NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4710 8.3049 118.1945 55.1719 31.6517 173.2757 2 K 4.8201 7.6799 124.6421 54.7320 39.8797 170.0452 3 V 4.4428 7.7755 133.7026 61.2057 33.2977 174.1997 4 R 4.7530 8.1395 122.7777 53.8103 33.4810 175.5240 5 A 4.5761 8.4884 119.3634 52.0941 18.8388 178.0421 6 S 4.3784 7.3743 112.1561 57.6188 63.0504 173.2427 7 V 3.9236 7.9208 125.8036 62.0691 32.2393 175.1763 8 K 4.6540 8.1123 123.4145 55.6627 36.2075 176.9231 9 R 4.5119 8.0172 117.7127 54.5861 29.4677 176.7897 10 I 4.0044 7.3576 123.4016 58.7490 35.2093 174.3264 11 C 4.2561 7.5599 114.2338 57.0729 30.9084 173.0465 12 D 4.6095 8.8413 115.9800 55.9520 40.0839 178.5654 13 K 4.0775 7.9946 116.2035 56.9500 32.0501 176.7606 14 C 4.6880 7.9351 117.9700 59.3675 28.9746 173.0742 15 K 4.6412 8.8956 123.0746 54.1615 35.3647 176.3326 16 V 4.5502 8.2717 123.2059 62.9827 32.2149 175.7324 17 I 3.8565 7.9568 118.7996 61.5789 38.0898 174.9490 18 R 5.3045 8.4723 121.9615 54.5399 31.8447 174.9735 19 R 4.4737 8.9405 117.1897 56.1468 32.4464 176.2717 20 H 3.9751 9.7280 113.2564 55.8480 27.5269 175.4751 21 G 4.0627 7.9471 105.4289 45.2259 0.0000 173.7065 22 R 4.7524 8.5719 119.2151 53.9128 33.6397 174.4962 23 V 4.2975 8.3682 120.5937 63.0759 32.2529 174.6266 24 Y 4.9589 8.4366 126.3289 56.9817 41.7948 174.8246 25 V 4.5282 8.2423 117.8235 63.0571 34.7088 173.3455 26 I 4.8123 8.4416 129.0496 60.4432 39.8752 174.1566 27 C 4.9642 8.4939 121.4092 58.8791 33.8038 173.2077 28 E 4.0239 9.2237 125.2748 58.9578 29.2524 176.8077 29 N 4.8345 7.8242 115.8137 50.1693 39.0610 173.8851 30 P 4.2455 0.0000 0.0000 65.5327 31.2257 178.0122 31 K 4.2181 7.6364 115.3136 57.5938 31.2509 176.9143 32 H 4.9159 8.0682 115.5935 55.1828 31.4700 172.2656 33 K 4.4938 8.2142 118.2841 55.9054 32.6107 175.9456 34 Q 4.7698 8.3232 126.1039 54.9881 31.0153 175.4753 35 R 3.7665 8.5443 116.3648 55.9692 32.5905 174.3493 36 Q 3.1952 8.3342 111.7803 57.9507 27.1272 173.9707 37 G 3.7254 9.1698 114.7422 46.3026 0.0000 172.2033 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 M 8.30 4.47 0.00 2.13 2.44 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 2 K 7.68 4.82 0.00 1.71 1.60 0.00 1.86 0.00 0.00 2.02 0.00 0.00 2.82 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.27 7.81 3 V 7.78 4.44 2.04 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 0.80 0.00 0.00 0.87 0.00 0.00 4 R 8.14 4.75 0.00 1.85 1.97 0.00 2.98 0.00 0.00 3.39 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 5 A 8.49 4.58 1.27 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 0.00 0.00 0.00 6 S 7.37 4.38 0.00 3.77 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 7 V 7.92 3.92 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 0.85 0.00 0.00 0.90 0.00 0.00 8 K 8.11 4.65 0.00 1.69 1.66 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.37 7.81 9 R 8.02 4.51 0.00 1.76 1.85 0.00 3.22 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 10 I 7.36 4.00 1.51 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.27 0.84 0.00 0.00 11 C 7.56 4.26 0.00 3.18 3.27 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 0.00 12 D 8.84 4.61 0.00 2.85 2.95 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 13 K 7.99 4.08 0.00 1.79 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 14 C 7.94 4.69 0.00 2.99 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 15 K 8.90 4.64 0.00 1.66 1.66 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.35 7.81 16 V 8.27 4.55 2.10 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 0.81 0.00 0.00 0.94 0.00 0.00 17 I 7.96 3.86 1.88 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 1.40 0.99 0.84 0.00 0.00 18 R 8.47 5.30 0.00 1.81 1.89 0.00 3.06 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 19 R 8.94 4.47 0.00 1.84 1.83 0.00 2.29 0.00 0.00 2.85 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.98 0.00 20 H 9.73 3.98 0.00 3.27 3.52 0.00 5.87 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.95 4.06 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 0.00 0.00 0.00 22 R 8.57 4.75 0.00 2.27 1.89 0.00 3.35 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 23 V 8.37 4.30 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 0.82 0.00 0.00 0.97 0.00 0.00 24 Y 8.44 4.96 0.00 2.89 2.88 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 25 V 8.24 4.53 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 0.91 0.00 0.00 0.96 0.00 0.00 26 I 8.44 4.81 1.89 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 1.16 0.67 0.93 0.00 0.00 27 C 8.49 4.96 0.00 3.00 2.78 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 28 E 9.22 4.02 0.00 1.96 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 0.00 2.30 2.29 0.00 29 N 7.82 4.83 0.00 2.87 2.86 0.00 0.00 5.85 7.76 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 30 P 0.00 4.25 0.00 2.23 2.38 0.00 3.67 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 2.06 2.01 0.00 31 K 7.64 4.22 0.00 1.79 1.89 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.40 7.81 32 H 8.07 4.92 0.00 2.97 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.21 4.49 0.00 1.72 1.87 0.00 1.95 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.35 7.81 34 Q 8.32 4.77 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.13 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 35 R 8.54 3.77 0.00 1.27 1.52 0.00 3.14 0.00 0.00 2.85 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.50 0.00 36 Q 8.33 3.20 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 37 G 9.17 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00