NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3594 8.1233 123.5829 51.8701 20.4591 179.2445 5 L 3.7940 8.0934 122.9210 58.6535 41.7444 177.2263 6 L 3.9879 8.0745 118.6706 57.7273 42.0610 179.1226 7 R 3.9216 7.9077 118.0392 59.6299 30.1596 178.4609 8 Q 3.9557 8.7593 117.9457 58.7766 28.6276 178.4816 9 A 3.6563 8.6876 122.8909 55.1393 18.3934 178.8710 10 Y 4.0124 8.1748 118.1954 61.1611 38.6897 178.6815 11 S 3.9512 7.9120 114.1718 61.4226 63.0209 176.1747 12 A 4.1556 7.8637 122.1665 53.6927 18.8594 177.7905 13 L 4.4150 7.8214 115.9596 56.4850 43.3163 178.7071 14 F 5.0857 7.4624 113.9424 59.1652 39.3033 177.0313 15 R 3.6587 7.5335 121.2175 58.9592 30.3533 177.0381 16 R 4.1969 7.6272 116.5219 55.8969 31.7191 177.8239 17 T 3.9603 8.6353 120.3552 66.4710 68.5628 176.9944 18 S 4.1464 8.0179 116.1821 61.8450 63.3347 176.6086 19 T 3.9430 7.9355 113.7373 63.9703 68.4676 175.9444 20 F 4.2687 8.7032 124.8721 60.5194 39.4497 177.0280 21 A 4.1461 8.0140 120.5611 55.2438 18.2434 179.6543 22 L 3.9986 7.9009 117.1062 58.2300 41.6637 179.9228 23 T 3.8786 8.0222 115.8206 66.4746 68.3321 176.9417 24 V 3.5371 7.4600 119.8901 65.4628 31.4289 178.4574 25 V 3.5632 7.6287 118.0781 66.1095 31.4368 178.1563 26 L 4.1159 8.1267 118.8601 57.5047 41.3580 179.8414 27 G 3.5755 8.2370 105.6648 47.7305 0.0000 175.6080 28 A 4.0844 8.0852 123.5832 54.7164 18.3545 179.7876 29 V 3.5441 7.9918 116.7671 66.3768 31.6447 178.3533 30 L 4.0592 8.2850 118.9461 57.5559 41.3379 179.2954 31 F 4.0742 8.7806 121.1580 61.1801 39.3406 176.5093 32 E 4.0735 8.8446 119.2629 59.4215 29.3028 178.4778 33 R 3.8379 7.7909 117.8025 59.6417 30.0852 178.3148 34 A 3.9123 7.8755 120.1888 55.0492 18.3137 179.3746 35 F 3.7836 8.4783 120.0924 61.2924 39.3250 176.9930 36 D 4.1526 8.3953 118.8325 57.5557 40.8063 178.6046 37 Q 4.0428 7.8176 118.3482 59.0180 28.6628 179.6537 38 G 3.4187 8.0990 106.2673 47.6843 0.0000 175.6496 39 A 3.7745 7.7101 124.0533 54.8712 18.4038 179.5114 40 D 4.3267 8.6301 117.3483 57.1529 40.7713 179.0251 41 A 3.9441 7.7893 121.2821 55.2922 18.5541 179.3720 42 I 3.6723 7.8817 118.2789 64.7219 36.9666 178.4251 43 F 4.1019 8.2023 120.1195 61.5317 39.7182 176.8125 44 E 4.0040 8.2574 118.0959 59.5967 28.9918 178.9916 45 H 4.1233 8.8245 118.6953 59.1136 29.8109 176.9214 46 L 4.2418 7.6753 118.2016 56.0882 41.6375 177.0712 47 N 4.9295 7.6049 116.6198 52.3574 39.9226 173.7829 48 E 3.8879 7.5064 117.3520 58.4028 29.8159 178.3156 49 G 3.9696 7.8378 109.7581 45.6223 0.0000 174.0942 50 K 4.3760 8.0139 117.7912 57.1031 33.6807 177.1415 51 L 4.4025 7.5500 118.1672 53.5569 42.6216 177.5625 52 W 4.3569 8.7989 129.7621 60.3529 30.2878 177.9978 53 K 3.7960 8.1495 118.7908 60.0082 31.6123 177.8613 54 H 4.4718 7.8221 115.1021 58.5864 28.9584 177.4750 55 I 3.7831 7.9013 121.0525 64.3989 37.2769 179.0073 56 K 3.1720 7.4758 121.2849 58.9161 32.6624 177.1724 57 H 4.0145 7.9118 113.1806 58.6207 28.2580 176.3971 58 K 3.7962 7.5264 118.7332 58.7057 31.6943 177.2787 59 Y 4.5576 7.1013 112.6975 57.9097 39.6410 176.4088 60 E 4.2099 7.9737 121.7016 56.5402 27.3907 175.6927 61 A 3.6932 7.8810 125.3423 52.8057 15.4655 177.5331 62 S 4.6241 7.9113 113.8316 56.8945 65.7999 174.0242 63 E 4.6619 7.8812 117.6688 54.1747 32.7382 175.6463 64 E 4.1377 8.7494 118.0273 57.2217 29.7807 175.0365 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 4 A 8.12 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.09 3.79 0.00 1.79 1.73 0.93 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.07 3.99 0.00 1.71 1.77 0.95 0.92 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 7 R 7.91 3.92 0.00 1.89 2.12 0.00 3.19 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 8 Q 8.76 3.96 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 9 A 8.69 3.66 1.10 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 0.00 0.00 10 Y 8.17 4.01 0.00 3.23 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 11 S 7.91 3.95 0.00 3.91 3.91 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 12 A 7.86 4.16 1.22 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 0.00 0.00 13 L 7.82 4.42 0.00 1.06 1.58 0.65 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.46 5.09 0.00 3.05 3.18 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 15 R 7.53 3.66 0.00 1.35 1.72 0.00 3.03 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 0.00 16 R 7.63 4.20 0.00 1.90 1.84 0.00 3.17 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 17 T 8.64 3.96 4.23 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 0.00 0.00 0.00 1.18 0.00 0.00 18 S 8.02 4.15 0.00 4.07 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 0.00 19 T 7.94 3.94 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 1.21 0.00 0.00 20 F 8.70 4.27 0.00 3.30 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 21 A 8.01 4.15 1.45 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 0.00 0.00 0.00 22 L 7.90 4.00 0.00 1.75 1.73 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.02 3.88 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 24 V 7.46 3.54 2.20 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 0.96 0.00 0.00 0.72 0.00 0.00 25 V 7.63 3.56 2.22 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 0.99 0.00 0.00 1.02 0.00 0.00 26 L 8.13 4.12 0.00 1.88 1.71 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.24 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 4.08 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 29 V 7.99 3.54 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 1.05 0.00 0.00 1.01 0.00 0.00 30 L 8.28 4.06 0.00 1.78 1.75 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.78 4.07 0.00 3.20 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 32 E 8.84 4.07 0.00 2.28 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 0.00 2.57 2.42 0.00 33 R 7.79 3.84 0.00 1.91 2.06 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 34 A 7.88 3.91 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 35 F 8.48 3.78 0.00 1.84 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.40 4.15 0.00 2.70 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 37 Q 7.82 4.04 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 38 G 8.10 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.71 3.77 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 40 D 8.63 4.33 0.00 2.80 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 41 A 7.79 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.88 3.67 2.03 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.88 0.95 0.00 0.00 43 F 8.20 4.10 0.00 3.05 3.25 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 0.00 44 E 8.26 4.00 0.00 2.14 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 2.47 2.82 0.00 45 H 8.82 4.12 0.00 3.18 3.41 0.00 5.59 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 46 L 7.68 4.24 0.00 1.65 1.61 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 47 N 7.60 4.93 0.00 2.36 2.56 0.00 0.00 6.86 7.64 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 48 E 7.51 3.89 0.00 1.80 1.80 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 2.22 2.31 0.00 49 G 7.84 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 50 K 8.01 4.38 0.00 1.89 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.38 7.81 51 L 7.55 4.40 0.00 1.46 1.59 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.80 4.36 0.00 3.38 3.10 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 53 K 8.15 3.80 0.00 1.80 1.71 0.00 1.85 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.57 7.81 54 H 7.82 4.47 0.00 3.29 3.28 0.00 5.72 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.90 3.78 1.84 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.97 1.14 0.00 0.00 56 K 7.48 3.17 0.00 0.79 1.26 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.20 1.21 7.81 57 H 7.91 4.01 0.00 3.15 3.37 0.00 5.78 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.53 3.80 0.00 0.79 1.06 0.00 1.42 0.00 0.00 1.45 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.02 7.81 59 Y 7.10 4.56 0.00 3.04 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 60 E 7.97 4.21 0.00 2.01 1.87 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 2.32 2.34 0.00 61 A 7.88 3.69 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 62 S 7.91 4.62 0.00 3.92 3.81 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 63 E 7.88 4.66 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 64 E 8.75 4.14 0.00 2.07 1.91 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 2.24 2.36 0.00