41.1123 175.1536 42 P 4.2435 0.0000 0.0000 64.5671 31.7615 176.6101 43 R 4.4369 7.0594 117.3653 53.9877 32.6903 175.2592 44 K 4.0369 8.5424 122.8130 56.4108 32.3924 175.3730 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 5 F 8.32 4.19 0.00 3.11 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 6 E 8.20 3.48 0.00 2.40 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 0.00 2.24 2.44 0.00 7 I 7.76 4.48 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.01 0.90 0.00 0.00 8 P 0.00 4.55 0.00 2.15 2.06 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.91 0.00 9 D 8.18 4.84 0.00 2.59 2.56 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 0.00 0.00 0.00 0.00 10 D 7.38 4.78 0.00 2.61 2.42 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 0.00 0.00 0.00 0.00 11 V 7.49 4.53 2.07 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 0.68 0.00 0.00 0.97 0.00 0.00 12 P 0.00 4.25 0.00 2.09 2.15 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 13 L 7.32 4.41 0.00 1.58 1.11 0.95 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.48 0.00 2.29 2.10 0.00 2.76 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.92 0.00 15 A 8.58 4.25 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.86 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 W 7.73 4.97 0.00 3.48 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 9.26 4.68 0.00 1.93 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 19 M 8.77 3.82 0.00 2.15 1.60 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 20 A 7.40 4.56 0.77 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 21 K 8.83 5.19 0.00 1.91 1.79 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.47 7.81 22 T 8.55 4.41 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 23 S 9.21 3.84 0.00 4.38 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 24 S 6.74 4.82 0.00 3.89 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.76 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.98 4.78 0.00 2.05 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.19 2.41 0.00 27 R 8.92 4.79 0.00 1.74 1.74 0.00 3.22 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 28 Y 8.78 4.86 0.00 2.58 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 9.47 4.55 0.00 3.54 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.37 4.38 0.00 1.83 1.61 1.03 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 31 N 9.18 3.17 0.00 1.49 2.35 0.00 0.00 6.48 6.33 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 32 H 9.06 4.06 0.00 3.10 3.11 0.00 5.66 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.52 3.66 1.87 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.62 0.95 0.00 0.00 34 D 9.13 4.65 0.00 2.39 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 7.34 3.19 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.36 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 36 T 8.02 4.36 4.17 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 0.00 0.00 1.16 0.00 0.00 37 T 8.30 5.03 3.91 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 0.00 0.00 1.00 0.00 0.00 38 T 8.92 4.55 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 39 W 8.99 4.57 0.00 3.44 3.42 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 0.00 0.00 0.00 0.00 40 Q 8.14 4.43 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 41 D 7.59 4.24 0.00 2.28 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.24 0.00 2.08 2.18 0.00 2.64 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.29 0.00 43 R 7.06 4.44 0.00 1.69 1.70 0.00 3.04 0.00 0.00 3.08 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 44 K 8.54 4.04 0.00 1.55 1.57 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.39 7.81