NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.4001 8.0333 110.9472 61.4514 70.4126 174.6216 6 T 3.7292 8.5184 120.3999 66.2041 68.4266 174.9479 7 Y 4.0965 8.5548 122.9255 60.7952 39.2688 177.6915 8 A 4.0635 8.0560 121.7007 55.2166 18.4715 179.3764 9 D 4.3222 8.0699 117.3878 57.3973 40.6458 178.7166 10 F 4.2342 8.1875 120.4606 61.3619 39.4388 176.9825 11 I 3.4674 7.3675 118.2414 64.1257 36.9216 177.9634 12 A 4.0882 7.7757 120.9916 53.7600 18.6067 178.2472 13 S 4.2324 7.7810 113.3382 57.9252 63.7383 175.6328 14 G 3.9938 8.5384 113.8086 46.1241 0.0000 173.6653 15 R 4.5857 7.7482 117.9912 55.7194 30.6498 177.6247 16 T 3.8449 7.6257 109.2175 62.6378 69.6082 174.9212 17 G 3.8902 7.5849 110.8482 43.9429 0.0000 173.1766 18 R 3.8881 8.4222 118.0382 56.7273 30.2569 176.5985 19 R 4.5367 8.5397 121.6927 54.5491 31.6199 175.2227 20 N 4.8821 8.4981 120.2590 51.3328 40.5062 175.0630 21 A 4.1000 8.7380 125.9604 55.0872 18.8689 177.5257 22 I 4.0334 7.6067 119.3716 61.5540 37.3674 175.7091 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 5 T 8.03 4.40 4.32 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 1.25 0.00 0.00 6 T 8.52 3.73 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 1.24 0.00 0.00 7 Y 8.55 4.10 0.00 3.10 3.02 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 8 A 8.06 4.06 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.07 4.32 0.00 2.97 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.19 4.23 0.00 2.85 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.37 3.47 1.85 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.75 0.81 0.00 0.00 12 A 7.78 4.09 1.33 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 0.00 0.00 0.00 13 S 7.78 4.23 0.00 3.98 3.97 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 0.00 0.00 0.00 14 G 8.54 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 4.59 0.00 1.69 1.92 0.00 3.16 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.48 0.00 16 T 7.63 3.84 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 0.33 0.00 0.00 17 G 7.58 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.42 3.89 0.00 1.81 1.92 0.00 3.19 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 19 R 8.54 4.54 0.00 1.80 1.87 0.00 3.23 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.85 0.00 20 N 8.50 4.88 0.00 2.70 2.73 0.00 0.00 7.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.74 4.10 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.61 4.03 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 1.28 0.90 0.91 0.00 0.00