NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 E 4.3569 8.4449 116.7540 55.8261 31.5142 174.2525 11 I 4.3288 7.9524 117.0621 59.0218 39.0486 174.8452 12 S 4.4364 8.8342 121.9693 57.0255 65.1248 173.2949 13 A 4.2109 8.1566 123.6506 51.0950 18.7120 175.8399 14 P 4.5044 0.0000 0.0000 62.7776 32.0774 175.5202 15 S 4.6744 7.7893 113.1804 57.1934 66.3191 172.5164 16 N 4.1892 8.8284 114.2791 53.7176 35.6537 175.0381 17 F 4.2094 8.4375 118.7557 58.7039 40.1059 173.7766 18 E 4.1525 7.6321 125.7894 54.6280 32.8219 175.1860 19 H 4.3953 8.1263 123.1760 54.9069 29.0758 174.7083 20 R 4.0539 8.3183 125.6405 57.8635 30.5227 177.6506 21 V 4.2663 7.4798 115.0088 61.0295 34.1777 174.2250 22 H 4.7469 8.5345 124.9797 54.8112 31.1763 172.0318 23 T 4.7748 8.3453 123.5380 62.4905 70.2313 174.5348 24 G 4.4771 9.2128 112.2846 44.5823 0.0000 170.6315 25 F 5.2347 8.6739 120.5454 56.5278 42.7529 173.6822 26 D 4.6309 8.1420 126.3545 52.7589 41.9015 177.1426 27 Q 4.0740 8.7339 125.7231 58.9034 29.4449 177.3187 28 H 4.1579 8.6710 116.8675 59.3272 28.6445 176.6802 29 E 4.3893 7.9909 110.9026 54.7984 30.4248 177.2957 30 Q 3.3443 7.4427 115.5375 58.1008 26.9853 173.5229 31 K 4.6175 6.6601 114.1832 54.2849 36.5967 176.7531 32 F 5.0917 8.8501 121.3162 57.8019 40.1041 174.9263 33 T 4.5802 8.7537 111.1794 60.3061 72.2543 173.9859 34 G 4.0811 8.8436 109.9694 46.6835 0.0000 174.0374 35 L 4.1519 7.9561 118.2325 53.0916 42.6946 175.5530 36 P 3.9202 0.0000 0.0000 63.7226 31.7130 178.3690 37 R 4.2644 8.6529 127.5594 61.5365 28.7578 177.6316 38 Q 4.3251 8.0448 120.2049 60.4915 28.0857 181.7782 39 W 4.3475 8.1515 120.6756 59.0983 28.5403 178.4902 40 Q 4.2048 7.8570 118.9163 59.0234 27.9681 178.7433 41 S 4.4690 7.6086 112.4112 59.7562 63.6003 175.5739 42 L 4.3270 8.1877 122.4279 55.6474 42.1782 176.3946 43 I 4.5599 7.1890 118.4432 60.2777 41.0064 174.5735 44 E 4.4736 8.8413 120.6422 56.1092 30.3006 176.0647 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 10 E 8.44 4.36 0.00 2.01 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.91 0.00 11 I 7.95 4.33 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 1.47 1.19 0.92 0.00 0.00 12 S 8.83 4.44 0.00 3.98 3.88 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 13 A 8.16 4.21 1.26 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 0.00 0.00 14 P 0.00 4.50 0.00 2.24 2.10 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 15 S 7.79 4.67 0.00 3.95 3.85 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 16 N 8.83 4.19 0.00 2.88 2.94 0.00 0.00 6.81 7.45 0.00 0.00 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 F 8.44 4.21 0.00 2.96 2.97 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 18 E 7.63 4.15 0.00 1.95 1.59 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 2.20 1.83 0.00 19 H 8.13 4.40 0.00 3.08 3.17 0.00 5.74 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.32 4.05 0.00 1.76 1.87 0.00 3.20 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 21 V 7.48 4.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.75 0.00 0.00 22 H 8.53 4.75 0.00 2.93 3.13 0.00 5.96 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.35 4.77 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 24 G 9.21 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.67 5.23 0.00 2.93 2.87 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 26 D 8.14 4.63 0.00 2.64 2.31 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.73 4.07 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 28 H 8.67 4.16 0.00 3.37 3.33 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.99 4.39 0.00 2.01 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 30 Q 7.44 3.34 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.64 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 31 K 6.66 4.62 0.00 1.48 1.59 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.54 7.81 32 F 8.85 5.09 0.00 3.07 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.75 4.58 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 34 G 8.84 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.96 4.15 0.00 1.70 1.67 1.09 1.18 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 36 P 0.00 3.92 0.00 0.84 1.30 0.00 2.96 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.35 0.00 37 R 8.65 4.26 0.00 1.81 1.95 0.00 3.34 0.00 0.00 3.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.13 0.00 38 Q 8.04 4.33 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.04 0.00 39 W 8.15 4.35 0.00 3.42 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.86 4.20 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 41 S 7.61 4.47 0.00 4.00 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 42 L 8.19 4.33 0.00 1.71 1.68 0.99 0.72 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 43 I 7.19 4.56 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.69 0.97 0.00 0.00 44 E 8.84 4.47 0.00 1.99 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.83 0.00