NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3478 8.1885 116.7949 57.8006 63.9733 175.3197 2 A 3.9428 7.9414 123.7860 55.4322 18.9296 178.7258 3 D 4.1666 8.1698 113.4809 56.7155 42.2852 176.4537 4 E 4.0803 8.0582 119.9521 58.6583 29.9638 177.7025 5 E 4.0482 8.9156 120.2265 59.6088 29.4559 178.6782 6 L 3.9605 7.4689 119.6196 58.1227 41.6411 178.3364 7 E 3.9355 8.6347 119.4256 59.4354 29.4452 178.7961 8 A 4.0479 8.0304 120.6080 54.6133 18.4349 179.4762 9 L 3.9039 7.6358 118.6764 58.4639 42.3896 179.1814 10 R 4.0361 9.6044 117.9144 58.9571 30.0352 179.0453 11 R 4.2312 8.2685 118.0668 58.6336 29.8107 179.0100 12 Q 3.9238 8.0205 118.1819 59.1131 28.4598 178.7215 13 R 4.0208 8.0199 119.6559 58.8561 30.0664 178.1561 14 L 3.8193 8.3468 120.4558 58.0632 42.3463 178.6779 15 A 4.1341 8.4177 120.9018 54.9313 17.9739 179.4086 16 E 3.8773 7.5458 115.3670 59.6015 29.9221 178.9965 17 L 4.1397 7.3832 120.2798 58.2204 42.1225 178.7989 18 Q 4.1153 8.4100 116.6216 57.7463 28.7408 176.9230 19 A 4.7205 7.8619 122.5729 51.9795 18.9941 177.4668 20 K 4.2679 7.2942 118.5657 57.8771 33.8319 176.9610 21 H 4.5317 8.9505 119.3667 56.6282 32.1266 174.5191 22 G 4.3630 6.9924 104.5339 43.2913 0.0000 172.7921 23 D 4.7047 8.0350 119.7149 50.8447 41.4565 173.7218 24 P 4.2887 0.0000 0.0000 65.0664 31.8440 178.4284 25 G 3.6988 7.5515 106.3754 48.2759 0.0000 173.3507 26 D 4.4950 8.4575 124.5669 53.8789 40.8689 176.4752 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 S 8.19 4.35 0.00 3.90 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 2 A 7.94 3.94 1.32 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 0.00 0.00 3 D 8.17 4.17 0.00 2.80 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.06 4.08 0.00 2.00 1.97 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 2.29 2.24 0.00 5 E 8.92 4.05 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 6 L 7.47 3.96 0.00 1.90 1.65 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.63 3.94 0.00 2.22 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 2.31 2.34 0.00 8 A 8.03 4.05 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.64 3.90 0.00 1.77 1.76 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 10 R 9.60 4.04 0.00 1.87 1.96 0.00 3.33 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 11 R 8.27 4.23 0.00 1.90 1.97 0.00 3.29 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 12 Q 8.02 3.92 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 13 R 8.02 4.02 0.00 2.08 1.91 0.00 3.08 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 14 L 8.35 3.82 0.00 1.74 1.68 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.42 4.13 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 16 E 7.55 3.88 0.00 2.25 2.03 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 2.35 2.39 0.00 17 L 7.38 4.14 0.00 1.87 1.65 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.41 4.12 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.23 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 19 A 7.86 4.72 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 20 K 7.29 4.27 0.00 1.96 1.75 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.66 7.81 21 H 8.95 4.53 0.00 3.04 3.24 0.00 5.92 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 22 G 6.99 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.04 4.70 0.00 2.63 2.75 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 24 P 0.00 4.29 0.00 2.08 2.12 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 25 G 7.55 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.46 4.50 0.00 2.89 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