NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.4505 8.4244 118.1258 53.8805 39.9110 170.8337 2 E 3.3662 8.7215 128.0369 55.1989 28.6093 172.2759 3 K 4.2226 8.8983 127.8559 58.2122 34.0061 176.3237 4 S 4.6653 8.0325 108.7987 59.1564 67.5398 173.8286 5 G 4.2334 7.6143 108.0883 45.4674 0.0000 172.2220 6 S 4.5260 8.9649 119.9222 57.7771 67.2641 171.2088 7 C 4.7745 8.7513 120.8453 56.2758 44.3956 173.6046 8 P 4.5215 0.0000 0.0000 61.3961 30.1036 173.2174 9 D 4.4061 8.3123 125.1574 56.0736 40.5742 174.1265 10 M 4.7848 8.8533 125.5946 56.1398 40.3398 176.8597 11 S 4.4369 8.2264 110.4719 59.0415 60.4844 173.4619 12 M 4.0905 7.4915 120.8751 57.8757 32.2118 174.7046 13 P 4.2793 0.0000 0.0000 62.6598 31.7530 175.7075 14 I 4.2918 8.0841 124.0093 58.1748 38.7693 173.3778 15 P 4.3597 0.0000 0.0000 61.9879 30.9916 174.8770 16 P 4.3389 0.0000 0.0000 64.8443 31.8126 176.8956 17 L 4.0692 7.8356 119.7243 54.7716 42.3955 177.7361 18 G 3.8579 8.3613 112.5106 45.6812 0.0000 171.7668 19 I 4.5166 7.7525 122.9427 59.9178 39.3198 175.7097 20 C 5.2904 8.4018 125.4824 53.4696 43.3648 172.4104 21 K 4.3578 7.8629 120.2908 55.0337 34.5005 175.3236 22 T 3.7820 8.3189 121.9269 62.6959 67.9723 171.4134 23 L 4.5553 8.1512 120.1006 56.4759 47.1384 174.0736 24 C 4.8549 7.9237 112.6295 53.3080 43.6826 172.6928 25 N 4.5289 8.1459 116.7409 53.2963 40.3586 173.7652 26 S 4.5749 7.4607 111.8256 58.6854 66.8963 176.6341 27 D 4.3680 8.4335 120.1277 57.9403 40.6418 178.9642 28 S 4.2310 8.0586 111.1814 60.6098 63.2798 175.5317 29 G 3.7023 8.0550 110.5091 48.2920 0.0000 173.9464 30 C 4.4537 7.6897 116.9909 55.8477 41.8410 172.0533 31 P 4.4808 0.0000 0.0000 62.3275 33.3036 176.9660 32 N 4.2286 8.7390 115.5873 53.9668 37.8375 175.6136 33 V 4.4141 7.9259 116.5120 62.1511 32.8488 174.6152 34 Q 4.5596 8.2669 120.1570 56.0734 29.8088 175.9248 35 K 4.3647 8.5899 122.0428 55.8552 34.3374 175.4170 36 C 5.0818 8.6824 123.5886 55.7663 40.5946 172.4694 37 C 4.9494 8.8317 126.9823 54.9599 47.6342 172.2731 38 K 5.1947 8.6255 120.4206 53.3841 32.1011 176.1178 39 N 5.1922 7.8865 127.5321 50.5048 41.1071 173.9170 40 G 3.9226 7.6037 116.2816 46.1994 0.0000 173.5587 41 C 4.3353 7.2914 118.3300 56.1065 43.9148 172.5507 42 G 3.6750 7.7359 104.0012 45.3064 0.0000 173.2504 43 F 5.0394 6.8902 114.8910 55.0937 41.9880 173.7357 44 M 4.7400 8.5358 117.9504 54.5126 32.5208 175.5288 45 T 4.6767 8.6933 118.9676 60.0738 71.2380 171.6725 46 C 5.1840 8.5397 120.1363 56.5479 37.8234 173.1608 47 T 4.7097 8.7186 116.2698 60.6686 71.5538 172.3411 48 T 4.5754 8.4059 120.0956 62.3557 69.2000 173.3125 49 P 4.6838 0.0000 0.0000 62.7572 32.3808 175.7744 50 V 4.5088 8.3014 123.8084 58.8788 33.9970 174.3431 51 P 4.4053 0.0000 0.0000 63.1142 31.2866 176.0343 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 N 8.42 4.45 0.00 2.73 2.82 0.00 0.00 6.88 6.78 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 2 E 8.72 3.37 0.00 2.17 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 0.00 2.19 2.36 0.00 3 K 8.90 4.22 0.00 2.13 1.80 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.38 1.41 7.81 4 S 8.03 4.67 0.00 3.80 3.77 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 0.00 0.00 0.00 5 G 7.61 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.96 4.53 0.00 3.75 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 7 C 8.75 4.77 0.00 2.99 2.98 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 8 P 0.00 4.52 0.00 2.12 2.08 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 9 D 8.31 4.41 0.00 2.64 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 10 M 8.85 4.78 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 11 S 8.23 4.44 0.00 4.01 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 12 M 7.49 4.09 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 13 P 0.00 4.28 0.00 2.23 2.07 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 14 I 8.08 4.29 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.80 0.89 0.00 0.00 15 P 0.00 4.36 0.00 2.22 2.14 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 16 P 0.00 4.34 0.00 2.20 2.22 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 17 L 7.84 4.07 0.00 1.62 1.65 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.36 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.75 4.52 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 1.00 0.00 0.00 20 C 8.40 5.29 0.00 2.94 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 21 K 7.86 4.36 0.00 1.70 1.53 0.00 1.81 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.35 7.81 22 T 8.32 3.78 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 1.21 0.00 0.00 23 L 8.15 4.56 0.00 1.66 1.57 0.86 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 24 C 7.92 4.85 0.00 3.09 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 25 N 8.15 4.53 0.00 2.67 2.83 0.00 0.00 6.90 7.64 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 26 S 7.46 4.57 0.00 3.89 3.75 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 27 D 8.43 4.37 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.06 4.23 0.00 4.01 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 29 G 8.05 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 30 C 7.69 4.45 0.00 3.16 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 31 P 0.00 4.48 0.00 2.21 2.20 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 32 N 8.74 4.23 0.00 2.84 2.71 0.00 0.00 6.63 7.68 0.00 0.00 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 V 7.93 4.41 2.08 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 0.61 0.00 0.00 0.93 0.00 0.00 34 Q 8.27 4.56 0.00 1.97 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 35 K 8.59 4.36 0.00 1.79 1.72 0.00 1.82 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.60 7.81 36 C 8.68 5.08 0.00 3.10 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 37 C 8.83 4.95 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.63 5.19 0.00 1.80 1.70 0.00 1.57 0.00 0.00 2.31 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.24 1.44 7.81 39 N 7.89 5.19 0.00 2.75 2.69 0.00 0.00 6.73 7.68 0.00 0.00 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 7.60 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.29 4.34 0.00 2.89 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.74 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.89 5.04 0.00 3.02 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.54 4.74 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 45 T 8.69 4.68 4.07 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 1.50 0.00 0.00 46 C 8.54 5.18 0.00 2.89 2.99 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 47 T 8.72 4.71 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 1.27 0.00 0.00 48 T 8.41 4.58 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 49 P 0.00 4.68 0.00 2.07 2.06 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.11 0.00 50 V 8.30 4.51 2.08 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 0.86 0.00 0.00 0.93 0.00 0.00 51 P 0.00 4.41 0.00 2.20 2.08 0.00 3.80 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 1.99 1.96 0.00