NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 D 4.6256 8.3644 120.5495 53.9377 43.3451 175.3383 26 V 3.4914 7.9128 120.0682 63.3911 32.4754 173.2818 27 M 5.0691 9.4776 128.9493 54.6905 34.4247 174.9458 28 W 5.4617 8.8944 121.5557 55.3645 33.8789 173.6569 29 E 5.3232 9.8560 118.4100 55.3788 34.1470 174.2869 30 Y 5.7627 9.5825 118.5373 54.9950 42.0756 173.9630 31 K 4.5422 8.3932 121.6142 54.6498 35.0049 176.4322 32 W 4.2492 9.1246 127.9363 59.8342 29.1458 176.3047 33 E 4.4029 7.9757 116.2603 55.3151 30.4803 174.7729 34 N 4.0451 8.0380 116.1873 52.7313 39.0246 174.7678 35 T 4.4723 7.4061 106.9720 59.7011 71.2654 175.1593 36 G 3.6305 8.4840 110.0996 46.8547 0.0000 173.6803 37 D 4.6521 7.3770 117.7065 54.2541 42.9979 176.2206 38 A 4.0176 8.1829 121.4339 51.9632 18.8937 177.0901 39 E 3.7742 8.5149 119.3899 56.6272 29.9192 177.3885 40 L 4.2444 7.4013 122.7515 53.0738 42.0678 174.9599 41 Y 4.8034 7.5914 124.0271 56.2055 40.5445 177.3535 42 G 4.3749 8.7319 111.5272 45.8280 0.0000 172.7181 43 P 5.2924 0.0000 0.0000 62.2240 30.0638 174.9660 44 F 5.1520 7.6868 116.9939 55.8541 43.1675 175.4432 45 T 4.2656 8.5818 111.7667 62.0284 69.0999 174.9780 46 S 4.1922 9.4871 118.5028 61.9306 62.2550 176.9151 47 A 3.9605 8.0259 122.8767 55.1740 18.1658 179.2511 48 Q 3.4828 8.3932 118.2682 58.9006 28.8787 178.4958 49 M 4.3976 7.8684 119.6328 58.6276 32.2859 178.0974 50 Q 3.0069 7.7484 119.5046 59.1835 28.7094 178.5994 51 T 3.5808 7.3700 116.2028 66.2732 68.4667 176.4735 52 W 4.1140 7.3179 120.3208 59.6709 29.1762 178.8080 53 V 3.3012 7.7882 118.2151 66.1597 30.8297 178.1088 54 S 4.2088 8.0129 111.4553 60.9591 62.2574 175.5402 55 E 4.1006 8.7793 122.0067 58.1548 27.9765 177.6425 56 G 4.1143 7.6789 103.8103 45.3962 0.0000 175.1727 57 Y 4.0738 7.9632 117.9873 60.1762 38.3130 176.7980 58 F 5.4691 7.0649 117.3563 54.9273 38.6713 173.9906 59 P 4.3410 0.0000 0.0000 64.8944 31.7579 177.7470 60 D 4.6942 8.3955 115.4313 53.2426 41.5740 176.7193 61 G 4.3236 8.2847 101.9023 46.4788 0.0000 172.9578 62 V 4.4990 7.7428 110.4749 59.4695 36.7643 175.2276 63 Y 4.8577 9.0087 120.7577 58.0711 37.0481 174.7969 64 C 5.7332 9.6223 122.3977 58.7819 30.3446 172.6210 65 R 4.9896 8.4710 115.6202 55.3242 32.1296 173.8443 66 K 3.5586 8.0871 120.3813 55.9172 32.8915 176.8418 67 L 4.0232 8.3273 124.9551 56.5607 41.9439 175.9305 68 D 5.1279 7.4777 117.5068 51.3278 43.6264 173.9573 69 P 4.3245 0.0000 0.0000 61.4575 32.1510 174.3457 70 P 4.6470 0.0000 0.0000 61.2351 31.6366 176.8022 71 G 4.8191 8.0007 127.0700 46.1211 0.0000 172.4918 72 G 3.7649 7.5793 108.6429 44.8527 0.0000 175.0369 73 Q 3.7816 8.3353 122.3788 55.1196 28.1375 175.0928 74 F 3.3036 7.4229 113.4425 58.1711 37.0083 175.5869 75 Y 4.2548 8.3304 122.8270 55.3682 39.6839 175.0883 76 N 4.8792 8.6858 124.5769 53.6008 39.1876 175.7024 77 S 3.9451 9.5057 121.4726 61.5187 63.0223 176.1882 78 K 4.3769 9.4310 118.9886 57.4181 31.9576 177.1726 79 R 4.6056 8.8224 118.7382 55.8384 30.7215 174.9887 80 I 4.3179 7.3881 116.4612 60.0803 38.9307 174.5761 81 D 4.6922 8.2012 122.3900 53.0674 41.6268 175.7166 82 F 4.7925 8.7922 125.2200 57.7399 39.0781 175.8410 83 D 5.1024 8.2663 119.2542 53.9829 41.2130 176.8007 84 L 4.6268 7.5186 116.6578 54.6037 43.2395 176.3486 85 Y 4.9042 7.9617 114.7503 59.7865 42.4232 175.2127 86 T 4.2290 8.1142 116.7625 62.2370 67.4981 174.1374 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 25 D 8.36 4.63 0.00 2.74 2.85 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 26 V 7.91 3.49 2.39 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 0.50 0.00 0.00 1.06 0.00 0.00 27 M 9.48 5.07 0.00 2.01 1.92 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 2.66 2.61 0.00 28 W 8.89 5.46 0.00 3.37 3.34 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 29 E 9.86 5.32 0.00 1.98 1.77 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 2.31 2.03 0.00 30 Y 9.58 5.76 0.00 2.56 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 31 K 8.39 4.54 0.00 1.77 1.75 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.55 1.61 7.81 32 W 9.12 4.25 0.00 3.37 3.23 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 0.00 33 E 7.98 4.40 0.00 1.94 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 34 N 8.04 4.05 0.00 2.29 1.90 0.00 0.00 6.53 7.40 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 35 T 7.41 4.47 4.18 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 1.16 0.00 0.00 36 G 8.48 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.38 4.65 0.00 2.50 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 38 A 8.18 4.02 1.23 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 0.00 0.00 0.00 39 E 8.51 3.77 0.00 1.64 1.12 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 2.33 2.42 0.00 40 L 7.40 4.24 0.00 1.37 1.37 0.88 0.79 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 41 Y 7.59 4.80 0.00 2.02 2.48 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 42 G 8.73 4.37 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 0.00 43 P 0.00 5.29 0.00 1.93 1.94 0.00 2.72 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.71 0.00 44 F 7.69 5.15 0.00 3.54 3.21 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 45 T 8.58 4.27 4.34 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 1.30 0.00 0.00 46 S 9.49 4.19 0.00 4.27 4.10 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 47 A 8.03 3.96 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 48 Q 8.39 3.48 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.31 0.00 0.00 0.00 0.00 0.00 1.80 1.16 0.00 49 M 7.87 4.40 0.00 2.27 2.40 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.05 2.99 0.00 50 Q 7.75 3.01 0.00 1.64 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 6.51 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 51 T 7.37 3.58 3.73 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 0.84 0.00 0.00 52 W 7.32 4.11 0.00 3.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.79 3.30 1.90 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 1.02 0.00 0.00 1.14 0.00 0.00 54 S 8.01 4.21 0.00 3.89 3.93 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 0.00 0.00 0.00 55 E 8.78 4.10 0.00 1.94 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 2.29 2.28 0.00 56 G 7.68 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 0.00 0.00 0.00 57 Y 7.96 4.07 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 58 F 7.06 5.47 0.00 3.10 2.93 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 0.00 0.00 0.00 59 P 0.00 4.34 0.00 2.23 2.23 0.00 4.06 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 60 D 8.40 4.69 0.00 2.70 2.81 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 61 G 8.28 4.32 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 0.00 62 V 7.74 4.50 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.11 0.00 0.00 63 Y 9.01 4.86 0.00 3.09 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 64 C 9.62 5.73 0.00 3.31 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 65 R 8.47 4.99 0.00 1.88 2.06 0.00 3.19 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 66 K 8.09 3.56 0.00 1.03 1.14 0.00 1.07 0.00 0.00 0.69 0.00 0.00 2.25 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.30 0.21 7.81 67 L 8.33 4.02 0.00 1.48 1.56 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 68 D 7.48 5.13 0.00 2.48 2.41 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 69 P 0.00 4.32 0.00 2.14 1.96 0.00 3.66 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.90 0.00 70 P 0.00 4.65 0.00 1.99 1.99 0.00 3.80 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 71 G 8.00 4.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.58 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.78 0.00 1.89 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 5.91 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 74 F 7.42 3.30 0.00 2.85 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 0.00 0.00 0.00 75 Y 8.33 4.25 0.00 3.17 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 76 N 8.69 4.88 0.00 2.79 2.79 0.00 0.00 6.96 7.74 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 77 S 9.51 3.95 0.00 4.30 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 0.00 78 K 9.43 4.38 0.00 2.06 2.00 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.58 1.51 7.81 79 R 8.82 4.61 0.00 1.76 1.99 0.00 3.29 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 80 I 7.39 4.32 1.36 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.14 0.11 0.00 0.00 81 D 8.20 4.69 0.00 2.57 2.45 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 82 F 8.79 4.79 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.27 5.10 0.00 2.85 2.61 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 84 L 7.52 4.63 0.00 0.84 1.27 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 7.96 4.90 0.00 3.05 3.02 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 86 T 8.11 4.23 4.36 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 1.32 0.00 0.00