NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.5346 8.3349 116.8082 58.6100 63.5202 172.8039 8 D 4.8018 8.0849 124.1946 52.3998 42.3795 174.0648 9 F 5.3292 8.5162 115.0753 55.5027 41.8662 173.1786 10 V 4.3374 9.0674 119.9176 61.0861 34.3874 174.2689 11 V 4.5221 8.8360 127.8974 61.6255 33.3919 174.4323 12 I 4.8720 8.9228 128.8610 59.4672 40.4025 174.2481 13 K 5.0216 9.2649 129.6232 54.2512 34.3105 175.1211 14 A 4.3851 8.8434 130.6838 52.3733 18.8118 177.5271 15 L 4.7295 8.6935 122.5917 55.0509 42.9494 175.8406 16 E 4.8179 7.7852 115.2619 54.3353 33.2516 174.7853 17 D 4.5010 8.6557 119.4488 55.4298 41.3775 176.6820 18 G 3.8326 8.7638 110.0948 46.3146 0.0000 173.8610 19 V 3.9255 8.0123 120.3903 62.6392 32.9075 174.3859 20 N 5.3383 9.2178 125.3837 51.4869 41.2436 173.7568 21 V 4.6827 8.6903 124.1434 61.4135 33.7221 174.0926 22 I 4.6136 8.9964 130.0107 59.4504 39.7053 174.9797 23 G 4.4105 9.3622 114.9747 44.7584 0.0000 172.6158 24 L 5.6680 9.6248 126.2003 53.0240 44.0123 176.0772 25 T 4.7176 8.4187 112.7955 61.1606 70.5238 173.7811 26 R 4.3063 7.8169 126.4740 55.2910 30.7707 176.4032 27 G 4.1090 8.9180 111.9526 43.0957 0.0000 172.5126 28 A 4.1070 8.4307 122.8839 54.2485 18.3788 177.6208 29 D 5.0304 7.8012 112.5653 51.6812 42.0948 175.4291 30 T 4.7622 8.5341 116.3060 60.7647 71.3794 173.2889 31 R 4.5264 8.3926 121.7389 53.9110 33.9404 174.6196 32 F 5.2122 8.4397 118.5492 57.9057 38.1792 175.0133 33 H 4.7152 9.0908 121.1617 57.7803 29.7508 175.4492 34 H 4.7360 7.5944 117.1284 54.8006 33.3166 172.0923 35 S 4.9407 8.2168 119.5388 56.4600 64.5621 172.4445 36 E 4.6051 9.4597 128.9260 54.6554 31.7275 174.1445 37 K 4.9340 8.5032 126.3466 54.6733 34.4964 175.1766 38 L 4.7421 9.0945 126.7567 53.1758 44.9972 175.4147 39 D 4.9559 8.4903 124.1233 52.6368 43.0519 176.0737 40 K 4.2743 8.4527 122.0678 58.1985 32.0265 176.6043 41 G 3.9761 9.3552 115.7993 44.9491 0.0000 172.6519 42 E 4.4087 8.1336 120.0799 55.5766 31.0860 175.5219 43 V 4.9145 8.3285 123.1322 61.0415 33.9296 174.3202 44 L 4.7757 9.1275 129.4399 53.2982 44.9514 174.7625 45 I 4.9775 8.5210 126.6004 59.6519 39.0571 174.8018 46 A 4.7142 9.0314 129.0163 50.1595 21.8780 174.8750 47 Q 4.8468 8.6836 121.4720 54.8606 30.3887 175.8309 48 F 4.6254 8.6372 122.3719 57.8366 39.6492 174.9094 49 T 4.7801 9.2612 113.3751 59.2764 72.0761 173.2417 50 E 4.0123 9.0398 121.4748 59.6386 29.4503 177.4222 51 H 4.6353 8.2143 113.1218 56.1730 29.8723 174.1716 52 T 5.3001 7.8765 116.9069 61.7109 71.1650 174.2985 53 S 5.0556 9.0116 119.0149 57.7090 65.0917 173.3330 54 A 5.0150 8.0738 122.0472 51.2265 22.5089 175.2422 55 I 4.8448 8.7668 123.0884 59.2977 39.7667 174.9132 56 K 4.5622 9.2305 128.2896 54.4981 34.8874 174.6125 57 V 4.7104 8.4903 127.1886 61.3928 33.2841 174.5305 58 R 4.4733 9.3299 128.2602 55.6232 32.0516 177.3687 59 G 4.1709 9.0409 108.9539 44.8976 0.0000 172.8811 60 K 3.9851 9.0466 119.7129 57.1473 32.8906 175.9327 61 A 5.0808 8.4517 125.0301 50.9563 22.5646 174.2392 62 Y 4.6020 9.5038 122.4922 56.2209 40.7794 174.4877 63 I 4.9806 7.6821 126.3917 59.4816 41.0330 174.1845 64 Q 4.7022 8.9132 125.5117 54.3265 32.0374 174.6229 65 T 4.7017 8.6810 117.4032 59.7469 71.2401 174.4337 66 R 3.8442 8.5850 123.3502 59.0751 29.9630 176.5322 67 H 4.7671 8.0635 113.2862 55.4587 30.3325 174.9028 68 G 4.2000 7.6185 105.8824 43.8527 0.0000 174.7796 69 V 4.3554 8.1685 124.4836 62.2845 30.9686 173.5587 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 7 S 8.33 4.53 0.00 3.94 3.97 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 8 D 8.08 4.80 0.00 2.88 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 9 F 8.52 5.33 0.00 3.06 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.07 4.34 1.90 0.00 0.00 0.00 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 0.60 0.00 0.00 11 V 8.84 4.52 2.21 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 1.10 0.00 0.00 1.10 0.00 0.00 12 I 8.92 4.87 1.87 0.00 0.00 0.83 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 0.35 0.91 0.00 0.00 13 K 9.26 5.02 0.00 1.87 1.87 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.38 7.81 14 A 8.84 4.39 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 15 L 8.69 4.73 0.00 1.70 1.74 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.79 4.82 0.00 1.90 1.88 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 2.35 2.32 0.00 17 D 8.66 4.50 0.00 2.69 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 8.76 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.01 3.93 2.21 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 0.87 0.00 0.00 1.06 0.00 0.00 20 N 9.22 5.34 0.00 2.63 2.58 0.00 0.00 6.22 7.22 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 21 V 8.69 4.68 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.90 0.00 0.00 22 I 9.00 4.61 1.46 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.08 0.02 0.00 0.00 23 G 9.36 4.41 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 0.00 24 L 9.62 5.67 0.00 1.81 1.69 1.29 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.42 4.72 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 1.39 0.00 0.00 26 R 7.82 4.31 0.00 1.89 1.97 0.00 3.33 0.00 0.00 3.06 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.42 0.00 27 G 8.92 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.43 4.11 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.80 5.03 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.53 4.76 4.20 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 1.22 0.00 0.00 31 R 8.39 4.53 0.00 1.76 1.93 0.00 2.98 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 32 F 8.44 5.21 0.00 2.97 2.91 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 0.00 0.00 0.00 33 H 9.09 4.72 0.00 3.21 3.52 0.00 5.78 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 34 H 7.59 4.74 0.00 3.21 2.94 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.22 4.94 0.00 3.66 3.54 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.46 4.61 0.00 2.14 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 2.24 2.28 0.00 37 K 8.50 4.93 0.00 1.75 1.64 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.56 7.81 38 L 9.09 4.74 0.00 1.53 1.52 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.49 4.96 0.00 2.61 2.70 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 40 K 8.45 4.27 0.00 1.73 1.74 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.47 7.81 41 G 9.36 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 0.00 0.00 0.00 42 E 8.13 4.41 0.00 2.17 1.87 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 2.30 2.25 0.00 43 V 8.33 4.91 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 0.96 0.00 0.00 44 L 9.13 4.78 0.00 1.72 1.46 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.52 4.98 1.85 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 1.34 0.68 1.00 0.00 0.00 46 A 9.03 4.71 1.13 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 47 Q 8.68 4.85 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.87 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 48 F 8.64 4.63 0.00 3.03 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 49 T 9.26 4.78 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 1.32 0.00 0.00 50 E 9.04 4.01 0.00 1.96 1.94 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 2.25 2.36 0.00 51 H 8.21 4.64 0.00 3.24 3.27 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.88 5.30 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 1.42 0.00 0.00 53 S 9.01 5.06 0.00 3.80 4.03 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 0.00 0.00 0.00 54 A 8.07 5.02 1.33 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 0.00 0.00 0.00 55 I 8.77 4.84 1.82 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.85 0.00 0.00 56 K 9.23 4.56 0.00 1.79 1.54 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.41 7.81 57 V 8.49 4.71 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 0.85 0.00 0.00 0.90 0.00 0.00 58 R 9.33 4.47 0.00 1.68 1.78 0.00 3.04 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 59 G 9.04 4.17 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 0.00 0.00 0.00 60 K 9.05 3.99 0.00 1.87 1.81 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.43 7.81 61 A 8.45 5.08 1.25 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 0.00 0.00 0.00 62 Y 9.50 4.60 0.00 3.07 2.93 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 63 I 7.68 4.98 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.71 0.80 0.00 0.00 64 Q 8.91 4.70 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 65 T 8.68 4.70 4.14 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 1.17 0.00 0.00 66 R 8.59 3.84 0.00 1.82 1.83 0.00 3.28 0.00 0.00 3.49 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 67 H 8.06 4.77 0.00 3.13 3.27 0.00 5.68 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 68 G 7.62 4.20 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 0.00 69 V 8.17 4.36 1.93 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 0.96 0.00 0.00 0.64 0.00 0.00