NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 D 4.5860 8.3644 120.5325 54.5643 43.1312 176.4133 25 H 4.4684 8.0040 119.4007 53.5388 28.2376 173.4975 26 H 4.1823 8.8280 121.3358 58.5844 29.7653 176.5730 27 Y 3.2140 6.9920 118.2886 60.1638 37.3271 178.2216 28 A 4.1891 7.4636 120.2820 54.4681 18.5659 178.4851 29 M 4.3775 8.2247 115.6763 56.0162 32.7487 177.4068 30 W 4.4806 8.2222 119.3592 56.8592 29.4918 177.5904 31 D 4.5263 8.1493 120.0250 56.7261 38.6637 178.3077 32 A 3.9851 8.0845 122.1601 54.4799 18.3964 179.2139 33 A 3.8741 7.9460 118.6963 55.3062 18.3299 179.0017 34 Y 4.0640 8.1191 118.0169 61.1029 38.7711 178.6610 35 V 3.4790 7.7734 117.5881 65.3432 31.7317 177.0013 36 L 4.3925 7.9700 116.3251 54.3735 41.8763 177.4860 37 G 3.7711 7.5839 107.0203 45.5812 0.0000 174.2243 38 A 4.2641 7.8953 121.0582 52.2896 19.0904 178.5621 39 L 4.0800 7.5902 116.8373 53.7661 42.5428 177.7911 40 S 4.2900 8.4358 117.7331 58.2015 64.7830 175.0621 41 A 4.0127 8.6972 124.1159 55.5944 17.9294 180.0992 42 A 4.0160 7.9280 118.4217 55.4384 18.6904 179.3137 43 D 4.6378 8.1027 117.4554 57.6337 40.7902 179.0783 44 R 4.2045 8.5536 119.5117 59.7029 30.1427 178.8316 45 R 3.9743 7.9365 117.9781 59.1467 30.0605 178.6057 46 E 3.9385 8.5243 119.2001 59.4059 29.6587 178.7480 47 F 3.8946 8.9058 121.0782 61.1800 39.5680 176.9525 48 E 3.5746 8.5424 118.3436 58.9886 28.9807 179.0627 49 A 3.8480 7.5498 119.8683 55.4378 18.7922 178.6987 50 H 3.9155 7.6951 116.4903 59.4032 29.8963 177.0964 51 L 3.4544 7.7729 120.6664 57.8611 41.1474 179.5420 52 A 4.1043 7.5172 119.0974 53.8727 18.2210 178.3632 53 G 3.8501 7.4746 104.3929 45.1753 0.0000 173.8452 54 C 4.3955 7.6728 119.9861 55.9736 33.2941 172.3970 55 P 4.2683 0.0000 0.0000 65.1460 31.0110 178.4018 56 E 3.9659 8.0265 117.3379 59.6424 29.5278 178.9169 57 C 4.2957 7.9909 116.3048 62.7540 28.2733 176.1657 58 R 3.9771 8.0788 119.9373 59.1772 29.6295 179.2944 59 G 3.6442 8.4152 105.5270 47.6422 0.0000 175.6028 60 A 4.0509 7.8132 122.1699 55.2221 18.9037 179.9238 61 V 3.8846 8.0710 110.9522 64.7210 31.2374 178.7705 62 T 3.9385 8.0503 115.6484 66.9137 68.0811 176.2718 63 E 4.0734 8.0600 119.2059 59.0857 29.8719 178.6621 64 L 4.4805 7.8111 116.9455 55.4655 41.8582 177.4938 65 C 4.6018 7.5542 112.9065 58.5809 29.9226 174.6855 66 G 3.9672 7.8091 107.4035 45.3066 0.0000 176.2204 67 V 3.5887 7.7868 121.1784 65.6011 31.6450 175.7600 68 P 4.1775 0.0000 0.0000 65.9362 30.9484 178.3214 69 A 3.9921 7.9687 117.2751 54.9115 18.5468 179.0429 70 L 4.1837 7.6361 117.5097 57.5131 42.0957 179.1272 71 L 4.0168 8.6402 119.7038 57.9151 41.3828 179.4921 72 S 4.3412 8.0766 112.3546 60.4158 63.0551 175.6124 73 Q 4.2552 7.8847 120.5769 56.1635 28.7057 175.2332 74 L 4.9795 7.1360 119.0442 52.6544 45.6070 175.9887 75 D 4.9180 9.1217 120.5889 52.6722 44.0222 178.1546 76 R 3.9737 8.3888 118.2365 59.6288 29.2686 178.7270 77 D 4.3203 8.0285 119.3683 56.2376 39.5249 178.2119 78 E 3.9595 8.1319 119.5812 59.1233 29.4205 179.3785 79 V 3.5413 7.7533 117.6575 65.9945 31.5932 177.9573 80 A 3.9575 8.3131 120.4605 54.9703 18.0310 179.6002 81 A 3.9109 7.9412 119.5333 55.3523 18.2939 179.7497 82 I 3.6365 7.6441 117.1898 64.8524 36.9638 178.5721 83 S 4.2584 8.3093 115.9904 61.5174 62.3921 176.3960 84 E 4.0423 8.2932 121.8633 58.6510 29.4749 178.0003 85 S 4.5002 8.0060 111.5286 57.3405 63.8313 174.1315 86 A 4.0785 7.1309 125.9567 51.4835 18.7223 176.0607 87 P 4.4159 0.0000 0.0000 63.1585 31.3891 176.1939 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 4.59 0.00 2.67 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 25 H 8.00 4.47 0.00 3.27 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.84 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 4.18 0.00 3.37 3.42 0.00 5.53 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 6.99 3.21 0.00 2.55 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 7.46 4.19 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 29 M 8.22 4.38 0.00 2.09 2.41 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.78 0.00 30 W 8.22 4.48 0.00 2.72 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 4.53 0.00 3.02 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 3.99 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 33 A 7.95 3.87 1.18 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 0.00 0.00 34 Y 8.12 4.06 0.00 2.94 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 35 V 7.77 3.48 2.31 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 0.91 0.00 0.00 1.07 0.00 0.00 36 L 7.97 4.39 0.00 1.67 1.65 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.58 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 4.26 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 7.59 4.08 0.00 1.69 1.67 0.57 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.44 4.29 0.00 4.04 3.96 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 0.00 0.00 0.00 41 A 8.70 4.01 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 7.93 4.02 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 43 D 8.10 4.64 0.00 2.69 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 44 R 8.55 4.20 0.00 2.06 2.06 0.00 3.22 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.09 0.00 45 R 7.94 3.97 0.00 2.08 2.02 0.00 3.35 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 46 E 8.52 3.94 0.00 2.34 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 2.38 2.44 0.00 47 F 8.91 3.89 0.00 3.47 3.24 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 0.00 48 E 8.54 3.57 0.00 2.16 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 2.30 2.53 0.00 49 A 7.55 3.85 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 50 H 7.70 3.92 0.00 2.42 2.64 0.00 5.81 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 7.77 3.45 0.00 1.40 1.37 0.28 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.52 4.10 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 53 G 7.47 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 54 C 7.67 4.40 0.00 2.69 2.43 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 55 P 0.00 4.27 0.00 2.16 2.05 0.00 3.59 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 56 E 8.03 3.97 0.00 1.99 2.04 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 2.39 2.34 0.00 57 C 7.99 4.30 0.00 2.99 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.98 0.00 1.95 1.93 0.00 3.05 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.74 0.00 59 G 8.42 3.64 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 0.00 0.00 0.00 60 A 7.81 4.05 1.48 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 0.00 0.00 61 V 8.07 3.88 2.35 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 1.25 0.00 0.00 1.10 0.00 0.00 62 T 8.05 3.94 4.44 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 1.23 0.00 0.00 63 E 8.06 4.07 0.00 2.21 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 2.38 0.00 64 L 7.81 4.48 0.00 1.80 1.74 1.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.55 4.60 0.00 3.21 3.31 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 66 G 7.81 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 0.00 0.00 0.00 67 V 7.79 3.59 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 1.03 0.00 0.00 0.97 0.00 0.00 68 P 0.00 4.18 0.00 2.18 2.09 0.00 3.66 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 2.11 2.22 0.00 69 A 7.97 3.99 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 70 L 7.64 4.18 0.00 1.75 1.71 0.93 0.67 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 71 L 8.64 4.02 0.00 1.94 1.72 0.92 0.85 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 72 S 8.08 4.34 0.00 4.01 4.09 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 73 Q 7.88 4.26 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 74 L 7.14 4.98 0.00 1.62 1.63 0.92 0.89 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 75 D 9.12 4.92 0.00 2.61 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 76 R 8.39 3.97 0.00 2.02 2.19 0.00 2.95 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 77 D 8.03 4.32 0.00 2.96 2.96 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 0.00 0.00 0.00 78 E 8.13 3.96 0.00 2.15 2.04 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 2.40 2.36 0.00 79 V 7.75 3.54 2.19 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 1.08 0.00 0.00 0.97 0.00 0.00 80 A 8.31 3.96 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 81 A 7.94 3.91 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 7.64 3.64 2.01 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 0.80 0.91 0.00 0.00 83 S 8.31 4.26 0.00 3.97 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 84 E 8.29 4.04 0.00 2.07 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 0.00 2.32 2.35 0.00 85 S 8.01 4.50 0.00 4.06 3.95 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 86 A 7.13 4.08 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.42 0.00 2.05 2.01 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00