NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.2311 8.1744 110.9449 61.2655 70.7978 173.6463 6 N 4.5341 8.0359 121.1836 51.9127 39.1316 172.2800 7 S 4.7154 9.0409 121.3210 57.1861 68.1413 173.4940 8 D 4.8181 8.6814 121.9611 54.8762 41.8180 175.3933 9 F 5.3582 7.9718 114.3803 55.2859 41.5800 173.7352 10 V 4.4845 8.8309 119.3196 61.0925 34.6565 174.1663 11 V 4.8509 8.7171 126.9263 61.2900 33.8896 174.2997 12 I 4.8961 9.1078 128.5392 59.4583 40.5189 174.1582 13 K 4.9730 9.2248 129.5198 54.2501 34.1322 175.2135 14 A 4.3872 8.6495 130.4906 52.4064 19.0345 177.3884 15 L 4.6506 8.9558 122.6847 54.6570 42.4570 176.1533 16 E 4.6870 7.6907 115.5262 54.8143 32.2899 174.5215 17 D 4.4582 8.3671 119.5393 55.6674 41.3758 176.9644 18 G 3.8667 8.3726 109.8305 45.7489 0.0000 174.0132 19 V 3.8012 7.5812 119.6928 63.0434 32.8992 174.2697 20 N 5.2565 9.2566 126.3480 51.9157 41.4889 173.0395 21 V 4.5332 8.7747 127.9265 61.6441 33.3595 174.4659 22 I 4.7944 9.0100 129.6707 59.4778 39.9712 174.7815 23 G 4.2579 9.1751 115.7448 45.0141 0.0000 172.4027 24 L 5.3731 8.9646 126.6997 53.3102 43.8982 176.3890 25 T 4.5583 8.7097 114.4813 61.6988 69.2538 174.2591 26 R 4.2982 7.9146 126.7685 56.3264 30.9029 176.0902 27 G 3.8074 8.8084 110.7094 43.7846 0.0000 172.6519 28 A 4.0484 8.5300 122.1889 54.5610 18.5237 177.7179 29 D 4.8091 7.7810 113.1928 53.0457 42.9166 175.5881 30 T 4.7549 8.2514 120.4845 62.0162 70.8653 173.2797 31 R 4.8903 8.7698 122.4936 54.4464 33.4870 174.3255 32 F 5.0526 8.9273 115.6935 57.3304 38.3107 174.7629 33 H 4.7027 9.1701 116.5071 56.1338 30.3258 173.7594 34 H 4.9760 7.9227 117.8303 55.0818 33.4015 171.9673 35 S 4.9108 8.3213 118.5819 56.5512 65.0157 172.3191 36 E 4.5749 9.4118 129.3470 54.5054 31.1489 174.7416 37 K 4.8941 8.6366 126.8127 55.6922 33.5328 176.1824 38 L 4.9576 9.0252 124.2766 53.0539 44.8543 176.1703 39 D 4.7537 9.1689 123.2383 52.9512 42.8086 175.9452 40 K 4.0723 8.8068 122.3096 58.3196 32.3843 177.1767 41 G 4.0224 9.1084 115.6882 45.1493 0.0000 173.5424 42 E 4.2547 8.0528 119.7059 56.2400 30.7822 176.0163 43 V 4.8629 8.3154 122.2916 60.9861 34.3964 174.2007 44 L 4.7750 9.0769 129.6238 53.2506 44.8888 174.8262 45 I 5.0829 8.4973 126.3083 59.6023 39.2935 174.7498 46 A 4.6993 9.0856 129.3113 50.1551 21.8881 175.3927 47 Q 4.8179 8.7102 121.2955 55.1678 30.3775 175.6920 48 F 4.8335 8.6349 120.3704 57.6497 39.8295 175.2269 49 T 4.7640 9.0382 111.3881 59.6310 72.1359 174.1617 50 E 4.0320 8.8696 121.8131 59.4195 29.5668 177.3350 51 H 4.5724 7.8998 114.4318 56.0094 30.0368 174.4072 52 T 5.4047 8.4897 115.9982 61.0386 70.2162 173.9877 53 S 4.9958 8.7889 119.9681 58.0434 64.8960 173.3213 54 A 5.1146 7.9742 121.7249 51.0253 22.6262 175.0639 55 I 5.0156 8.6965 121.2423 59.3319 40.3831 174.8287 56 K 4.6388 9.1626 128.0924 54.5017 35.0053 174.6158 57 V 4.8527 8.4083 126.2453 61.1898 33.6673 174.5591 58 R 4.5523 9.0221 126.9053 55.5746 32.8763 176.1810 59 G 4.0393 8.9506 108.7879 44.1328 0.0000 172.7119 60 K 4.5037 9.8642 121.2601 56.1661 32.9676 175.6015 61 A 5.1422 8.8015 128.2831 50.7784 23.4706 173.7851 62 Y 4.7710 9.1568 122.5007 56.2863 40.6348 174.4426 63 I 5.0577 8.2923 127.4876 59.5467 40.6663 174.4427 64 Q 5.0579 8.9954 125.6271 54.3535 31.8618 174.8763 65 T 4.7733 8.5846 112.8347 59.4174 72.3927 174.4389 66 R 3.7242 8.5629 120.5985 59.6741 29.7717 176.5767 67 H 4.5993 7.9699 112.4825 55.3890 29.5967 174.0196 68 G 3.7493 7.1882 105.8357 44.1862 0.0000 172.9146 69 V 4.4815 8.0332 113.2846 60.4036 33.1620 175.6944 70 I 4.6081 8.3901 123.1512 59.4690 41.9834 173.2311 71 E 5.1408 8.6244 126.6281 54.5275 31.9971 175.9719 72 S 4.6443 8.7037 119.2224 57.8169 65.2864 172.9026 73 E 4.8940 8.4844 119.7370 54.3327 32.9369 176.1802 74 G 3.7067 8.7139 111.3946 45.9033 0.0000 173.3298 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 5 T 8.17 4.23 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 1.22 0.00 0.00 6 N 8.04 4.53 0.00 2.81 2.81 0.00 0.00 6.77 6.75 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 7 S 9.04 4.72 0.00 4.00 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 8 D 8.68 4.82 0.00 2.81 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 9 F 7.97 5.36 0.00 3.03 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 10 V 8.83 4.48 1.98 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 0.98 0.00 0.00 0.72 0.00 0.00 11 V 8.72 4.85 2.16 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 1.11 0.00 0.00 1.16 0.00 0.00 12 I 9.11 4.90 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 1.11 0.51 0.92 0.00 0.00 13 K 9.22 4.97 0.00 1.85 1.78 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.38 7.81 14 A 8.65 4.39 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 15 L 8.96 4.65 0.00 1.64 1.72 1.01 0.74 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 16 E 7.69 4.69 0.00 2.02 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 2.34 2.33 0.00 17 D 8.37 4.46 0.00 2.68 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 18 G 8.37 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 19 V 7.58 3.80 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 0.76 0.00 0.00 0.99 0.00 0.00 20 N 9.26 5.26 0.00 2.69 2.57 0.00 0.00 6.56 7.32 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 21 V 8.77 4.53 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 0.89 0.00 0.00 0.92 0.00 0.00 22 I 9.01 4.79 1.92 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.57 0.84 0.00 0.00 23 G 9.18 4.26 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 0.00 24 L 8.96 5.37 0.00 1.96 1.67 1.04 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.71 4.56 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 1.30 0.00 0.00 26 R 7.91 4.30 0.00 1.89 1.94 0.00 3.22 0.00 0.00 3.07 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.43 0.00 27 G 8.81 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.53 4.05 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 7.78 4.81 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 4.75 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 1.25 0.00 0.00 31 R 8.77 4.89 0.00 1.84 1.98 0.00 2.70 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 32 F 8.93 5.05 0.00 3.13 3.06 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 33 H 9.17 4.70 0.00 3.06 3.43 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.92 4.98 0.00 3.32 3.12 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.32 4.91 0.00 3.58 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 9.41 4.57 0.00 2.18 1.82 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 2.25 2.33 0.00 37 K 8.64 4.89 0.00 1.67 1.70 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.43 7.81 38 L 9.03 4.96 0.00 1.51 1.53 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.17 4.75 0.00 2.88 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.81 4.07 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.40 7.81 41 G 9.11 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 0.00 0.00 0.00 42 E 8.05 4.25 0.00 2.12 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 2.33 2.32 0.00 43 V 8.32 4.86 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 0.81 0.00 0.00 0.95 0.00 0.00 44 L 9.08 4.78 0.00 1.75 1.47 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.50 5.08 1.78 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 1.30 0.78 0.74 0.00 0.00 46 A 9.09 4.70 1.14 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 0.00 0.00 47 Q 8.71 4.82 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 48 F 8.63 4.83 0.00 3.01 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 49 T 9.04 4.76 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 8.87 4.03 0.00 1.94 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 0.00 2.12 2.32 0.00 51 H 7.90 4.57 0.00 3.36 3.20 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 8.49 5.40 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 53 S 8.79 5.00 0.00 3.82 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 54 A 7.97 5.11 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 5.02 1.85 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 0.88 0.00 0.00 56 K 9.16 4.64 0.00 1.80 1.61 0.00 1.55 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.35 7.81 57 V 8.41 4.85 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 0.87 0.00 0.00 0.92 0.00 0.00 58 R 9.02 4.55 0.00 1.72 1.74 0.00 3.05 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 59 G 8.95 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 9.86 4.50 0.00 1.82 1.72 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.41 7.81 61 A 8.80 5.14 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 62 Y 9.16 4.77 0.00 3.04 2.83 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 63 I 8.29 5.06 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.54 0.92 0.00 0.00 64 Q 9.00 5.06 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 65 T 8.58 4.77 4.12 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 66 R 8.56 3.72 0.00 1.58 1.75 0.00 3.37 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 67 H 7.97 4.60 0.00 3.19 3.27 0.00 5.69 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 7.19 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 69 V 8.03 4.48 1.61 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 0.62 0.00 0.00 0.87 0.00 0.00 70 I 8.39 4.61 1.81 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 1.19 1.44 0.84 0.00 0.00 71 E 8.62 5.14 0.00 1.85 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 72 S 8.70 4.64 0.00 3.95 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 73 E 8.48 4.89 0.00 1.82 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 74 G 8.71 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00