NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.3199 8.0433 122.7523 54.6769 43.8725 175.4793 10 L 4.2841 8.5945 126.8540 53.7220 42.0342 174.5951 11 L 4.9089 8.3663 125.7783 53.2033 45.5657 175.0714 12 E 4.7132 8.3110 120.9409 55.1577 32.2745 174.2069 13 C 4.8929 8.4646 122.6686 58.3762 29.5911 173.1714 14 T 5.4636 8.7211 117.4947 60.0405 69.9208 172.5201 15 E 4.2764 8.4153 124.7255 54.4367 31.5158 174.8894 16 C 4.2153 7.9935 122.6675 60.1941 29.3943 174.0925 17 K 3.8834 8.8585 120.6234 57.0015 29.5965 174.6180 18 R 4.6318 7.4190 115.7352 55.4737 34.0906 175.3751 19 R 4.4479 8.1118 111.7079 54.2721 29.1495 173.1033 20 N 4.8143 7.5964 122.2050 52.9476 43.2627 172.3834 21 Y 6.2444 8.3812 121.2176 55.9990 41.5862 174.2358 22 A 4.6578 8.0762 118.8270 51.0249 22.4149 176.0325 23 T 4.0198 8.4314 111.4732 62.2536 69.7112 173.2960 24 E 4.5788 8.3442 122.3349 56.3036 34.1535 174.9613 25 K 4.3140 8.1966 121.1256 56.3038 33.3999 174.5552 26 N 4.7746 8.2555 126.9548 52.6563 40.6465 173.7077 27 K 4.6612 8.1963 118.8968 53.9258 35.3995 175.1000 28 R 3.9068 8.7244 123.2405 58.2709 29.3533 176.8433 29 N 4.4832 8.9167 117.2156 56.1536 40.3203 175.2060 30 T 3.8603 7.8759 113.5828 63.2117 68.8398 170.5815 31 P 4.2368 0.0000 0.0000 62.1889 30.6631 174.1967 32 N 4.4329 7.7525 112.4978 53.0806 40.9333 174.4616 33 K 4.2544 8.8411 121.9951 57.4238 33.3581 177.1818 34 L 4.7157 7.5336 115.6819 53.9063 42.8497 175.5150 35 E 4.5147 8.2620 118.6882 54.1834 31.7364 174.6551 36 L 5.0057 8.2340 129.1564 55.4077 41.4009 176.7922 37 R 4.2731 7.9977 118.4892 56.7094 31.3714 176.5416 38 K 4.3671 8.6779 124.2515 57.3473 33.6827 174.3910 39 Y 4.5386 8.0777 122.2413 57.3560 43.0835 172.3372 40 C 4.4417 7.2326 119.8963 56.7424 32.7941 171.6952 41 P 4.7778 0.0000 0.0000 61.6737 32.4720 176.4370 42 W 5.2540 8.8353 127.9777 60.6937 30.9078 176.6739 43 C 4.1686 8.1204 115.0303 60.6920 28.6192 175.1896 44 R 3.6046 8.4098 122.7956 56.8717 28.4505 175.2991 45 K 4.4128 8.3426 118.5058 57.3165 36.1093 172.4075 46 H 4.1537 9.1617 126.2651 56.0008 26.9776 174.0193 47 T 4.8348 8.3874 113.3572 59.8316 71.6466 173.8582 48 V 3.9299 8.6313 116.7795 62.3346 32.9955 174.5927 49 H 5.2387 8.4718 121.2428 53.2794 31.1260 174.1736 50 R 4.4204 8.4352 121.9322 54.8324 31.7637 175.6993 51 E 3.9540 9.0709 121.8046 54.0126 29.6025 177.0052 52 V 3.6379 8.0013 123.9292 63.4515 32.6496 172.7138 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 9 L 8.04 4.32 0.00 1.73 1.59 0.90 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.59 4.28 0.00 1.62 1.56 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.37 4.91 0.00 1.68 1.43 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.31 4.71 0.00 1.69 1.71 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 1.96 1.94 0.00 13 C 8.46 4.89 0.00 2.76 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 14 T 8.72 5.46 4.47 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 1.30 0.00 0.00 15 E 8.42 4.28 0.00 1.96 1.75 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 2.16 2.20 0.00 16 C 7.99 4.22 0.00 3.11 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 17 K 8.86 3.88 0.00 1.87 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.38 7.81 18 R 7.42 4.63 0.00 1.85 1.80 0.00 3.57 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 19 R 8.11 4.45 0.00 1.70 1.80 0.00 2.97 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 20 N 7.60 4.81 0.00 2.72 2.78 0.00 0.00 6.87 7.56 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 21 Y 8.38 6.24 0.00 2.87 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.43 4.02 4.21 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 1.20 0.00 0.00 24 E 8.34 4.58 0.00 1.82 1.83 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 2.09 2.13 0.00 25 K 8.20 4.31 0.00 1.70 1.67 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.66 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.55 7.81 26 N 8.26 4.77 0.00 2.81 2.71 0.00 0.00 7.00 6.56 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 27 K 8.20 4.66 0.00 1.74 1.66 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.32 7.81 28 R 8.72 3.91 0.00 1.74 1.70 0.00 3.27 0.00 0.00 3.14 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 29 N 8.92 4.48 0.00 2.72 2.82 0.00 0.00 6.90 7.70 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 30 T 7.88 3.86 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 31 P 0.00 4.24 0.00 2.03 2.07 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 32 N 7.75 4.43 0.00 2.77 2.96 0.00 0.00 7.13 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 33 K 8.84 4.25 0.00 1.73 1.84 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.35 7.81 34 L 7.53 4.72 0.00 1.73 1.66 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.26 4.51 0.00 2.04 1.81 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 2.24 2.35 0.00 36 L 8.23 5.01 0.00 1.69 1.73 0.93 0.71 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 37 R 8.00 4.27 0.00 1.87 1.94 0.00 3.20 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 38 K 8.68 4.37 0.00 1.84 1.80 0.00 1.93 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.55 7.81 39 Y 8.08 4.54 0.00 2.98 2.46 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 0.00 40 C 7.23 4.44 0.00 2.50 2.36 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 41 P 0.00 4.78 0.00 2.36 2.37 0.00 3.86 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 42 W 8.84 5.25 0.00 3.20 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 43 C 8.12 4.17 0.00 3.03 2.84 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 0.00 0.00 0.00 44 R 8.41 3.60 0.00 1.92 1.89 0.00 3.21 0.00 0.00 3.21 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 45 K 8.34 4.41 0.00 1.71 1.72 0.00 1.99 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.42 7.81 46 H 9.16 4.15 0.00 3.32 3.36 0.00 5.70 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.39 4.83 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 1.25 0.00 0.00 48 V 8.63 3.93 2.12 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 0.84 0.00 0.00 0.96 0.00 0.00 49 H 8.47 5.24 0.00 3.11 3.20 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 50 R 8.44 4.42 0.00 1.74 1.86 0.00 3.58 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.41 0.00 51 E 9.07 3.95 0.00 2.04 1.74 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 2.35 2.28 0.00 52 V 8.00 3.64 2.11 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 0.80 0.00 0.00 0.95 0.00 0.00