NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3007 8.2649 123.5808 51.6126 19.9501 176.3475 2 T 3.7132 8.2613 117.0402 63.6413 69.0387 171.7306 3 L 4.7891 7.8748 124.0255 52.5267 45.8120 176.5310 4 T 4.1083 8.0990 110.6013 61.3799 70.7107 175.1302 5 A 3.9463 8.4583 122.9604 55.3096 18.3503 179.4391 6 E 3.8777 8.1346 117.1366 59.7958 29.8214 179.0365 7 Q 4.0472 7.9212 117.6145 58.7140 28.6787 178.7118 8 S 4.0880 8.3350 114.5480 61.5350 62.6120 176.0961 9 E 4.0259 8.2707 121.2491 59.4160 28.9280 179.2641 10 E 4.0557 8.0531 117.8813 59.3137 29.8521 178.8112 11 L 4.1476 8.0722 120.4087 58.4980 42.1090 178.5225 12 H 4.2082 8.5452 118.2048 59.0921 29.6987 177.1583 13 K 3.8891 8.0878 120.0429 59.8943 31.8419 178.7615 14 Y 3.9147 8.1773 116.8618 60.7326 37.7887 178.3836 15 V 3.6182 7.7092 118.9062 65.9209 31.7573 178.0170 16 I 3.6584 7.9725 119.9163 64.5908 37.0099 178.1648 17 D 4.4588 8.2860 119.8960 57.3037 40.5340 179.2194 18 G 3.6608 8.3230 106.3441 47.9978 0.0000 175.9691 19 T 3.9356 8.0859 118.1437 66.5867 68.3804 176.9852 20 R 3.9491 8.1774 119.9990 59.0089 30.0380 179.2680 21 V 3.5663 7.9456 118.1776 65.8967 31.4787 177.6516 22 F 3.8917 8.4034 120.4569 61.2932 39.1250 176.7196 23 L 4.1493 8.4700 120.1506 58.1666 41.9076 179.0427 24 G 3.6705 8.3011 105.6983 48.0204 0.0000 175.6419 25 L 3.9702 7.9364 121.5899 57.2811 41.5044 179.4931 26 A 3.9541 8.2069 121.1044 54.9865 18.2369 179.7523 27 L 3.9839 8.3420 118.0617 57.8922 41.6821 179.7504 28 V 3.6806 7.8246 117.9447 66.0395 31.4296 177.8820 29 A 4.0267 8.3357 120.6918 55.6530 18.1546 179.3869 30 H 4.2159 8.7391 115.0177 58.8343 28.7638 177.8310 31 F 4.3273 8.6566 122.6421 61.4146 39.2566 177.1606 32 L 3.8862 8.3696 118.4687 57.7240 41.2575 179.4736 33 A 4.0204 8.3498 120.8462 55.1174 18.1372 179.4004 34 F 4.2827 8.6565 118.6035 61.6987 39.4775 177.2486 35 S 3.7721 7.7211 113.6931 60.0070 62.7204 174.7646 36 A 4.5555 7.7015 121.1556 51.8679 18.5431 175.6643 37 T 4.7579 7.4012 112.4740 60.7817 72.0853 173.2945 38 P 4.1198 0.0000 0.0000 63.6507 31.7455 176.6627 39 W 4.5750 7.4510 128.5651 59.1126 30.7650 175.2941 40 L 3.1615 8.5968 122.8985 54.6688 38.8710 174.2117 41 H 4.4791 8.3372 121.9400 56.4268 29.3757 174.4003 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 A 8.26 4.30 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 2 T 8.26 3.71 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 3 L 7.87 4.79 0.00 1.59 1.55 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.10 4.11 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 5 A 8.46 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.13 3.88 0.00 2.05 1.97 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 2.39 2.42 0.00 7 Q 7.92 4.05 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 8 S 8.33 4.09 0.00 3.95 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 9 E 8.27 4.03 0.00 2.19 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 10 E 8.05 4.06 0.00 2.13 2.09 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 2.40 2.47 0.00 11 L 8.07 4.15 0.00 1.78 1.93 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.55 4.21 0.00 3.48 3.34 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.09 3.89 0.00 2.10 1.79 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.63 7.81 14 Y 8.18 3.91 0.00 3.27 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 15 V 7.71 3.62 2.06 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 1.02 0.00 0.00 1.00 0.00 0.00 16 I 7.97 3.66 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.00 0.89 0.00 0.00 17 D 8.29 4.46 0.00 2.61 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.32 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 19 T 8.09 3.94 4.38 0.00 0.00 0.00 0.00 0.00 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 20 R 8.18 3.95 0.00 2.05 1.98 0.00 3.11 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 21 V 7.95 3.57 2.28 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 1.02 0.00 0.00 1.02 0.00 0.00 22 F 8.40 3.89 0.00 3.32 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.47 4.15 0.00 1.95 1.91 0.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.30 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 25 L 7.94 3.97 0.00 1.61 1.59 0.84 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.21 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.34 3.98 0.00 1.88 1.76 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.82 3.68 2.24 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 1.08 0.00 0.00 0.99 0.00 0.00 29 A 8.34 4.03 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.74 4.22 0.00 3.56 3.63 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.66 4.33 0.00 3.23 3.32 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 32 L 8.37 3.89 0.00 1.94 1.72 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.35 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.66 4.28 0.00 2.97 3.32 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 35 S 7.72 3.77 0.00 3.71 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.70 4.56 1.20 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 0.00 0.00 37 T 7.40 4.76 4.68 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 1.48 0.00 0.00 38 P 0.00 4.12 0.00 2.24 2.11 0.00 3.67 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 2.13 2.07 0.00 39 W 7.45 4.58 0.00 3.26 3.23 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 40 L 8.60 3.16 0.00 1.55 1.49 -0.24 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.34 4.48 0.00 3.15 3.23 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00