NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3081 8.1631 117.3743 62.9162 68.9951 173.4682 2 G 3.4795 8.4748 115.3798 45.2900 0.0000 172.5880 3 A 4.1444 8.1837 125.7108 53.0439 21.1886 176.1906 4 G 4.3733 7.0604 109.9173 44.6877 0.0000 175.9303 5 T 3.8934 9.1308 122.1299 65.9133 68.5024 173.9467 6 P 4.2411 0.0000 0.0000 65.7642 31.1448 177.7049 7 S 4.5254 8.1966 113.2875 59.3615 62.7155 175.4745 8 Q 4.2780 8.2102 120.1846 57.2417 28.9153 178.3220 9 G 3.6623 7.5419 105.5737 48.0793 0.0000 174.6551 10 K 4.3436 7.9719 117.0195 56.6423 32.1909 178.0621 11 K 4.4082 7.3573 120.4761 55.0490 30.2580 176.0830 12 N 5.0730 7.9927 120.0562 52.5112 38.3436 174.9867 13 T 4.4789 7.9251 114.9102 63.1275 70.2208 174.3252 14 T 4.3562 8.3845 123.1968 62.7658 69.0535 172.6574 15 T 4.3010 7.5650 115.1640 63.0424 71.3290 172.9594 16 H 4.8716 8.0472 119.3461 55.1247 30.0244 174.6619 17 T 4.8188 9.5995 113.8511 59.0085 72.9874 172.9847 18 K 4.2832 8.8147 122.9339 57.5184 32.6910 175.3934 19 C 4.2774 9.3841 128.8214 58.7215 32.2484 174.3204 20 R 3.7228 8.4494 126.5348 59.3620 30.0284 177.5488 21 R 3.7036 7.2525 116.6831 58.2356 30.1634 176.3924 22 C 4.4774 8.0069 109.2164 57.4075 31.1083 174.6833 23 G 3.9357 8.1795 108.7760 45.0772 0.0000 173.4741 24 E 4.2405 7.6928 119.0932 55.2386 31.0877 176.5097 25 K 4.6547 8.1921 124.8407 55.9132 29.8165 176.4809 26 S 4.7629 7.8771 114.0258 57.8136 66.7310 174.1127 27 Y 4.5967 8.8867 123.7354 57.2705 39.4328 174.3455 28 H 4.4317 8.8895 128.9326 56.0186 29.7337 175.6035 29 T 3.6490 8.8962 122.1244 64.1709 67.0332 175.2981 30 K 4.2023 8.1474 119.6188 58.9552 32.6646 177.9357 31 K 4.0618 7.9553 115.7472 56.0516 32.6511 176.4551 32 K 3.2565 8.4938 118.4855 56.7544 30.0070 175.4527 33 V 4.6626 6.6756 116.4144 61.3302 35.0007 172.7629 34 C 5.0666 9.3983 128.4049 58.5314 32.0282 174.3012 35 S 4.4359 8.8011 121.9518 60.1003 63.3405 175.1822 36 S 4.4889 8.2922 115.4120 60.2261 62.8537 174.2748 37 C 4.4933 8.2290 112.5584 57.5976 30.6102 175.0267 38 G 3.9859 8.4636 109.8483 44.9217 0.0000 173.1884 39 F 4.4823 8.1469 122.4632 60.1275 39.6003 175.5220 40 G 3.9495 8.7826 115.4200 45.9391 0.0000 173.5809 41 K 4.3475 8.2439 118.9039 57.0636 33.9347 176.1136 42 S 4.6847 7.7581 110.4868 56.0341 65.2393 173.3684 43 A 4.1890 8.7674 130.2130 55.1258 18.4852 178.5140 44 K 4.2395 7.3939 113.3031 56.2185 32.7304 176.9181 45 R 4.3691 8.1859 120.4318 55.6673 30.8978 176.6100 46 R 3.8569 8.6887 125.2093 56.8300 30.5853 175.2821 47 D 4.4278 7.3879 122.0478 53.9140 44.2816 174.2666 48 Y 4.5472 8.5675 121.8841 55.9454 41.9558 176.5024 49 E 3.9944 8.6151 121.9780 58.9143 29.8137 178.7089 50 W 4.5908 7.6434 113.4137 57.5591 28.4266 176.7336 51 Q 4.3288 7.5117 117.8255 57.3018 28.3118 175.4290 52 S 4.7507 7.5855 111.8024 56.0232 66.5841 173.9210 53 K 4.1142 8.4712 119.6142 56.2013 32.4940 177.9811 54 A 4.0039 8.9371 125.6180 55.4506 18.1634 179.1437 55 G 4.1315 7.8657 101.9710 45.1252 0.0000 173.2515 56 E 4.1937 8.0844 126.6835 56.2703 29.8784 174.4460 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 T 8.16 4.31 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 2 G 8.47 3.48 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 3 A 8.18 4.14 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 4 G 7.06 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.13 3.89 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 6 P 0.00 4.24 0.00 2.21 2.31 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.99 0.00 7 S 8.20 4.53 0.00 4.21 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.21 4.28 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 9 G 7.54 3.66 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 0.00 0.00 0.00 10 K 7.97 4.34 0.00 1.76 1.85 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.45 7.81 11 K 7.36 4.41 0.00 1.88 1.77 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.44 1.37 7.81 12 N 7.99 5.07 0.00 2.77 2.83 0.00 0.00 6.27 7.71 0.00 0.00 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 T 7.93 4.48 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 14 T 8.38 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 15 T 7.57 4.30 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 16 H 8.05 4.87 0.00 3.08 3.48 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.60 4.82 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 1.32 0.00 0.00 18 K 8.81 4.28 0.00 1.80 1.82 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.52 7.81 19 C 9.38 4.28 0.00 3.17 2.89 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 20 R 8.45 3.72 0.00 1.58 1.55 0.00 3.21 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 21 R 7.25 3.70 0.00 0.67 1.33 0.00 3.21 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 22 C 8.01 4.48 0.00 3.07 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 23 G 8.18 3.94 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 0.00 0.00 0.00 24 E 7.69 4.24 0.00 1.95 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 2.40 2.27 0.00 25 K 8.19 4.65 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.52 7.81 26 S 7.88 4.76 0.00 3.87 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 27 Y 8.89 4.60 0.00 3.11 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.89 4.43 0.00 3.19 3.08 0.00 5.84 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.90 3.65 4.28 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 1.18 0.00 0.00 30 K 8.15 4.20 0.00 1.87 1.85 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.44 7.81 31 K 7.96 4.06 0.00 1.55 1.72 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.49 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.20 0.89 7.81 32 K 8.49 3.26 0.00 1.83 1.88 0.00 1.78 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.50 7.81 33 V 6.68 4.66 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.95 0.00 0.00 34 C 9.40 5.07 0.00 3.41 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 35 S 8.80 4.44 0.00 4.12 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 36 S 8.29 4.49 0.00 3.91 3.98 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 0.00 0.00 0.00 37 C 8.23 4.49 0.00 3.15 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.46 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 39 F 8.15 4.48 0.00 3.04 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.78 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.24 4.35 0.00 1.68 2.03 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.35 7.81 42 S 7.76 4.68 0.00 3.83 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.77 4.19 1.31 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 0.00 0.00 44 K 7.39 4.24 0.00 1.75 1.72 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.40 7.81 45 R 8.19 4.37 0.00 1.65 1.81 0.00 3.36 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 46 R 8.69 3.86 0.00 1.90 1.97 0.00 3.45 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 47 D 7.39 4.43 0.00 2.48 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.57 4.55 0.00 1.43 1.55 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 49 E 8.62 3.99 0.00 2.05 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 2.38 2.26 0.00 50 W 7.64 4.59 0.00 3.48 3.21 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 0.00 51 Q 7.51 4.33 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.10 1.38 0.00 52 S 7.59 4.75 0.00 3.89 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.47 4.11 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.94 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 55 G 7.87 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.08 4.19 0.00 1.93 1.77 0.00 0.00 0.00 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 2.25 0.00