NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2991 8.2649 123.5823 52.1797 20.9144 176.7333 2 D 4.3360 7.8994 114.7322 52.2525 41.6938 174.7387 3 K 4.2334 8.9681 122.9417 56.5331 35.4459 176.7928 4 S 3.7454 8.0906 111.2026 59.0656 60.8471 172.5900 5 D 4.8820 7.6423 115.3718 54.8236 40.7339 177.5932 6 L 4.3707 7.9016 119.9833 56.4555 41.5634 178.7246 7 G 3.7515 7.7216 104.1193 47.3432 0.0000 175.1725 8 Y 4.0934 7.9817 118.7055 61.0914 38.1176 177.6940 9 T 4.2936 8.0172 113.7268 64.7811 67.4482 176.7966 10 G 4.1641 7.7886 104.8325 44.9122 0.0000 174.1559 11 L 4.6548 7.8930 120.6983 55.7031 40.6962 178.0319 12 T 3.8062 7.6251 112.1024 65.4497 68.9930 175.7969 13 D 4.3288 8.0480 121.2320 56.8768 41.2471 177.9743 14 E 3.9853 8.0814 118.5443 59.1666 29.4169 178.9117 15 Q 3.8774 8.2052 119.7805 59.0476 29.0736 178.1100 16 A 3.9382 8.4038 121.9911 55.4652 18.4235 179.6303 17 Q 3.9420 8.1308 116.3752 58.9465 28.7848 178.7788 18 E 3.9017 8.6821 120.6063 59.3882 29.7589 178.9769 19 L 4.0217 8.1830 119.2960 57.8060 41.6654 178.9391 20 H 4.1671 8.5536 118.7720 59.3279 29.8129 177.4702 21 S 4.0630 8.2908 116.2104 61.6740 62.7187 176.8627 22 V 3.4009 7.9031 116.2435 63.8703 31.2623 177.8710 23 Y 4.1332 8.3892 119.7128 61.0325 38.4217 178.2970 24 M 3.6779 7.7413 118.0142 58.3776 32.1997 178.2881 25 S 4.1632 8.4307 112.8740 60.2482 63.8205 174.6281 26 G 3.3436 8.2647 109.6896 42.3941 0.0000 172.8267 27 L 3.5120 7.2687 123.2136 56.9407 42.4790 177.2287 28 W 4.5909 7.1870 114.1776 57.4762 28.5007 177.5735 29 L 4.2323 8.6727 123.5933 58.2271 41.4157 178.3110 30 F 4.5932 8.0728 119.8141 61.4636 39.2764 176.8588 31 S 3.9609 8.3142 112.4390 61.3454 62.0510 176.1472 32 A 4.0525 8.0789 122.9498 55.1566 18.2845 179.4989 33 V 3.6142 8.0926 116.6141 66.1013 31.5916 178.1854 34 A 4.0301 8.6810 120.7723 55.1840 18.2642 179.5975 35 I 3.6601 7.7951 118.3274 64.5055 37.2328 178.6898 36 V 3.5823 8.1227 118.9677 66.0243 31.3126 177.8398 37 A 3.9851 8.1277 120.2571 55.4201 18.3025 178.9334 38 H 4.1134 8.7610 116.9734 59.6413 30.0089 177.4434 39 L 4.1226 8.6309 120.7834 57.6196 41.4241 179.2619 40 A 4.0704 8.6208 121.1461 55.3728 18.2641 179.8793 41 V 3.6549 8.0844 116.7685 66.3677 31.3824 177.5133 42 Y 4.3849 7.9333 118.2614 60.8675 38.6002 177.8558 43 I 3.9821 7.7836 119.7821 63.3286 37.5381 177.5680 44 W 4.2773 8.3442 129.5401 59.8548 30.1058 178.1862 45 R 4.2493 8.6450 118.7205 59.1108 29.5015 176.6820 46 P 4.4959 0.0000 0.0000 63.3537 31.6010 177.3472 47 W 3.6557 7.5255 127.4903 57.6665 31.1515 175.6109 48 F 4.3880 8.2253 117.6219 57.3566 39.4102 174.8848 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 1.29 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 2 D 7.90 4.34 0.00 2.77 2.64 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 0.00 0.00 0.00 0.00 3 K 8.97 4.23 0.00 2.07 2.03 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.33 7.81 4 S 8.09 3.75 0.00 4.03 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 5 D 7.64 4.88 0.00 2.81 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.90 4.37 0.00 1.77 1.74 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.72 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 8 Y 7.98 4.09 0.00 2.92 3.07 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 0.00 9 T 8.02 4.29 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 1.27 0.00 0.00 10 G 7.79 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 4.65 0.00 1.89 1.85 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.63 3.81 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 1.26 0.00 0.00 13 D 8.05 4.33 0.00 2.80 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 14 E 8.08 3.99 0.00 2.03 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 2.38 2.34 0.00 15 Q 8.21 3.88 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 16 A 8.40 3.94 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 17 Q 8.13 3.94 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.70 2.51 0.00 18 E 8.68 3.90 0.00 2.13 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 0.00 2.29 2.39 0.00 19 L 8.18 4.02 0.00 1.69 1.65 0.87 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.55 4.17 0.00 3.30 3.47 0.00 5.79 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.29 4.06 0.00 4.05 4.10 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 0.00 0.00 0.00 0.00 22 V 7.90 3.40 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 0.84 0.00 0.00 1.00 0.00 0.00 23 Y 8.39 4.13 0.00 3.01 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 24 M 7.74 3.68 0.00 1.88 1.95 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.41 0.00 25 S 8.43 4.16 0.00 3.78 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 26 G 8.26 3.34 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 27 L 7.27 3.51 0.00 1.30 1.38 0.32 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 28 W 7.19 4.59 0.00 3.57 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.67 4.23 0.00 1.73 1.82 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.07 4.59 0.00 3.32 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 31 S 8.31 3.96 0.00 4.00 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 0.00 32 A 8.08 4.05 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 3.61 2.54 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 1.23 0.00 0.00 1.05 0.00 0.00 34 A 8.68 4.03 1.17 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 35 I 7.80 3.66 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.96 0.00 0.00 36 V 8.12 3.58 2.27 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 0.86 0.00 0.00 1.03 0.00 0.00 37 A 8.13 3.99 1.43 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 38 H 8.76 4.11 0.00 3.27 3.54 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.63 4.12 0.00 1.78 1.78 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.62 4.07 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.08 3.65 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 1.04 0.00 0.00 0.97 0.00 0.00 42 Y 7.93 4.38 0.00 2.95 3.14 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 0.00 43 I 7.78 3.98 2.14 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.94 1.03 0.00 0.00 44 W 8.34 4.28 0.00 3.52 3.21 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 0.00 0.00 0.00 0.00 45 R 8.65 4.25 0.00 2.11 2.19 0.00 3.48 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 46 P 0.00 4.50 0.00 2.01 2.14 0.00 3.92 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.23 0.00 47 W 7.53 3.66 0.00 3.30 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 48 F 8.23 4.39 0.00 3.29 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00