NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 D 4.6340 8.3229 119.5546 53.2549 42.2916 178.0351 15 I 3.3677 7.8003 115.6534 61.3927 36.0193 177.0194 16 A 4.9036 8.0902 121.0695 51.3775 19.4015 175.6694 17 R 4.6964 7.6178 118.2226 54.8499 31.9055 179.1597 18 G 4.1040 8.3808 107.9771 48.6124 0.0000 175.8956 19 F 4.5365 8.0774 119.0707 60.2147 38.7526 176.9905 20 E 4.1074 8.2607 116.9500 58.3166 29.2903 178.6702 21 R 4.0423 7.7544 117.6735 56.4142 30.1504 176.8755 22 G 3.7742 7.8056 106.7385 46.3610 0.0000 173.4904 23 L 4.4967 7.0576 117.7740 52.5250 43.8509 175.7952 24 E 4.6593 8.4570 120.8294 54.8409 30.6768 174.6170 25 P 4.9989 0.0000 0.0000 63.6430 32.1046 175.0540 26 E 4.5378 9.0546 120.5288 57.2501 32.4228 175.6099 27 K 4.4747 7.3261 116.5714 55.4802 35.7078 173.7537 28 I 4.1982 8.3022 128.8779 60.5988 37.7052 175.5824 29 I 4.3074 8.5611 119.6076 59.6489 38.5521 175.2139 30 G 4.1335 7.1393 110.6915 47.0936 0.0000 171.2554 31 A 5.6399 7.8805 119.8499 51.9339 22.3351 175.1917 32 T 4.2287 7.9992 111.3391 61.9826 70.8350 172.3890 33 D 4.7989 8.6751 125.7733 53.0936 42.5321 176.7806 *36 G 3.8947 8.4936 110.3308 45.7363 0.0000 173.6083 37 D 4.7734 7.7706 118.0560 50.8158 41.5123 179.1192 38 L 4.1552 8.4251 126.0028 55.3187 43.1172 175.6297 39 M 4.9902 9.0554 124.9520 53.4607 36.2650 174.2866 40 F 5.3076 8.4750 120.5945 55.6512 42.1443 174.8068 41 L 4.2826 8.7789 126.0145 54.6571 42.9904 174.8151 42 M 4.2661 8.4156 127.6375 53.5890 34.0549 174.6823 43 K 4.3861 8.3514 127.7863 55.3177 33.9887 175.2226 44 W 5.4947 8.1727 128.3734 55.1412 31.5188 177.0807 45 K 4.3682 8.9400 124.4662 55.7752 31.4371 177.9126 46 D 4.6575 9.1439 121.4106 54.0372 39.4678 173.5165 47 T 4.6701 7.6031 112.6165 60.3882 70.0544 174.1455 48 D 4.7958 8.3102 127.1288 52.6586 39.8116 175.5409 49 E 4.9770 7.6376 119.4445 54.8918 34.7822 174.7773 50 A 4.8837 8.4613 122.7102 50.7863 22.5824 175.0399 51 D 4.8276 8.6169 118.5147 52.4776 46.2199 175.0721 52 L 4.5759 8.4515 120.8883 55.2623 42.9526 176.5667 53 V 4.8257 8.3357 114.7199 59.5308 36.6554 174.6826 54 L 4.2573 8.4749 122.8368 54.1503 42.6084 177.9868 55 A 3.7182 8.3020 125.7205 55.1368 17.9011 179.7687 56 K 3.8262 8.0482 117.4763 59.8002 32.1874 178.4474 57 E 4.0274 8.2053 118.6353 59.3576 29.7733 178.4658 58 A 4.3670 8.6396 121.0019 55.0721 18.1887 179.1617 59 N 4.3836 8.3272 114.8462 56.8138 38.7494 177.3017 60 V 3.8656 7.3444 120.6103 66.1886 31.7807 178.3643 61 K 4.2820 8.0652 122.4183 57.9343 33.3305 179.3703 62 C 5.0516 8.4343 113.4484 55.4240 30.5345 172.5607 63 P 4.3575 0.0000 0.0000 66.9581 31.3719 178.5875 64 Q 4.0847 8.1006 117.3857 58.7601 28.7554 178.8148 65 I 3.7723 7.7041 120.3876 64.0953 37.2376 178.2747 66 V 3.3242 7.7172 119.0841 66.1421 31.4305 178.1273 67 I 3.8836 8.4491 119.4391 64.5299 36.7576 178.3746 68 A 4.2127 8.2801 120.6903 54.9181 18.4274 179.1356 69 F 4.2099 8.0781 119.2065 61.4917 39.2400 177.2129 70 Y 3.9431 7.7772 115.4592 60.8114 37.7365 177.8237 71 E 4.0377 7.9739 117.2445 56.6212 29.5859 176.8006 72 E 3.8874 7.6808 124.0597 56.7636 30.2061 174.0939 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 14 D 8.32 4.63 0.00 2.62 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 15 I 7.80 3.37 1.87 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 1.35 1.01 0.91 0.00 0.00 16 A 8.09 4.90 1.13 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 0.00 0.00 17 R 7.62 4.70 0.00 1.87 2.08 0.00 3.17 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 18 G 8.38 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 0.00 0.00 0.00 19 F 8.08 4.54 0.00 3.24 3.07 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 0.00 0.00 0.00 0.00 20 E 8.26 4.11 0.00 2.15 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 2.37 2.42 0.00 21 R 7.75 4.04 0.00 1.34 1.70 0.00 3.17 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 22 G 7.81 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 23 L 7.06 4.50 0.00 0.70 1.41 0.61 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.46 4.66 0.00 1.97 1.97 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 2.39 2.28 0.00 25 P 0.00 5.00 0.00 2.22 2.49 0.00 3.90 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 26 E 9.05 4.54 0.00 2.14 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 2.17 2.23 0.00 27 K 7.33 4.47 0.00 1.77 1.48 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.35 7.81 28 I 8.30 4.20 1.07 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.24 -0.13 0.00 0.00 29 I 8.56 4.31 1.80 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.52 0.81 0.00 0.00 30 G 7.14 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 0.00 0.00 0.00 31 A 7.88 5.64 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 32 T 8.00 4.23 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 1.17 0.00 0.00 33 D 8.68 4.80 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.49 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.77 4.77 0.00 2.70 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.43 4.16 0.00 1.70 1.47 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 39 M 9.06 4.99 0.00 1.80 1.78 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.37 0.00 40 F 8.48 5.31 0.00 2.76 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 41 L 8.78 4.28 0.00 1.63 1.41 0.81 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 42 M 8.42 4.27 0.00 1.03 1.36 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 43 K 8.35 4.39 0.00 1.68 1.63 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.48 7.81 44 W 8.17 5.49 0.00 3.23 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 45 K 8.94 4.37 0.00 1.67 1.72 0.00 1.92 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.26 7.81 46 D 9.14 4.66 0.00 2.87 2.87 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 0.00 0.00 0.00 47 T 7.60 4.67 4.29 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 1.44 0.00 0.00 48 D 8.31 4.80 0.00 2.72 2.63 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 49 E 7.64 4.98 0.00 2.08 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 2.36 2.38 0.00 50 A 8.46 4.88 1.03 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 0.00 0.00 0.00 0.00 0.00 51 D 8.62 4.83 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.45 4.58 0.00 1.71 1.51 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.34 4.83 1.66 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 0.16 0.00 0.00 0.77 0.00 0.00 54 L 8.47 4.26 0.00 1.75 1.56 0.94 0.71 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 55 A 8.30 3.72 0.73 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 0.00 0.00 56 K 8.05 3.83 0.00 1.84 1.85 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.54 7.81 57 E 8.21 4.03 0.00 2.20 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 0.00 2.49 2.46 0.00 58 A 8.64 4.37 1.72 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 0.00 0.00 59 N 8.33 4.38 0.00 2.99 3.01 0.00 0.00 6.98 7.30 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 60 V 7.34 3.87 2.09 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 0.78 0.00 0.00 0.96 0.00 0.00 61 K 8.07 4.28 0.00 1.90 1.70 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.31 7.81 62 C 8.43 5.05 0.00 3.06 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 63 P 0.00 4.36 0.00 2.33 2.51 0.00 3.72 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 64 Q 8.10 4.08 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 65 I 7.70 3.77 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.15 0.82 0.00 0.00 66 V 7.72 3.32 2.36 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 1.36 0.00 0.00 1.24 0.00 0.00 67 I 8.45 3.88 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.10 0.96 0.00 0.00 68 A 8.28 4.21 1.31 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 0.00 0.00 69 F 8.08 4.21 0.00 2.90 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 70 Y 7.78 3.94 0.00 3.17 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 E 7.97 4.04 0.00 2.13 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 2.35 2.49 0.00 72 E 7.68 3.89 0.00 2.05 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.