NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 D 4.5812 8.3644 120.5321 53.8871 43.5445 176.1987 25 H 4.5998 7.5039 121.9236 53.4022 28.7197 173.7856 26 H 4.3137 8.8298 121.6277 57.9735 29.7845 176.5794 27 Y 3.0735 7.0440 118.5065 59.9213 37.3603 177.6440 28 A 4.0950 7.3560 120.8198 55.0490 18.4877 178.6712 29 M 4.3607 7.8286 114.5960 56.4361 32.5705 177.5763 30 W 4.4618 8.5891 119.8445 57.1525 29.5442 177.7534 31 D 4.5051 8.1459 119.8063 56.6794 38.6853 178.4492 32 A 4.0170 8.0158 121.6950 54.4813 18.5186 179.1955 33 A 3.8409 7.8964 118.8557 55.3905 18.5272 178.7929 34 Y 4.0346 8.0462 118.0821 61.2066 38.6896 178.8489 35 V 3.5126 7.8715 117.4559 65.4226 31.7436 177.1152 36 L 4.3125 7.9765 116.7057 54.7597 41.7849 177.6233 37 G 3.7532 7.7079 107.1048 45.5002 0.0000 174.1344 38 A 4.3139 7.7257 121.0781 52.1177 19.3713 178.4253 39 L 4.0539 7.5954 116.9687 53.7718 42.4414 177.7707 40 S 4.2658 8.5667 118.1985 58.4538 64.7639 175.3091 41 A 3.9957 8.5942 123.9187 55.4019 18.0683 179.9836 42 A 4.0011 7.9772 118.6126 55.5565 18.5858 179.4398 43 D 4.6443 8.3301 117.4698 57.6157 40.7656 179.0666 44 R 4.2989 8.4867 119.5378 59.5547 30.0423 178.8868 45 R 3.9811 8.1714 117.8843 59.0332 30.0845 178.4587 46 E 3.9321 8.5316 119.2779 59.4574 29.6482 178.7712 47 F 3.7835 8.8752 120.9705 61.1254 39.4308 176.9530 48 E 3.5766 8.5139 118.2646 59.0602 29.0360 178.8633 49 A 3.8601 7.7487 119.7980 55.6289 18.8411 178.8046 50 H 3.9120 7.7090 116.3326 59.3427 29.6358 177.3578 51 L 3.5825 7.6430 120.7717 57.5624 41.0570 179.3891 52 A 4.0199 7.4412 119.7360 53.9389 18.3053 178.2914 53 G 3.7846 7.4659 102.9651 45.2342 0.0000 173.4648 54 C 4.5079 7.3058 120.3584 56.2293 32.9977 172.2656 55 P 4.2469 0.0000 0.0000 65.0304 30.9565 178.2139 56 E 3.9108 8.0115 118.0059 59.4461 29.7813 178.2283 57 C 4.1795 8.0763 116.2722 62.9715 28.1898 176.0584 58 R 3.9784 7.9122 119.5629 59.3946 29.7099 179.3834 59 G 3.6127 8.1930 105.1219 47.5427 0.0000 175.6913 60 A 4.0625 7.7682 122.3645 55.1936 18.7321 179.8959 61 V 3.8671 8.0516 110.9696 64.7525 31.5268 178.6026 62 T 3.9199 8.0738 115.6934 67.1747 68.1480 176.2314 63 E 4.0345 8.0033 118.5032 58.9573 29.8309 178.5707 64 L 4.4429 7.8902 117.3047 55.3949 41.9004 178.2669 65 C 4.4140 7.8602 114.8254 60.6099 30.0165 175.3514 66 G 3.7759 8.0398 107.3129 46.2646 0.0000 175.7533 67 V 3.6077 7.8416 121.1454 65.6378 31.5151 176.0683 68 P 4.2050 0.0000 0.0000 65.4017 30.9584 178.2187 69 A 3.9791 7.9509 117.9950 55.2700 18.7105 179.1247 70 L 4.0875 7.7833 117.0346 58.1372 41.8513 179.9012 71 L 4.0789 8.2912 119.3345 57.5265 41.3245 179.0395 72 S 4.4076 8.0510 111.8805 59.7557 63.1056 175.3644 73 Q 4.2789 7.8438 120.8501 55.9976 29.0081 175.0797 74 L 4.7559 7.1829 119.3561 52.8002 44.5951 175.4733 75 D 5.0296 8.8730 120.4405 51.4180 43.0809 177.5514 76 R 3.9669 8.3633 116.5428 59.1910 29.1922 178.7178 77 D 4.2997 8.1173 119.4810 57.5056 41.0329 178.1004 78 E 3.9248 8.4256 118.9946 59.6015 29.4888 179.7171 79 V 3.6681 7.7007 117.7877 65.5434 31.6226 177.9340 80 A 3.9816 8.3502 120.7895 55.0081 18.3576 179.3002 81 A 3.9434 8.2665 119.4816 55.4828 18.2102 179.8759 82 I 3.7537 7.4405 116.8692 64.7902 37.2583 178.6175 83 S 4.2715 7.7549 114.3464 61.3036 62.6912 175.9377 84 E 4.1234 7.9465 121.0167 58.8348 29.3798 177.3656 85 S 4.3671 7.4843 115.1116 58.2695 63.1995 173.6148 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 24 D 8.36 4.58 0.00 2.71 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 25 H 7.50 4.60 0.00 3.23 3.20 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 H 8.83 4.31 0.00 3.33 3.39 0.00 5.51 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 27 Y 7.04 3.07 0.00 2.51 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.36 4.09 1.34 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 29 M 7.83 4.36 0.00 2.12 2.37 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.80 0.00 30 W 8.59 4.46 0.00 2.75 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.15 4.51 0.00 3.04 3.16 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 32 A 8.02 4.02 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 33 A 7.90 3.84 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 34 Y 8.05 4.03 0.00 2.86 3.26 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 35 V 7.87 3.51 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 0.90 0.00 0.00 1.14 0.00 0.00 36 L 7.98 4.31 0.00 1.60 1.65 0.90 1.06 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 37 G 7.71 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 38 A 7.73 4.31 1.21 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 0.00 0.00 39 L 7.60 4.05 0.00 1.67 1.67 0.54 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.57 4.27 0.00 4.04 3.98 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 0.00 0.00 0.00 0.00 41 A 8.59 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.98 4.00 1.39 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 0.00 0.00 0.00 43 D 8.33 4.64 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 8.49 4.30 0.00 2.12 2.21 0.00 3.20 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.13 0.00 45 R 8.17 3.98 0.00 2.15 2.01 0.00 3.24 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 46 E 8.53 3.93 0.00 2.36 2.47 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 2.45 2.46 0.00 47 F 8.88 3.78 0.00 3.50 3.12 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 0.00 48 E 8.51 3.58 0.00 2.11 1.93 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 2.29 2.52 0.00 49 A 7.75 3.86 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 50 H 7.71 3.91 0.00 2.43 2.62 0.00 5.80 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 51 L 7.64 3.58 0.00 1.46 1.38 0.13 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.44 4.02 1.21 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 0.00 0.00 53 G 7.47 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.31 4.51 0.00 2.56 2.51 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 55 P 0.00 4.25 0.00 2.17 2.05 0.00 3.59 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 2.07 2.09 0.00 56 E 8.01 3.91 0.00 2.04 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 0.00 2.42 2.42 0.00 57 C 8.08 4.18 0.00 2.90 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 58 R 7.91 3.98 0.00 2.01 1.95 0.00 3.07 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 59 G 8.19 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.77 4.06 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.05 3.87 2.32 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 1.01 0.00 0.00 1.05 0.00 0.00 62 T 8.07 3.92 4.45 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 1.23 0.00 0.00 63 E 8.00 4.03 0.00 2.22 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 2.37 2.48 0.00 64 L 7.89 4.44 0.00 1.90 1.74 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.86 4.41 0.00 3.12 3.27 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 66 G 8.04 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.84 3.61 2.23 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 1.12 0.00 0.00 0.95 0.00 0.00 68 P 0.00 4.20 0.00 2.18 2.07 0.00 3.85 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 69 A 7.95 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.78 4.09 0.00 1.90 1.73 0.93 0.58 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 71 L 8.29 4.08 0.00 1.95 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.05 4.41 0.00 4.01 4.11 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 0.00 0.00 0.00 0.00 73 Q 7.84 4.28 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 74 L 7.18 4.76 0.00 1.64 1.56 0.92 0.88 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 75 D 8.87 5.03 0.00 2.80 2.75 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 76 R 8.36 3.97 0.00 2.05 2.23 0.00 2.96 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 77 D 8.12 4.30 0.00 2.90 2.75 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 78 E 8.43 3.92 0.00 2.22 2.01 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 2.33 2.33 0.00 79 V 7.70 3.67 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 1.00 0.00 0.00 0.98 0.00 0.00 80 A 8.35 3.98 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 81 A 8.27 3.94 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 82 I 7.44 3.75 2.03 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 1.52 0.71 0.91 0.00 0.00 83 S 7.75 4.27 0.00 3.85 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 84 E 7.95 4.12 0.00 2.12 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 2.45 2.48 0.00 85 S 7.48 4.37 0.00 4.02 3.80 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