NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.3960 0.0000 0.0000 61.9050 32.8290 175.8057 11 T 3.7234 8.3209 116.2651 62.7289 68.7632 172.8874 12 K 3.9630 9.2805 127.9581 56.4128 33.7073 176.3249 13 L 4.2675 8.1580 125.7446 54.4708 42.3070 176.8468 14 E 4.2069 8.7023 121.0034 56.7193 30.2583 176.2136 15 T 4.9172 7.8427 117.1109 62.2900 70.3469 174.2881 16 F 4.9185 9.0157 123.2783 54.8307 43.2285 173.2679 17 P 4.4060 0.0000 0.0000 62.5326 32.2400 177.1705 18 L 3.9906 8.8756 124.4243 58.5954 41.9336 179.3075 19 D 4.3780 8.0876 118.4598 56.3765 39.0129 178.5550 20 V 3.5656 7.7778 119.2679 65.8675 31.3998 177.8969 21 L 3.9636 7.6764 117.4478 57.4988 41.5228 179.1315 22 V 3.8404 7.8647 117.4333 64.8462 31.6811 176.8414 23 N 4.7456 8.1985 113.6243 52.3553 39.3606 174.6927 24 T 4.4075 6.9576 117.5545 61.2270 70.3122 174.6791 25 A 4.0463 8.3924 128.5739 51.9875 19.3174 177.8571 26 A 3.9273 8.8171 124.3798 55.4104 18.3646 179.7153 27 E 4.1508 8.0734 110.1432 57.8526 29.9629 176.8215 28 D 4.7269 7.7126 118.5630 54.0474 41.5205 176.5554 29 L 4.0894 7.1728 119.7763 53.3182 42.4930 175.1760 30 P 4.2707 0.0000 0.0000 62.0859 31.8518 176.2011 31 R 4.0247 8.3055 120.5301 58.1861 30.2164 177.2357 32 G 3.9408 8.8227 111.6929 45.5160 0.0000 173.1814 33 V 3.2624 7.3460 120.1328 61.0374 31.9404 174.7206 34 D 4.6292 8.7703 128.6477 52.2413 40.9271 175.0431 35 P 4.3842 0.0000 0.0000 64.3844 31.3483 176.9276 36 S 4.5275 8.5590 113.4899 58.8065 63.8641 174.2190 37 R 4.9921 8.0508 121.2868 54.8852 31.3099 177.4132 38 K 4.2106 8.6158 119.7289 59.8416 32.0594 178.2533 39 E 4.2573 8.4156 117.1935 59.4580 29.1971 178.4545 40 N 4.4429 8.2614 115.8796 54.9634 38.8462 175.6628 41 Y 4.6653 8.0152 117.3668 56.9864 38.6423 175.5211 42 L 4.5721 7.2420 120.8024 54.1363 42.6445 177.6262 43 S 4.4419 8.4203 116.4785 58.1525 65.1019 175.0631 44 D 4.4117 8.5965 122.2174 57.5453 40.5536 178.7110 45 E 3.9499 8.1578 119.2383 59.5258 29.6440 178.5484 46 D 4.3673 8.2049 118.9578 57.0970 40.7806 178.5184 47 F 3.9854 8.7086 121.6806 61.1312 39.3839 177.0003 48 K 4.0317 8.5943 119.3078 59.6714 31.7930 178.5667 49 A 3.9277 7.8124 119.6781 55.0628 18.3348 179.4820 50 V 3.3550 7.6567 116.0356 65.1861 31.6798 177.4206 51 F 4.7684 7.8721 114.9293 55.8431 40.2083 175.7416 52 G 4.0882 8.1768 106.9842 45.7529 0.0000 172.6046 53 M 4.6622 7.7348 113.3061 52.9277 34.0168 174.5787 54 T 4.2888 8.2126 109.9537 61.3498 71.0472 175.6797 55 R 3.5083 8.2140 121.2486 59.3377 30.2048 179.5032 56 S 4.0769 7.9912 113.3653 61.2675 62.7999 176.1995 57 A 3.9820 7.8554 123.5628 54.8584 18.4708 179.0422 58 F 4.0747 8.4497 118.8924 61.4721 39.3313 177.2580 59 A 4.0840 8.3075 118.9751 54.5349 18.2204 178.3546 60 N 4.5504 7.5660 112.4855 52.9476 39.3176 175.6610 61 L 4.0563 6.7020 120.6642 53.3608 42.6193 175.8011 62 P 4.2990 0.0000 0.0000 62.2724 33.1651 177.4194 63 L 3.8478 8.4647 122.2935 58.1624 41.9414 179.4735 64 W 4.1725 8.1195 116.1149 59.4608 27.8606 178.1355 65 K 2.9879 6.2901 119.7394 58.7214 31.5453 178.5626 66 Q 3.3674 7.4117 118.2518 58.9788 28.5294 179.0799 67 Q 3.9835 8.1530 119.0524 59.0473 28.8203 178.6460 68 N 4.3108 8.2312 117.5298 56.2681 38.3120 177.4928 69 L 4.1233 8.2307 120.6692 57.8514 41.7068 179.7863 70 K 4.3724 8.3861 118.5138 59.4286 31.8787 179.5189 71 K 4.0679 8.5130 119.2733 59.5822 31.8098 178.8215 72 E 4.2595 8.1171 116.2652 57.6719 29.4914 178.1255 73 K 4.5245 7.2004 117.1486 55.1662 32.9224 176.3739 74 G 3.9380 7.8409 106.9025 46.4848 0.0000 174.4784 75 L 4.6007 8.2060 116.8393 54.1058 42.2176 176.5781 76 F 4.5391 8.1826 126.6274 58.3080 39.3601 175.2333 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 10 P 0.00 4.40 0.00 2.05 2.07 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.11 0.00 11 T 8.32 3.72 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 1.22 0.00 0.00 12 K 9.28 3.96 0.00 1.69 1.70 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.42 7.81 13 L 8.16 4.27 0.00 1.50 1.43 0.25 0.98 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 14 E 8.70 4.21 0.00 2.12 1.55 0.00 0.00 0.00 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 2.41 0.00 15 T 7.84 4.92 4.13 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 1.28 0.00 0.00 16 F 9.02 4.92 0.00 2.93 2.92 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 17 P 0.00 4.41 0.00 2.27 2.01 0.00 3.81 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 2.18 2.13 0.00 18 L 8.88 3.99 0.00 1.88 1.68 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.09 4.38 0.00 2.91 2.92 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 20 V 7.78 3.57 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 1.00 0.00 0.00 0.99 0.00 0.00 21 L 7.68 3.96 0.00 1.89 1.74 1.19 0.60 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 22 V 7.86 3.84 2.14 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 0.83 0.00 0.00 0.97 0.00 0.00 23 N 8.20 4.75 0.00 2.85 2.82 0.00 0.00 6.96 7.25 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 24 T 6.96 4.41 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 25 A 8.39 4.05 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 26 A 8.82 3.93 1.26 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 27 E 8.07 4.15 0.00 2.06 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 2.24 2.25 0.00 28 D 7.71 4.73 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.17 4.09 0.00 1.53 1.30 0.80 0.76 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 30 P 0.00 4.27 0.00 1.45 1.86 0.00 2.98 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.81 0.00 31 R 8.31 4.02 0.00 1.77 1.88 0.00 3.31 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 32 G 8.82 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.35 3.26 1.73 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 -0.06 0.00 0.00 0.21 0.00 0.00 34 D 8.77 4.63 0.00 2.83 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 35 P 0.00 4.38 0.00 2.13 2.06 0.00 3.76 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 1.92 1.88 0.00 36 S 8.56 4.53 0.00 3.93 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 37 R 8.05 4.99 0.00 2.02 1.98 0.00 3.33 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 38 K 8.62 4.21 0.00 2.05 1.99 0.00 1.88 0.00 0.00 2.00 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.71 7.81 39 E 8.42 4.26 0.00 2.18 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 0.00 2.42 1.98 0.00 40 N 8.26 4.44 0.00 2.50 2.59 0.00 0.00 6.94 6.98 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 41 Y 8.02 4.67 0.00 3.36 3.32 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 42 L 7.24 4.57 0.00 1.95 1.75 1.03 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.42 4.44 0.00 4.06 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 44 D 8.60 4.41 0.00 2.72 2.78 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 45 E 8.16 3.95 0.00 2.05 1.96 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 2.39 2.42 0.00 46 D 8.20 4.37 0.00 2.93 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 47 F 8.71 3.99 0.00 3.30 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.59 4.03 0.00 2.03 2.01 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.54 7.81 49 A 7.81 3.93 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 50 V 7.66 3.36 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 -0.46 0.00 0.00 0.72 0.00 0.00 51 F 7.87 4.77 0.00 2.49 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 52 G 8.18 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 0.00 0.00 0.00 53 M 7.73 4.66 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.84 0.00 54 T 8.21 4.29 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 1.25 0.00 0.00 55 R 8.21 3.51 0.00 1.59 1.67 0.00 2.82 0.00 0.00 2.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.82 0.00 56 S 7.99 4.08 0.00 4.03 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 57 A 7.86 3.98 1.44 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 0.00 0.00 58 F 8.45 4.07 0.00 3.28 3.35 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 59 A 8.31 4.08 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 60 N 7.57 4.55 0.00 2.89 2.82 0.00 0.00 7.02 7.13 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 61 L 6.70 4.06 0.00 1.24 1.15 0.57 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.30 0.00 1.65 2.05 0.00 3.21 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 63 L 8.46 3.85 0.00 1.74 1.71 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 64 W 8.12 4.17 0.00 3.61 3.30 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 65 K 6.29 2.99 0.00 0.79 1.05 0.00 1.16 0.00 0.00 1.09 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.98 1.11 7.81 66 Q 7.41 3.37 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 1.16 2.01 0.00 67 Q 8.15 3.98 0.00 2.09 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 68 N 8.23 4.31 0.00 2.88 2.94 0.00 0.00 7.07 6.26 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 69 L 8.23 4.12 0.00 2.10 2.11 1.03 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.39 4.37 0.00 2.29 2.15 0.00 2.03 0.00 0.00 2.06 0.00 0.00 3.31 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.77 1.87 7.81 71 K 8.51 4.07 0.00 1.89 1.86 0.00 1.39 0.00 0.00 1.47 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.22 7.81 72 E 8.12 4.26 0.00 2.00 2.02 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 2.61 2.52 0.00 73 K 7.20 4.52 0.00 1.58 1.65 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.17 7.81 74 G 7.84 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.21 4.60 0.00 1.79 1.84 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.18 4.54 0.00 3.05 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00