NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4475 8.3049 118.1943 55.1063 32.5759 174.1558 2 I 4.2625 8.1031 120.2000 59.1995 39.2035 174.1567 3 R 4.5179 9.1743 124.8947 54.9244 32.8736 175.6754 4 T 4.4577 8.2824 117.3268 62.3906 69.3406 174.0835 5 M 4.7281 8.1814 125.7303 52.6812 34.9831 175.6548 6 L 4.0194 8.3405 123.7679 55.3724 42.6593 176.6873 7 Q 4.0430 8.8934 127.9057 58.0429 29.3610 175.3763 8 G 4.0151 7.5165 103.4657 45.7105 0.0000 171.6780 9 K 4.4248 8.2890 116.6494 55.7815 34.8156 175.3510 10 L 4.4054 8.3117 120.5548 53.4145 42.0964 175.9428 11 H 4.4163 8.7344 124.8001 55.6340 30.3053 175.2375 12 R 3.7205 8.2243 127.6861 57.2791 26.8184 176.7595 13 V 4.0314 7.4009 109.6712 60.4872 33.2676 176.0085 14 K 4.4687 8.1329 122.9304 54.2839 33.6206 176.3745 15 V 3.7341 8.3577 126.3451 63.3059 31.9035 175.5144 16 T 4.5026 8.2960 115.5202 61.9962 70.3069 173.5444 17 H 4.7296 7.6838 119.3590 55.0679 32.6371 172.1746 18 A 4.5136 7.9699 126.9648 50.4815 21.4579 175.6424 19 D 4.5751 8.3276 121.8136 51.6860 42.0129 174.3445 20 L 3.9842 8.3924 127.7475 57.8087 42.3073 177.4460 21 H 4.8352 8.4634 113.0001 55.4601 29.4103 174.0740 22 Y 4.2700 8.7940 118.2078 58.2100 40.9562 170.1684 23 E 3.0208 5.9000 112.2545 61.4838 26.8257 175.8123 24 G 4.1150 5.9675 111.1362 44.8931 0.0000 173.4762 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 M 8.30 4.45 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 2 I 8.10 4.26 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.27 0.91 0.00 0.00 3 R 9.17 4.52 0.00 1.79 1.84 0.00 3.34 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 4 T 8.28 4.46 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 5 M 8.18 4.73 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 6 L 8.34 4.02 0.00 1.58 1.59 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.89 4.04 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 8 G 7.52 4.02 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 0.00 9 K 8.29 4.42 0.00 1.85 1.75 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.47 7.81 10 L 8.31 4.41 0.00 1.64 1.66 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 11 H 8.73 4.42 0.00 3.08 3.24 0.00 6.06 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.22 3.72 0.00 1.95 1.94 0.00 3.23 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.23 0.00 13 V 7.40 4.03 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 0.67 0.00 0.00 0.92 0.00 0.00 14 K 8.13 4.47 0.00 1.69 1.68 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.39 7.81 15 V 8.36 3.73 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 0.86 0.00 0.00 0.92 0.00 0.00 16 T 8.30 4.50 4.25 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 1.28 0.00 0.00 17 H 7.68 4.73 0.00 3.04 3.17 0.00 5.87 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 18 A 7.97 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.33 4.58 0.00 2.57 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.39 3.98 0.00 1.53 1.41 0.86 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 21 H 8.46 4.84 0.00 3.19 3.37 0.00 5.70 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.79 4.27 0.00 3.01 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 E 5.90 3.02 0.00 1.79 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 2.05 2.14 0.00 24 G 5.97 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00