NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8733 8.2133 109.7255 44.7668 0.0000 174.0016 3 K 3.6125 8.1693 124.9505 58.4695 32.5936 176.6960 4 G 3.4108 8.4637 107.7054 46.9090 0.0000 173.7669 5 D 4.1585 7.7469 119.1183 54.7731 40.9800 177.1019 6 R 4.5105 8.4971 123.0997 56.5475 30.0473 176.4487 7 R 4.1898 7.2786 114.9835 55.2476 31.1249 174.1714 8 T 4.5488 7.4262 106.1250 59.3728 71.7173 172.9618 9 R 3.8807 7.9162 120.3562 60.3898 30.3371 177.3982 10 R 4.3564 7.9535 116.4519 57.4405 30.2250 178.8571 11 G 3.8556 7.5449 108.5230 47.3277 0.0000 176.1713 12 K 4.2412 7.7717 120.4468 58.6440 32.1899 179.4235 13 I 3.5844 7.8358 119.7999 64.3942 36.7990 177.9878 14 W 4.1544 7.9065 127.4845 60.3478 30.6032 177.7192 15 R 3.7466 7.5601 116.7617 56.4455 29.7375 177.0955 16 G 3.7493 7.8794 106.2343 46.1912 0.0000 172.7856 17 T 4.8113 7.8626 108.7322 59.6819 71.5390 171.3586 18 Y 4.2923 8.5470 117.4079 54.5490 41.3341 180.0182 19 G 4.1362 8.6204 111.4116 45.5816 0.0000 174.0492 20 K 4.3003 8.8388 119.8364 58.3136 33.2338 177.9429 21 Y 3.8474 8.2698 113.6589 59.3512 38.0547 175.4543 22 R 4.6046 7.4134 120.5995 53.0710 31.8673 173.4254 23 P 4.2682 0.0000 0.0000 63.5000 31.3582 175.3311 24 R 4.6135 8.2700 121.3939 53.9625 33.5176 174.9240 25 K 4.1378 8.2808 118.9040 56.6511 32.1714 177.1992 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 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.61 0.00 1.45 1.48 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.40 7.81 4 G 8.46 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 0.00 0.00 0.00 5 D 7.75 4.16 0.00 2.84 2.55 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 6 R 8.50 4.51 0.00 1.75 1.88 0.00 3.23 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 7 R 7.28 4.19 0.00 1.44 0.98 0.00 3.11 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.47 0.00 8 T 7.43 4.55 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 1.10 0.00 0.00 9 R 7.92 3.88 0.00 1.93 1.84 0.00 3.24 0.00 0.00 3.36 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 10 R 7.95 4.36 0.00 1.89 1.97 0.00 3.19 0.00 0.00 3.34 7.52 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 7.54 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 0.00 0.00 0.00 12 K 7.77 4.24 0.00 1.91 2.00 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.27 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.57 7.81 13 I 7.84 3.58 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.68 0.92 0.00 0.00 14 W 7.91 4.15 0.00 3.21 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 7.56 3.75 0.00 1.97 1.95 0.00 3.46 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 16 G 7.88 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 0.00 0.00 0.00 17 T 7.86 4.81 4.33 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 1.25 0.00 0.00 18 Y 8.55 4.29 0.00 2.91 2.88 0.00 0.00 0.00 0.00 0.00 0.00 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 8.62 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 0.00 0.00 0.00 0.00 20 K 8.84 4.30 0.00 1.75 1.76 0.00 1.58 0.00 0.00 1.45 0.00 0.00 2.47 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.96 1.26 7.81 21 Y 8.27 3.85 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 4.60 0.00 1.72 2.05 0.00 3.35 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.71 0.00 23 P 0.00 4.27 0.00 2.29 2.13 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 24 R 8.27 4.61 0.00 1.74 1.78 0.00 2.61 0.00 0.00 2.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.51 0.00 25 K 8.28 4.14 0.00 1.69 1.65 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.36 7.81