NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8501 8.2133 109.7215 44.6639 0.0000 174.4864 3 K 2.9570 8.3153 118.5228 58.1507 31.8842 176.2352 4 G 3.4952 7.7257 106.1280 45.0421 0.0000 173.2801 5 D 4.5153 8.6465 122.8149 51.9888 39.9249 176.6714 6 R 3.9781 8.3547 123.3853 58.0489 29.6430 177.6812 7 R 3.9060 7.7535 116.1567 55.0025 29.6930 175.7584 8 T 4.7353 7.1038 107.0559 60.5350 73.6107 172.2785 9 R 3.8590 8.8306 119.4001 60.0588 29.7050 178.0585 10 R 4.0639 8.1081 116.5279 59.7377 30.2693 178.6482 11 G 4.5062 7.7083 105.6186 47.6668 0.0000 175.4398 12 K 3.9774 8.0392 121.8943 58.2564 32.3105 179.1848 13 I 3.5924 7.7637 119.8825 64.5201 36.8715 177.8515 14 W 4.0394 8.6809 127.5655 60.6525 30.7080 177.7491 15 R 4.1725 8.6652 115.0083 55.8748 30.1557 176.6844 16 G 3.8371 7.7468 107.2441 46.8864 0.0000 172.1712 17 T 4.6405 7.8478 107.5325 59.7838 72.5191 172.2959 18 Y 4.9261 8.2236 117.3208 56.4384 42.1175 175.9231 19 G 4.0329 8.2252 107.7562 46.0756 0.0000 173.5217 20 K 3.9191 8.9512 119.8009 58.7743 32.0852 177.6772 21 Y 4.3939 7.7033 113.7016 58.6098 39.2139 176.3310 22 R 4.7087 8.1031 118.6336 55.0850 31.9750 171.8432 23 P 4.8603 0.0000 0.0000 61.6195 32.7132 177.3299 24 R 3.6233 8.4966 117.7572 57.2777 30.1337 177.3938 25 K 3.9971 7.6607 119.9035 57.4027 33.0504 174.5978 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 2 G 8.21 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 3 K 8.32 2.96 0.00 1.36 0.93 0.00 1.70 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.43 7.81 4 G 7.73 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.65 4.52 0.00 2.47 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.35 3.98 0.00 1.92 2.07 0.00 3.05 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 7 R 7.75 3.91 0.00 0.67 1.53 0.00 2.88 0.00 0.00 2.97 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.14 0.00 8 T 7.10 4.74 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 1.23 0.00 0.00 9 R 8.83 3.86 0.00 1.99 1.95 0.00 3.32 0.00 0.00 3.40 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 10 R 8.11 4.06 0.00 1.88 2.01 0.00 3.22 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 11 G 7.71 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.04 3.98 0.00 2.09 1.98 0.00 1.69 0.00 0.00 1.95 0.00 0.00 3.35 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.55 1.42 7.81 13 I 7.76 3.59 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.19 0.92 0.00 0.00 14 W 8.68 4.04 0.00 3.30 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.67 4.17 0.00 2.05 2.03 0.00 3.47 0.00 0.00 3.31 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.09 0.00 16 G 7.75 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.85 4.64 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 18 Y 8.22 4.93 0.00 2.95 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 19 G 8.23 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.95 3.92 0.00 1.63 1.52 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.67 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.95 1.28 7.81 21 Y 7.70 4.39 0.00 3.08 3.07 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 22 R 8.10 4.71 0.00 1.85 1.84 0.00 3.09 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 23 P 0.00 4.86 0.00 2.09 2.00 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.25 0.00 24 R 8.50 3.62 0.00 1.65 1.72 0.00 2.21 0.00 0.00 2.68 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.31 0.00 25 K 7.66 4.00 0.00 1.70 1.66 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 1.21 7.81