NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 5.0626 8.3249 119.4559 57.6296 40.3409 173.8499 2 V 4.2532 8.0089 115.5897 58.8786 33.9578 174.2574 3 N 4.4912 9.3877 120.7482 53.5492 39.4454 174.9961 4 Q 4.4270 8.4493 122.4171 54.8036 30.4860 175.1865 5 H 4.8301 8.5259 119.0466 54.3902 31.0019 172.5742 6 L 4.7788 8.3421 125.7220 52.9468 45.1031 176.1633 7 C 4.9747 8.1766 119.3580 58.5468 32.9278 175.3461 8 G 3.7624 8.4689 110.5593 46.5632 0.0000 177.3537 9 S 4.0687 8.5095 116.6511 61.1378 63.3705 176.3922 10 H 4.1435 7.9804 118.7086 58.5692 28.2309 177.4002 11 L 3.9206 7.8131 121.7100 58.1085 42.0524 178.8701 12 V 3.4272 7.3343 117.9109 66.1248 31.3889 177.8730 13 E 3.9745 8.5374 118.4060 59.3781 29.3003 179.2449 14 A 4.0039 8.0657 120.8602 54.9734 18.4215 179.6618 15 L 3.6407 7.9930 118.0684 57.8697 41.4407 179.1349 16 Y 4.0325 7.6464 119.5252 60.6059 38.5300 177.9333 17 L 3.9099 7.6941 119.0946 57.5729 41.7591 179.3781 18 V 3.6900 7.5620 117.4406 65.9317 31.5823 177.6207 19 C 4.2672 7.8708 115.2898 62.5963 29.0807 175.1606 20 G 3.4157 8.6405 112.7377 46.3890 0.0000 176.4999 21 E 3.9785 9.0287 119.1033 59.5354 29.8219 176.8362 22 R 3.9454 8.0343 116.5170 57.3805 29.4004 179.7836 23 G 3.9877 9.0403 104.2821 45.7327 0.0000 171.6212 24 F 4.8638 7.2447 111.9297 56.5666 39.8652 172.8119 25 F 4.5611 9.2039 119.3060 55.7149 41.0628 174.6603 26 Y 4.8433 8.7437 126.4992 56.3827 38.9763 175.1502 27 T 4.3263 7.9382 118.4545 58.8399 68.8524 172.2354 28 P 4.2307 0.0000 0.0000 63.4748 31.5644 176.9138 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 F 8.32 5.06 0.00 3.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.01 4.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 3 N 9.39 4.49 0.00 2.73 2.80 0.00 0.00 6.90 7.69 0.00 0.00 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 Q 8.45 4.43 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.24 0.00 5 H 8.53 4.83 0.00 3.03 3.18 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.34 4.78 0.00 1.62 1.58 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.18 4.97 0.00 2.94 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.47 3.76 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 0.00 0.00 0.00 9 S 8.51 4.07 0.00 3.89 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.98 4.14 0.00 3.28 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.81 3.92 0.00 1.89 1.89 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.33 3.43 2.07 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 0.93 0.00 0.00 0.63 0.00 0.00 13 E 8.54 3.97 0.00 2.28 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.20 0.00 14 A 8.07 4.00 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 15 L 7.99 3.64 0.00 1.29 0.13 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.65 4.03 0.00 3.11 3.14 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 17 L 7.69 3.91 0.00 1.76 1.65 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.56 3.69 1.99 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 0.82 0.00 0.00 0.92 0.00 0.00 19 C 7.87 4.27 0.00 3.16 3.26 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 0.00 20 G 8.64 3.42 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 0.00 21 E 9.03 3.98 0.00 2.00 1.89 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 2.23 1.89 0.00 22 R 8.03 3.95 0.00 1.82 1.91 0.00 3.30 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.22 0.00 23 G 9.04 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 24 F 7.24 4.86 0.00 3.27 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 9.20 4.56 0.00 3.01 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 26 Y 8.74 4.84 0.00 3.12 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 27 T 7.94 4.33 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 28 P 0.00 4.23 0.00 2.11 1.76 0.00 3.49 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00