NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2894 8.2644 123.5821 52.0717 19.7629 175.6849 2 V 4.3125 7.9831 121.6652 58.5467 34.8716 172.8235 3 Q 4.2664 8.6097 121.5134 56.2862 29.9573 175.1914 4 Q 4.5677 8.1377 116.0804 55.5133 30.1315 174.4751 5 N 4.5962 7.5982 111.0161 52.4827 42.3935 173.9292 6 K 4.0054 8.6705 123.6978 55.8189 31.9286 174.3315 7 P 4.1428 0.0000 0.0000 63.0148 31.3432 176.9559 8 T 3.9820 8.5543 117.9525 62.1155 69.2390 174.2216 9 R 3.9011 8.5335 121.8206 59.5106 29.3313 178.4666 10 S 4.0188 8.1612 113.3255 61.1982 62.0018 175.5891 11 K 3.7396 8.0887 120.2919 60.1789 32.0039 177.5903 12 R 3.9486 7.8099 118.0917 59.8229 29.9048 177.9630 13 G 3.8715 8.1804 104.4846 48.5671 0.0000 175.0077 14 M 4.0545 7.9845 121.1976 58.2381 31.7076 178.9514 15 R 4.0009 8.0453 118.1446 58.8858 30.6497 177.7132 16 R 4.7036 8.0724 117.7817 55.3683 29.8872 178.2759 17 S 4.1376 7.4785 114.8263 61.9876 63.0136 175.8023 18 H 4.4054 7.9064 118.0736 57.2942 28.7366 176.6192 19 D 4.6316 7.6381 120.4507 54.2514 39.9427 175.7164 20 A 4.6128 7.6740 120.3722 50.2951 21.6626 177.0577 21 L 4.4245 8.0866 119.5265 54.2643 42.9476 176.2443 22 T 4.7138 7.9047 113.3679 59.9054 70.9405 176.1612 23 A 4.6747 8.0463 131.7271 51.8000 17.1285 179.7877 24 V 4.4106 8.1009 107.9551 62.0989 34.8032 175.2799 25 T 3.5067 8.7708 108.6763 62.1201 67.3845 169.1598 26 S 3.9893 7.3999 121.6391 58.5534 65.5164 171.3566 27 L 4.7819 7.9016 123.0432 55.6058 42.0357 176.3821 28 S 4.7965 9.0462 111.2131 57.1230 66.2035 173.0591 29 V 5.0100 8.2587 122.5048 59.8096 33.8920 174.7521 30 D 4.5630 8.3682 121.8883 54.0044 41.5977 176.6352 31 K 4.1868 8.6157 122.7274 59.5889 32.9741 178.9721 32 T 4.1009 8.2252 115.4737 65.8121 68.6899 174.3979 33 S 4.7755 7.6146 113.2654 56.0580 66.3470 174.4451 34 G 3.7508 8.2624 110.0805 45.3423 0.0000 174.8133 35 E 4.1758 7.6060 119.2657 54.9357 31.0627 177.7990 36 K 4.5636 8.7179 127.7843 56.2867 32.0740 175.0808 37 H 5.1376 9.3376 122.7514 52.9020 32.7236 172.3508 38 L 4.4338 8.2776 120.3535 54.3463 43.2000 176.2854 39 R 3.9131 8.5550 124.6314 58.5895 30.3874 176.6674 40 H 4.9771 10.8414 117.6626 56.9749 26.4518 174.3046 41 H 4.1309 8.2750 113.1945 54.8729 31.2658 174.0582 42 I 3.3434 6.7659 121.0586 59.4142 37.1385 175.0862 43 T 4.4764 8.5608 114.0558 60.1075 70.7138 175.2587 44 A 4.2037 8.5585 123.3715 54.4383 18.3595 177.8082 45 D 4.8844 8.3117 112.4097 52.7835 40.5436 176.1007 46 G 4.3431 8.0137 107.6604 46.9911 0.0000 173.3264 47 Y 4.9158 8.9307 118.1538 56.6429 42.0639 176.2013 48 Y 5.1520 8.2025 128.1228 58.3560 45.9801 176.6915 49 R 4.2430 8.2404 114.2491 55.4545 30.1759 175.8512 50 G 4.4338 7.7405 111.7458 43.8444 0.0000 173.5075 51 R 3.4024 8.3860 122.6051 58.0064 29.5063 176.8365 52 K 4.0858 7.5993 112.4871 57.4366 33.3396 175.1923 53 V 3.8013 7.8266 117.8433 60.6421 32.8096 171.9880 54 I 3.2546 8.3507 129.5811 60.3512 36.7687 173.9886 55 A 3.8976 8.7444 128.2516 53.4967 18.9263 177.1228 56 K 4.3506 8.5287 119.2829 57.3695 34.3033 174.4384 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 4.29 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 2 V 7.98 4.31 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 0.87 0.00 0.00 0.93 0.00 0.00 3 Q 8.61 4.27 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.67 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 4 Q 8.14 4.57 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 5 N 7.60 4.60 0.00 2.68 2.65 0.00 0.00 6.95 7.61 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 6 K 8.67 4.01 0.00 1.71 1.76 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.46 7.81 7 P 0.00 4.14 0.00 2.08 2.04 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 8 T 8.55 3.98 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 1.23 0.00 0.00 9 R 8.53 3.90 0.00 2.07 2.18 0.00 3.04 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 10 S 8.16 4.02 0.00 3.90 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 11 K 8.09 3.74 0.00 1.76 2.03 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.60 7.81 12 R 7.81 3.95 0.00 1.86 2.20 0.00 3.18 0.00 0.00 3.17 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 13 G 8.18 3.87 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 0.00 0.00 0.00 14 M 7.98 4.05 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.56 0.00 15 R 8.05 4.00 0.00 1.80 2.08 0.00 3.25 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 16 R 8.07 4.70 0.00 2.02 1.92 0.00 3.20 0.00 0.00 3.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.49 0.00 17 S 7.48 4.14 0.00 3.78 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 18 H 7.91 4.41 0.00 3.18 3.41 0.00 5.70 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.64 4.63 0.00 2.94 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 20 A 7.67 4.61 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 21 L 8.09 4.42 0.00 1.65 1.62 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.90 4.71 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 23 A 8.05 4.67 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 24 V 8.10 4.41 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 0.86 0.00 0.00 0.95 0.00 0.00 25 T 8.77 3.51 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 1.21 0.00 0.00 26 S 7.40 3.99 0.00 4.36 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 4.78 0.00 1.85 1.38 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 28 S 9.05 4.80 0.00 3.93 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 29 V 8.26 5.01 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 0.78 0.00 0.00 0.96 0.00 0.00 30 D 8.37 4.56 0.00 2.59 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.62 4.19 0.00 1.78 1.83 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 32 T 8.23 4.10 4.63 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 1.42 0.00 0.00 33 S 7.61 4.78 0.00 3.52 3.25 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 34 G 8.26 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 0.00 0.00 0.00 35 E 7.61 4.18 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 36 K 8.72 4.56 0.00 1.77 1.78 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 37 H 9.34 5.14 0.00 3.22 3.37 0.00 5.31 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.28 4.43 0.00 1.73 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.56 3.91 0.00 1.89 2.05 0.00 3.53 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 40 H 10.84 4.98 0.00 3.18 3.49 0.00 5.98 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.28 4.13 0.00 2.98 3.01 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 6.77 3.34 1.82 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 1.37 0.72 0.93 0.00 0.00 43 T 8.56 4.48 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 1.24 0.00 0.00 44 A 8.56 4.20 1.38 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 0.00 0.00 0.00 45 D 8.31 4.88 0.00 3.01 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.01 4.34 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 0.00 47 Y 8.93 4.92 0.00 2.98 3.08 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 48 Y 8.20 5.15 0.00 2.92 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 0.00 0.00 0.00 49 R 8.24 4.24 0.00 1.49 1.62 0.00 2.90 0.00 0.00 2.93 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.50 0.00 50 G 7.74 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.39 3.40 0.00 1.86 1.83 0.00 3.43 0.00 0.00 3.14 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 52 K 7.60 4.09 0.00 1.05 1.36 0.00 1.58 0.00 0.00 1.46 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.21 7.81 53 V 7.83 3.80 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 0.93 0.00 0.00 1.02 0.00 0.00 54 I 8.35 3.25 1.85 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 1.33 0.33 0.90 0.00 0.00 55 A 8.74 3.90 1.23 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 56 K 8.53 4.35 0.00 1.94 1.98 0.00 1.50 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.48 7.81