NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.4886 8.2531 123.5983 51.7747 20.5535 177.1466 6 G 3.8233 8.0402 103.6266 44.0716 0.0000 171.0381 7 E 4.2189 7.8351 118.3996 54.9076 31.4202 173.4193 8 P 4.4010 0.0000 0.0000 61.7806 32.0008 174.3010 9 P 3.6264 0.0000 0.0000 62.6836 31.4215 175.0461 10 Y 4.6261 8.0102 123.1447 55.9597 39.8464 175.2798 11 T 4.2000 8.3356 125.4811 64.7988 68.8573 176.0119 12 G 3.7668 6.9084 105.4460 44.2056 0.0000 171.1569 13 P 4.3640 0.0000 0.0000 64.2396 32.2694 177.5455 14 C 4.5328 7.7826 116.8429 56.8237 40.8351 173.4973 15 K 4.4670 8.1981 119.5392 56.2212 32.3442 176.6197 16 A 4.3169 7.7644 120.6383 51.3822 20.8150 177.6046 17 R 4.5472 8.3951 119.5859 54.7046 31.1559 174.2847 18 I 4.4882 8.3612 126.8236 59.1335 40.1736 174.8897 19 I 4.3406 8.3689 128.5807 60.9510 37.7787 175.4709 20 R 4.8148 8.5920 125.3084 54.6242 34.9030 173.6167 21 Y 5.6961 9.5290 118.0955 56.6674 40.5833 175.3192 22 F 5.7403 9.6597 117.3572 55.2554 41.6798 173.2587 23 Y 4.6126 9.7732 122.6275 56.8980 39.9211 174.3786 24 N 4.2713 8.4714 127.2250 52.0517 38.0079 174.9496 25 A 3.8156 8.2117 128.5107 55.3202 18.8380 177.7339 26 K 4.5923 7.5515 116.6519 53.3081 31.4329 175.6522 27 A 4.6986 8.0469 135.0000 52.4205 20.3289 177.9011 28 G 3.8886 8.8201 103.5467 45.3554 0.0000 172.5735 29 L 4.7118 6.9490 118.0777 54.6600 44.5855 173.2861 30 C 5.2339 8.6558 116.0247 55.7703 42.2009 173.6757 31 Q 4.9784 8.7735 122.3585 54.0536 32.7010 174.6120 32 T 4.7984 8.4091 110.8575 61.2302 70.4095 173.6769 33 F 5.0051 9.1279 118.1307 55.6113 42.3936 173.0516 34 V 4.2833 8.3533 119.0934 61.7653 32.2926 174.1364 35 Y 4.6836 8.7844 130.3712 56.2918 40.1931 176.4801 36 G 3.8479 8.2540 113.4404 46.3538 0.0000 175.0369 37 G 3.8341 6.2673 107.2749 45.3266 0.0000 171.9042 38 C 4.9471 7.0675 112.0227 53.9935 45.1816 173.1091 39 R 3.6984 8.8051 115.6091 56.8572 27.2420 177.0966 40 A 4.2057 8.1895 118.6170 52.5570 19.1878 178.1470 41 K 4.3844 8.4408 123.6842 55.2946 34.1211 177.8117 42 R 3.9009 8.2305 117.6574 59.2746 29.7224 174.8300 43 N 4.7225 8.0668 117.4809 51.5924 36.5907 173.8587 44 N 4.9420 6.3115 115.6979 52.8383 41.8336 173.5098 45 F 5.0793 9.6372 125.3878 55.7418 43.1285 176.4133 46 K 4.4764 9.1116 119.9219 57.8728 32.6147 177.5169 47 S 4.5341 7.6493 112.9468 55.3396 67.3175 174.6130 48 A 3.2838 7.5847 124.4274 55.0501 18.1900 179.9265 49 E 3.7833 7.8670 115.7105 59.4169 29.6137 178.5829 50 D 4.2248 7.9544 119.0015 57.2164 41.3831 177.5650 51 C 2.4500 7.4497 118.7770 59.3748 43.4018 175.4164 52 M 3.8582 7.7421 119.1796 58.2554 31.5819 178.3957 53 R 3.8984 7.5223 117.5252 59.9627 30.3923 178.4463 54 T 3.9138 7.5414 114.0700 66.3014 68.4881 174.7244 55 A 4.0064 7.3233 125.9498 52.1712 18.4506 176.9311 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 A 8.25 4.49 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.04 3.82 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 0.00 0.00 0.00 7 E 7.84 4.22 0.00 2.08 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 0.00 2.31 2.33 0.00 8 P 0.00 4.40 0.00 2.15 2.08 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 9 P 0.00 3.63 0.00 0.58 0.49 0.00 3.44 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.70 0.00 10 Y 8.01 4.63 0.00 2.78 2.90 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 0.00 0.00 0.00 11 T 8.34 4.20 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 1.20 0.00 0.00 12 G 6.91 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 13 P 0.00 4.36 0.00 2.17 2.18 0.00 3.78 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 14 C 7.78 4.53 0.00 2.93 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 15 K 8.20 4.47 0.00 1.66 1.74 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.34 7.81 16 A 7.76 4.32 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.40 4.55 0.00 1.75 1.80 0.00 3.15 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 18 I 8.36 4.49 2.02 0.00 0.00 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 1.22 0.63 1.00 0.00 0.00 19 I 8.37 4.34 1.82 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 1.29 0.26 0.78 0.00 0.00 20 R 8.59 4.81 0.00 0.93 1.77 0.00 3.40 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 21 Y 9.53 5.70 0.00 3.15 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.66 5.74 0.00 3.01 2.85 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 23 Y 9.77 4.61 0.00 3.01 2.99 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 24 N 8.47 4.27 0.00 2.24 2.33 0.00 0.00 6.62 8.19 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 25 A 8.21 3.82 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.55 4.59 0.00 1.86 1.85 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.42 7.81 27 A 8.05 4.70 1.21 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 28 G 8.82 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 6.95 4.71 0.00 1.73 1.73 0.78 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.66 5.23 0.00 2.86 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.77 4.98 0.00 1.76 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 2.11 1.79 0.00 32 T 8.41 4.80 4.04 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 0.47 0.00 0.00 33 F 9.13 5.01 0.00 2.84 2.91 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 0.00 34 V 8.35 4.28 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 0.70 0.00 0.00 0.89 0.00 0.00 35 Y 8.78 4.68 0.00 2.45 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.25 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 0.00 0.00 0.00 37 G 6.27 3.83 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 0.00 0.00 0.00 38 C 7.07 4.95 0.00 3.05 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 39 R 8.81 3.70 0.00 2.10 2.21 0.00 3.46 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 40 A 8.19 4.21 1.07 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 0.00 0.00 41 K 8.44 4.38 0.00 1.72 1.81 0.00 1.18 0.00 0.00 1.46 0.00 0.00 2.56 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.14 1.08 7.81 42 R 8.23 3.90 0.00 1.83 1.85 0.00 3.26 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 43 N 8.07 4.72 0.00 2.90 2.82 0.00 0.00 6.95 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 6.31 4.94 0.00 2.72 2.61 0.00 0.00 7.08 7.02 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 45 F 9.64 5.08 0.00 3.11 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 46 K 9.11 4.48 0.00 1.83 1.94 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.48 7.81 47 S 7.65 4.53 0.00 4.05 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.58 3.28 1.02 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 0.00 0.00 49 E 7.87 3.78 0.00 2.09 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 2.28 2.25 0.00 50 D 7.95 4.22 0.00 2.82 2.78 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 51 C 7.45 2.45 0.00 2.71 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 M 7.74 3.86 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.70 0.00 53 R 7.52 3.90 0.00 1.73 1.99 0.00 3.24 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 54 T 7.54 3.91 4.08 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 1.36 0.00 0.00 55 A 7.32 4.01 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00