NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.1299 8.4293 121.4512 55.6680 31.3300 176.3696 20 I 4.0420 7.4672 108.7166 59.9786 39.1741 173.3466 21 D 4.6081 7.3313 119.9517 53.1499 44.7566 175.6372 22 Y 4.6777 8.2517 121.8755 57.4001 38.0681 175.9659 23 K 4.3293 7.1019 119.5804 57.1077 33.4744 176.7703 24 D 4.7007 7.7060 120.9461 53.1568 40.0245 177.7671 25 I 4.2426 7.8419 114.1502 63.8003 37.6868 177.6140 26 A 4.1839 7.9245 121.9960 53.8653 19.1442 177.9729 27 T 4.4072 9.2622 112.7683 65.2369 70.0339 177.2213 28 L 4.1649 8.0429 121.2910 57.6643 41.7253 178.9637 29 K 4.2190 7.7183 115.8420 58.7489 32.3742 176.6458 30 N 4.7176 7.9865 117.2477 53.6460 38.5235 175.6428 31 Y 4.7741 8.0501 112.2908 58.2192 40.9866 174.3016 32 I 4.9906 7.5052 112.8129 58.8083 40.4719 175.0281 33 T 4.0763 8.3304 118.1656 61.7534 67.9815 174.5484 34 E 3.9462 8.7741 122.4469 59.5712 29.0495 178.8540 35 S 4.2220 8.0300 110.5697 58.7906 63.1026 175.4909 36 G 3.8985 8.2082 109.6404 45.5468 0.0000 174.0070 37 K 4.1626 7.4672 120.6208 55.7402 32.5212 176.4908 38 I 4.2025 8.3778 124.5200 62.2612 37.8385 175.2154 39 V 4.4681 8.3005 125.7953 60.3046 32.8748 173.9614 40 P 4.5222 0.0000 0.0000 63.0073 32.1034 177.6809 41 S 4.2843 8.8605 116.9321 61.3582 63.0000 176.5476 42 R 4.2015 8.0412 115.2647 57.7898 29.3044 177.0787 43 I 4.4338 7.4811 117.5217 62.2939 39.7594 176.4980 44 T 4.0486 8.1283 109.1750 61.7740 69.1419 176.0958 45 G 3.8856 8.6512 109.2725 45.5952 0.0000 173.7312 46 T 3.9678 7.4209 113.7431 62.0394 67.8535 174.5832 47 R 4.0834 8.2113 124.2020 56.4012 30.2891 176.5856 48 A 4.2457 8.4732 118.8790 55.5087 18.4695 179.6665 49 K 4.1845 7.9582 117.4554 59.9523 31.7468 178.4928 50 Y 4.1323 8.0829 116.6169 61.0451 37.9202 177.5862 51 Q 4.3239 7.7421 120.9762 59.6956 28.9398 178.4075 52 R 3.9244 8.0982 118.6693 58.7911 30.1738 178.4019 53 Q 3.8848 7.9383 116.6455 60.0361 28.8584 178.8222 54 L 3.6424 9.2956 120.0140 58.3834 41.7566 178.4295 55 A 3.9496 8.3888 119.6110 55.4841 18.4838 179.4027 56 R 3.8148 8.6286 117.0992 59.6573 30.0240 177.9800 57 A 4.4571 8.0161 118.3428 53.2954 18.9862 179.1653 58 I 3.8204 7.8670 119.4834 64.0398 37.3576 177.9187 59 K 3.7929 8.4899 119.0415 60.2462 30.6804 179.4398 60 R 3.8609 7.9899 118.1916 59.5912 30.1714 178.1957 61 A 4.2644 7.7822 120.6726 55.0205 18.3796 179.7796 62 R 3.7912 7.8377 118.1054 58.9786 29.8391 178.8635 63 Y 4.3245 7.6567 113.8753 59.6883 37.9775 177.0847 64 L 4.5364 7.1833 116.0244 53.5640 41.8854 176.0072 65 S 3.6967 8.3821 112.2894 59.2757 61.1848 173.2039 66 L 4.3459 7.7616 118.6514 55.6430 42.1042 177.0437 67 L 4.6761 7.1422 117.0461 52.4170 45.7454 173.1760 68 P 4.4163 0.0000 0.0000 62.4368 31.7914 176.0302 69 Y 4.1702 7.8411 120.8426 60.7980 38.5891 176.1640 70 T 4.3298 7.7228 114.9703 62.1419 68.3862 173.7999 71 D 4.8553 8.4585 122.5100 53.3085 39.5564 177.3738 72 R 4.2782 7.9800 119.3090 57.4209 30.8806 176.3241 73 H 4.6431 8.0354 119.2994 55.8055 29.0608 174.1510 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 19 E 8.43 4.13 0.00 1.80 1.92 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 1.83 2.08 0.00 20 I 7.47 4.04 1.80 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 1.24 0.60 0.79 0.00 0.00 21 D 7.33 4.61 0.00 2.53 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.25 4.68 0.00 3.20 3.05 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 0.00 0.00 0.00 23 K 7.10 4.33 0.00 1.44 1.69 0.00 1.54 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.21 7.81 24 D 7.71 4.70 0.00 2.76 2.65 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 25 I 7.84 4.24 1.88 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 1.50 1.10 0.93 0.00 0.00 26 A 7.92 4.18 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 27 T 9.26 4.41 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 1.36 0.00 0.00 28 L 8.04 4.16 0.00 1.79 1.78 1.02 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.72 4.22 0.00 1.83 2.03 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.42 7.81 30 N 7.99 4.72 0.00 2.92 2.37 0.00 0.00 6.72 7.47 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 31 Y 8.05 4.77 0.00 3.21 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 32 I 7.51 4.99 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.67 0.96 0.00 0.00 33 T 8.33 4.08 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 1.30 0.00 0.00 34 E 8.77 3.95 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 35 S 8.03 4.22 0.00 4.01 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 36 G 8.21 3.90 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 0.00 0.00 0.00 37 K 7.47 4.16 0.00 1.72 1.78 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.43 7.81 38 I 8.38 4.20 1.91 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 1.27 0.50 0.96 0.00 0.00 39 V 8.30 4.47 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 0.81 0.00 0.00 1.03 0.00 0.00 40 P 0.00 4.52 0.00 2.18 2.19 0.00 3.78 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 41 S 8.86 4.28 0.00 3.94 4.19 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 42 R 8.04 4.20 0.00 1.93 2.08 0.00 2.99 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 43 I 7.48 4.43 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.96 0.91 0.00 0.00 44 T 8.13 4.05 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 1.36 0.00 0.00 45 G 8.65 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.42 3.97 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 47 R 8.21 4.08 0.00 1.59 1.74 0.00 3.33 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.17 0.00 48 A 8.47 4.25 1.31 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 0.00 0.00 0.00 49 K 7.96 4.18 0.00 1.91 2.06 0.00 1.78 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.65 1.61 7.81 50 Y 8.08 4.13 0.00 2.93 3.01 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 0.00 0.00 0.00 51 Q 7.74 4.32 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 52 R 8.10 3.92 0.00 2.01 1.92 0.00 3.24 0.00 0.00 3.36 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.90 0.00 53 Q 7.94 3.88 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 54 L 9.30 3.64 0.00 1.78 1.58 0.58 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.39 3.95 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 56 R 8.63 3.81 0.00 1.91 2.12 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 57 A 8.02 4.46 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 58 I 7.87 3.82 2.00 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 1.53 0.78 0.91 0.00 0.00 59 K 8.49 3.79 0.00 1.95 2.20 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.61 7.81 60 R 7.99 3.86 0.00 2.14 2.06 0.00 3.04 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.54 0.00 61 A 7.78 4.26 1.51 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 0.00 0.00 62 R 7.84 3.79 0.00 1.19 0.66 0.00 3.00 0.00 0.00 2.95 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.41 0.00 63 Y 7.66 4.32 0.00 3.00 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 64 L 7.18 4.54 0.00 1.75 1.70 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.38 3.70 0.00 3.92 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.76 4.35 0.00 1.86 1.72 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.14 4.68 0.00 1.53 1.36 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.42 0.00 2.05 2.01 0.00 3.61 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 69 Y 7.84 4.17 0.00 3.05 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.72 4.33 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 1.19 0.00 0.00 71 D 8.46 4.86 0.00 2.79 2.72 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 72 R 7.98 4.28 0.00 1.64 1.93 0.00 3.27 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 73 H 8.04 4.64 0.00 3.14 3.15 0.00 5.73 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