NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 Q 4.0598 8.3331 121.7042 55.1732 30.9565 175.4663 10 G 4.3990 8.2716 106.3071 44.3394 0.0000 170.7196 11 D 4.8400 8.6827 125.4222 52.4577 44.9160 172.8355 12 I 4.8097 8.1148 123.6967 59.4848 39.4040 174.9772 13 V 4.8445 9.3938 122.8730 59.6221 36.1777 174.6122 14 V 4.6119 9.0572 123.2133 59.4032 34.2202 174.6752 15 A 4.1068 9.8458 126.7910 52.9483 18.5679 177.9353 16 L 4.2330 8.8309 123.2348 56.8829 42.7692 177.3300 17 Y 4.8525 8.1236 114.7145 55.0014 41.7593 173.7729 18 P 4.7541 0.0000 0.0000 63.4453 32.5171 174.9363 19 Y 4.1893 9.5391 123.4440 55.7295 42.1791 173.2057 20 D 4.6886 7.9553 126.6648 53.2365 42.8818 174.5120 21 G 4.1818 8.2582 117.5112 45.8669 0.0000 172.2296 22 I 4.0765 8.3757 126.3257 61.8248 38.0186 175.5029 23 H 5.0492 7.9388 116.3842 52.7891 31.5688 172.2829 24 P 4.4082 0.0000 0.0000 65.3704 31.4354 176.7773 25 D 4.9204 7.8900 116.0826 53.8837 43.3546 175.8852 26 D 5.2881 8.2770 118.6721 54.0282 41.2718 175.9158 27 L 4.4763 8.6996 126.8591 54.7242 43.0214 176.2456 28 S 4.8868 8.8050 121.3015 57.9863 63.8465 173.3457 29 F 5.1362 8.0089 116.8392 55.1271 41.7648 173.0819 30 K 4.6647 8.7184 121.7154 54.0833 34.5482 175.2213 31 K 4.1794 8.8999 125.8875 58.5940 32.5421 177.1042 32 G 4.0105 8.9296 109.6188 45.7710 0.0000 173.7237 33 E 4.3853 8.4423 121.2357 55.8170 31.4689 175.3912 34 K 4.6296 8.5388 123.2225 55.2264 35.0623 175.1820 35 M 5.6496 9.8023 122.3047 52.5570 37.0429 173.9391 36 K 4.9357 8.5417 121.3882 54.6767 35.8052 174.6632 37 V 4.7082 8.6648 127.5748 61.8482 32.3072 176.2582 38 L 4.3781 8.8386 128.3098 56.3678 42.7020 176.9176 39 E 4.6451 8.0522 118.5234 54.6898 32.6265 172.7800 40 E 5.0698 8.6220 125.7918 54.9577 31.4630 175.3526 41 H 5.1063 9.8280 124.1217 55.5164 31.4118 175.2490 42 G 4.1089 9.0814 112.7658 44.9571 0.0000 175.4020 43 E 4.4348 9.5735 128.8533 56.6913 31.1373 174.4776 44 W 4.0108 8.0965 118.2850 55.0643 33.4006 174.1693 45 W 5.6321 7.4013 121.6057 55.1000 34.2070 173.6190 46 K 5.6536 9.2390 121.5424 54.6589 33.8351 174.9178 47 A 5.9400 8.4613 129.4619 49.5447 23.0621 174.0572 48 K 5.1225 8.3585 115.7810 55.2374 36.5009 175.4153 49 S 4.9091 9.3490 121.2865 57.1105 63.1845 174.8315 50 L 4.2525 8.2740 128.0021 57.0028 42.2970 177.7970 51 L 4.1184 7.8900 119.8700 58.2812 41.8355 177.2519 52 T 4.3929 7.8626 109.9978 60.7725 67.6286 174.0962 53 K 3.9480 8.4851 117.3951 57.3665 30.5766 174.7805 54 K 4.3782 7.5699 118.4785 56.1110 33.4090 175.1712 55 E 5.1967 8.5092 126.3377 55.1713 32.8093 175.2922 56 G 4.2418 8.7003 110.4033 46.3904 0.0000 170.8958 57 F 5.7979 9.3841 122.9878 56.9319 41.3751 175.8114 58 I 4.5254 8.5862 119.4029 58.0948 40.6117 173.2986 59 P 2.9700 0.0000 0.0000 61.3963 32.8101 175.3953 60 S 3.4895 6.3970 114.3440 58.2231 62.2945 174.0589 61 N 4.9139 7.7300 113.1878 52.5796 40.7404 173.7623 62 Y 4.4862 7.9360 114.0223 59.0039 40.5415 175.5494 63 V 4.9785 7.4999 109.8478 60.0318 35.7307 174.8383 64 A 4.5707 8.0745 120.8479 51.9098 22.7900 174.8254 65 K 4.3825 8.7664 115.1417 56.7555 33.1510 177.7136 66 L 3.2746 8.3251 124.3959 57.0313 42.4341 172.1767 67 N 4.2113 7.8267 123.5120 54.1164 40.2325 174.7523 68 T 4.1752 8.3492 118.2786 63.7187 68.7473 174.8122 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 9 Q 8.33 4.06 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 5.75 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 10 G 8.27 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 0.00 0.00 0.00 0.00 11 D 8.68 4.84 0.00 2.61 2.30 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.11 4.81 1.84 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 1.33 1.06 0.88 0.00 0.00 13 V 9.39 4.84 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.98 0.00 0.00 14 V 9.06 4.61 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 0.69 0.00 0.00 0.98 0.00 0.00 15 A 9.85 4.11 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.83 4.23 0.00 2.02 1.79 1.02 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.12 4.85 0.00 2.86 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.75 0.00 2.09 2.10 0.00 3.88 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 19 Y 9.54 4.19 0.00 1.43 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.96 4.69 0.00 2.58 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.26 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.38 4.08 1.81 0.00 0.00 0.26 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 0.60 0.91 0.00 0.00 23 H 7.94 5.05 0.00 3.48 3.28 0.00 5.72 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.41 0.00 2.14 2.13 0.00 3.55 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.86 0.00 25 D 7.89 4.92 0.00 2.56 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.28 5.29 0.00 2.90 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 27 L 8.70 4.48 0.00 1.91 1.69 1.26 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.80 4.89 0.00 4.15 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 5.14 0.00 3.14 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.72 4.66 0.00 1.89 1.74 0.00 1.78 0.00 0.00 1.90 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.43 7.81 31 K 8.90 4.18 0.00 1.72 1.88 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.49 7.81 32 G 8.93 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 33 E 8.44 4.39 0.00 2.26 1.92 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 2.38 2.34 0.00 34 K 8.54 4.63 0.00 1.75 1.68 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.44 7.81 35 M 9.80 5.65 0.00 1.67 1.76 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 36 K 8.54 4.94 0.00 1.79 1.61 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.37 7.81 37 V 8.66 4.71 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 1.21 0.00 0.00 0.98 0.00 0.00 38 L 8.84 4.38 0.00 1.65 1.74 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.05 4.65 0.00 2.05 1.90 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 2.27 2.32 0.00 40 E 8.62 5.07 0.00 1.63 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.41 0.00 41 H 9.83 5.11 0.00 3.80 3.54 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 9.08 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.57 4.43 0.00 2.25 2.14 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 2.38 2.33 0.00 44 W 8.10 4.01 0.00 3.22 2.40 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 0.00 45 W 7.40 5.63 0.00 3.29 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 46 K 9.24 5.65 0.00 2.36 1.98 0.00 1.78 0.00 0.00 2.12 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.70 7.81 47 A 8.46 5.94 1.25 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 0.00 0.00 0.00 0.00 0.00 48 K 8.36 5.12 0.00 1.83 1.62 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.48 7.81 49 S 9.35 4.91 0.00 4.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.27 4.25 0.00 1.72 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.89 4.12 0.00 1.70 1.71 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.86 4.39 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 53 K 8.49 3.95 0.00 1.88 1.87 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.37 7.81 54 K 7.57 4.38 0.00 1.93 1.73 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.43 7.81 55 E 8.51 5.20 0.00 2.03 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 2.30 2.34 0.00 56 G 8.70 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 0.00 0.00 0.00 0.00 57 F 9.38 5.80 0.00 3.11 3.33 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 0.00 0.00 0.00 58 I 8.59 4.53 1.33 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.14 0.75 0.00 0.00 59 P 0.00 2.97 0.00 1.40 0.57 0.00 3.19 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.00 0.00 60 S 6.40 3.49 0.00 2.96 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 N 7.73 4.91 0.00 2.52 2.73 0.00 0.00 6.88 7.33 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 62 Y 7.94 4.49 0.00 2.97 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.50 4.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 0.00 0.00 0.86 0.00 0.00 64 A 8.07 4.57 1.24 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 0.00 0.00 65 K 8.77 4.38 0.00 1.74 1.73 0.00 1.86 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.38 7.81 66 L 8.33 3.27 0.00 1.66 1.61 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 67 N 7.83 4.21 0.00 2.71 2.57 0.00 0.00 6.78 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.35 4.18 4.22 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 1.20 0.00 0.00