NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9246 8.1132 109.1203 45.2936 0.0000 174.2269 3 K 3.9807 8.4657 124.4528 56.3765 31.9606 176.2042 4 G 3.7326 8.0147 107.9598 44.9111 0.0000 173.2716 5 D 4.2658 7.8385 121.0163 54.7673 40.9616 176.5933 6 R 4.3266 8.5100 123.5059 56.5283 30.1105 177.3307 7 R 4.2656 7.4647 113.8797 52.8812 31.1091 174.1558 8 T 4.5881 7.2371 107.9355 59.7228 73.7614 172.2102 9 R 3.9033 8.8789 119.3125 60.5065 29.6512 177.1520 10 R 4.2948 8.0096 118.1338 57.7248 29.2221 178.8009 11 G 3.9318 7.6650 107.6100 47.0481 0.0000 175.6071 12 K 4.3954 7.9505 119.6133 58.0058 32.3910 179.2438 13 I 3.5771 7.5923 120.0666 64.0254 36.8037 177.9630 14 W 4.2206 8.0990 128.8587 60.0827 30.6867 177.0046 15 R 3.7056 7.5489 112.9848 56.0858 29.7484 177.0916 16 G 3.7369 7.5445 104.8847 46.0313 0.0000 173.1290 17 T 4.7359 7.7044 109.9142 59.5870 70.9333 171.3166 18 Y 4.4003 7.8702 115.7902 54.4792 41.6266 181.1901 19 G 3.9180 8.3655 114.9577 45.7130 0.0000 172.7648 20 K 4.0796 8.5971 118.7741 59.6644 32.6853 179.7449 21 Y 4.1049 8.2932 115.7919 59.8663 38.1137 176.3208 22 R 4.6391 7.3863 119.3484 53.3813 31.5526 173.9964 23 P 4.3591 0.0000 0.0000 63.1844 31.8592 175.5809 24 R 4.4706 8.0855 121.2469 54.3562 33.4020 174.7220 25 K 4.1234 8.3332 120.6916 56.7604 32.1305 177.0904 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 8.11 3.92 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 0.00 0.00 0.00 3 K 8.47 3.98 0.00 1.39 1.42 0.00 1.52 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.37 7.81 4 G 8.01 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 7.84 4.27 0.00 2.71 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 6 R 8.51 4.33 0.00 1.76 1.87 0.00 3.27 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 7 R 7.46 4.27 0.00 1.55 1.15 0.00 3.10 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.44 0.00 8 T 7.24 4.59 4.19 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 1.12 0.00 0.00 9 R 8.88 3.90 0.00 1.97 1.83 0.00 3.26 0.00 0.00 3.38 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 10 R 8.01 4.29 0.00 1.89 1.98 0.00 3.20 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 11 G 7.67 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 12 K 7.95 4.40 0.00 1.85 1.95 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.54 7.81 13 I 7.59 3.58 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.95 0.93 0.00 0.00 14 W 8.10 4.22 0.00 3.23 3.30 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 15 R 7.55 3.71 0.00 1.84 1.94 0.00 3.50 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 16 G 7.54 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 4.74 4.30 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 1.27 0.00 0.00 18 Y 7.87 4.40 0.00 2.92 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 19 G 8.37 3.92 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 0.00 0.00 0.00 20 K 8.60 4.08 0.00 1.79 1.83 0.00 1.58 0.00 0.00 1.37 0.00 0.00 2.41 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.02 1.27 7.81 21 Y 8.29 4.10 0.00 2.97 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 7.39 4.64 0.00 1.94 2.11 0.00 3.43 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.96 0.00 23 P 0.00 4.36 0.00 2.16 2.04 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 24 R 8.09 4.47 0.00 1.67 1.69 0.00 2.55 0.00 0.00 2.52 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 25 K 8.33 4.12 0.00 1.70 1.65 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.32 7.81