NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 T 4.4335 8.0333 117.3639 63.6488 69.1470 171.7503 10 F 4.6068 8.2035 120.5903 55.2710 42.3809 171.5471 11 V 4.4785 8.9391 119.8779 61.3325 35.8145 174.7234 12 A 4.1176 8.5825 128.2438 51.4362 17.6981 177.7375 13 L 3.7866 8.8136 121.2421 58.3370 41.9861 177.3233 14 Y 4.5302 7.9158 112.1702 56.0237 41.6299 176.0317 15 D 4.5997 8.5369 121.6170 54.8448 39.5030 176.2148 16 Y 4.5821 6.6730 117.7817 57.3819 39.5289 176.4459 17 E 4.1832 8.6861 128.8607 54.4859 28.5425 175.5522 18 S 4.0499 7.1549 116.2927 57.9957 63.3878 173.9531 19 R 4.3704 8.4063 123.0697 57.0944 31.5673 177.1459 20 T 4.4338 7.1520 106.4560 60.2723 70.0722 174.7865 21 E 4.0772 8.5821 120.2923 59.2829 29.5013 177.6410 22 T 3.7829 7.4980 115.2587 66.6644 68.9952 173.4231 23 D 4.6114 8.1486 120.9535 55.1175 41.5711 176.5293 24 L 4.3308 8.6057 124.5010 53.7010 41.8930 176.8739 25 S 3.8592 8.6383 121.4144 58.2412 63.0978 173.8949 26 F 5.0176 7.3403 120.3524 54.7608 40.6379 174.0435 27 K 4.6007 8.3192 119.5743 53.9564 34.9412 174.9580 28 K 5.2235 7.7885 123.7444 60.4907 30.9680 175.9010 29 G 3.9495 8.6866 113.7157 45.2284 0.0000 171.8561 30 E 4.4284 8.1042 120.8595 54.7940 30.8577 175.5799 31 R 4.4087 8.2372 121.1914 55.3401 31.1565 176.5056 32 L 4.4344 8.1243 121.9049 53.6481 45.5824 176.3988 33 Q 4.3403 8.8661 127.0276 54.2395 27.9906 174.1378 34 I 3.3914 7.9155 123.0659 62.8822 37.7315 173.3680 35 V 3.8337 8.6998 124.4406 63.4071 32.0092 177.7158 36 N 4.6389 8.5830 119.4863 52.1129 41.1106 175.0693 37 N 3.1400 7.2766 119.6225 53.0683 38.4878 174.2089 38 T 3.7840 8.1258 124.7306 63.7881 65.7985 176.6746 39 E 4.4885 5.9000 113.7860 54.6731 31.3273 175.1684 40 G 4.5528 8.7488 111.6747 45.7928 0.0000 172.4663 41 D 4.9296 8.2885 128.2413 53.8313 42.5823 177.9036 42 W 5.1070 9.1379 124.9956 55.3856 30.3526 174.2637 43 W 4.7893 7.7103 123.7008 56.2320 30.6396 174.8096 44 L 5.0018 8.2715 122.7325 54.2346 43.8037 175.1773 45 A 5.1547 8.7626 124.5137 50.3670 23.3038 174.4202 46 H 5.3053 8.6472 118.6030 53.2339 33.0547 173.0548 47 S 4.5731 8.5565 121.5534 57.5272 63.7139 174.5658 48 L 4.5569 8.0423 123.6946 55.1039 41.4204 176.1870 49 T 4.4131 7.4529 111.5747 64.0661 71.3766 176.0847 50 T 4.1397 9.0235 115.5415 65.5047 70.5076 175.6098 51 G 3.3125 7.6676 109.7278 45.0884 0.0000 173.4174 52 Q 4.5015 7.9484 118.7960 55.0893 31.0823 175.4054 53 T 4.8993 8.0634 116.2148 62.2113 72.6578 174.3818 54 G 3.9297 8.2120 108.0414 45.5948 0.0000 172.2450 55 Y 4.9071 8.8261 124.7143 58.4875 38.0492 175.2382 56 I 4.6842 8.3789 119.3833 58.1508 39.3918 174.3012 57 P 3.3147 0.0000 0.0000 61.9650 31.7011 177.5969 58 S 3.0007 7.2790 116.5809 60.5215 62.7568 175.7281 59 N 4.3236 7.2051 117.9259 55.5070 38.9895 174.3830 60 Y 5.4115 7.6951 114.8671 58.1206 39.3088 175.1793 61 V 5.4912 7.6664 117.8480 59.1724 35.3153 174.5817 62 A 4.6861 8.2589 118.9203 50.2694 22.3176 173.9783 63 P 3.7940 0.0000 0.0000 63.1275 30.7998 176.6279 64 S 3.9484 7.7333 117.1988 59.0128 64.8807 172.5668 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 T 8.03 4.43 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 1.20 0.00 0.00 10 F 8.20 4.61 0.00 2.91 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 11 V 8.94 4.48 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 1.03 0.00 0.00 1.00 0.00 0.00 12 A 8.58 4.12 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 13 L 8.81 3.79 0.00 1.80 1.52 1.09 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.92 4.53 0.00 1.79 2.35 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 15 D 8.54 4.60 0.00 2.61 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.67 4.58 0.00 2.90 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 17 E 8.69 4.18 0.00 2.00 1.81 0.00 0.00 0.00 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 2.51 0.00 18 S 7.15 4.05 0.00 3.30 3.32 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 0.00 19 R 8.41 4.37 0.00 1.83 1.94 0.00 3.25 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 20 T 7.15 4.43 4.28 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 21 E 8.58 4.08 0.00 2.11 2.13 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 2.30 2.35 0.00 22 T 7.50 3.78 4.42 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 1.40 0.00 0.00 23 D 8.15 4.61 0.00 2.90 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 24 L 8.61 4.33 0.00 1.77 1.72 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.64 3.86 0.00 3.72 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.34 5.02 0.00 3.20 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 27 K 8.32 4.60 0.00 1.77 1.70 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.34 7.81 28 K 7.79 5.22 0.00 1.75 1.78 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.40 7.81 29 G 8.69 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 0.00 0.00 0.00 30 E 8.10 4.43 0.00 2.31 1.96 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 2.33 2.34 0.00 31 R 8.24 4.41 0.00 1.86 1.86 0.00 3.27 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 32 L 8.12 4.43 0.00 1.39 1.45 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.87 4.34 0.00 2.39 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 34 I 7.92 3.39 1.41 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 -0.36 0.45 0.00 0.00 35 V 8.70 3.83 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 0.84 0.00 0.00 0.99 0.00 0.00 36 N 8.58 4.64 0.00 2.70 2.70 0.00 0.00 6.73 8.01 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 37 N 7.28 3.14 0.00 1.44 1.42 0.00 0.00 5.39 7.49 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 38 T 8.13 3.78 4.20 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 1.29 0.00 0.00 39 E 5.90 4.49 0.00 2.16 1.95 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 2.37 2.30 0.00 40 G 8.75 4.55 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 0.00 0.00 0.00 41 D 8.29 4.93 0.00 2.92 2.15 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 0.00 0.00 0.00 0.00 42 W 9.14 5.11 0.00 3.00 3.18 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 43 W 7.71 4.79 0.00 3.35 2.97 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 44 L 8.27 5.00 0.00 1.98 1.59 0.23 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.76 5.15 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 46 H 8.65 5.31 0.00 3.25 3.07 0.00 5.82 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.56 4.57 0.00 3.73 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.04 4.56 0.00 1.66 1.69 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.45 4.41 4.23 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 1.21 0.00 0.00 50 T 9.02 4.14 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 1.21 0.00 0.00 51 G 7.67 3.31 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 52 Q 7.95 4.50 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.36 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 53 T 8.06 4.90 4.15 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 0.00 0.00 0.00 0.93 0.00 0.00 54 G 8.21 3.93 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 0.00 0.00 0.00 55 Y 8.83 4.91 0.00 3.31 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 56 I 8.38 4.68 1.84 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.81 1.24 0.00 0.00 57 P 0.00 3.31 0.00 0.85 0.49 0.00 3.34 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 0.80 0.44 0.00 58 S 7.28 3.00 0.00 2.72 2.63 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 59 N 7.21 4.32 0.00 2.30 2.47 0.00 0.00 6.74 7.49 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 60 Y 7.70 5.41 0.00 3.04 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 0.00 61 V 7.67 5.49 1.94 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 0.97 0.00 0.00 1.22 0.00 0.00 62 A 8.26 4.69 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 63 P 0.00 3.79 0.00 1.81 1.45 0.00 3.95 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.90 0.00 64 S 7.73 3.95 0.00 4.04 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00