NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.4785 0.0000 0.0000 62.0433 32.9203 176.1466 11 L 3.8647 8.7341 124.4093 57.7383 42.1628 176.3383 12 L 4.3784 7.8371 118.1383 54.4251 43.2370 177.3030 13 T 4.2976 8.4808 113.5274 60.5823 71.3114 175.9530 14 K 3.8356 8.4848 121.6360 60.0609 32.0525 178.9160 15 R 4.3955 7.7993 118.8874 58.7975 30.1385 178.7852 16 E 4.1086 8.1098 118.0929 59.1896 29.4201 179.2976 17 R 4.0434 8.2939 119.5912 59.1893 30.0677 178.3965 18 E 4.0972 8.2044 117.5340 59.1305 29.5425 179.5471 19 V 3.5407 7.6551 119.8805 64.7608 31.5799 178.4633 20 F 3.9581 8.1884 118.4849 59.9633 38.5935 177.2826 21 E 4.0347 8.7867 118.7016 59.7598 29.1806 179.6073 22 L 4.0319 7.7821 118.1746 57.5716 41.4282 179.4534 23 L 4.0552 7.8492 118.3000 57.3559 41.7161 179.4637 24 V 3.9206 7.6825 112.6040 64.0463 31.2568 178.8201 25 Q 4.2111 7.4500 114.1925 56.1111 28.4320 176.8637 26 D 4.6889 8.2748 118.1483 54.5901 42.2875 173.7513 27 K 4.3044 7.4873 117.9576 57.4402 30.5668 180.8145 *43 V 3.9134 8.4637 121.8795 61.9259 33.9667 175.2794 44 R 3.9993 8.2164 118.4736 59.2777 29.9793 179.0970 45 N 4.3534 8.0579 116.1893 56.5058 38.0389 176.9861 46 H 4.3508 8.0073 117.0882 58.9036 28.8820 177.6863 47 I 3.9313 7.6386 121.1653 64.5592 36.9507 178.3548 48 S 4.1791 8.1505 115.9114 62.1385 62.7994 176.8985 49 N 4.4705 8.2015 117.6559 55.6840 38.1596 177.4888 50 A 4.0204 7.8209 121.9123 55.3132 18.7729 179.5027 51 M 4.1270 8.3925 117.3928 58.4788 31.7199 178.8457 52 Q 4.0063 7.8542 119.1541 59.0225 29.3788 177.9344 53 K 4.1216 7.9764 118.5374 59.0028 31.8305 178.7026 54 L 4.2855 8.4779 118.9539 54.4490 41.5247 177.6983 55 G 3.8499 7.8247 106.4596 46.5938 0.0000 173.8766 56 V 4.3680 7.1215 110.9461 59.9046 33.9633 176.8838 57 K 4.3915 8.4973 121.6189 55.4510 32.5809 178.1776 58 G 4.3776 7.6129 102.6760 42.6142 0.0000 173.6381 59 R 4.1734 8.5320 119.1535 59.2507 29.6134 179.3646 60 S 4.1578 8.0963 115.3636 61.1412 62.7572 176.2589 61 Q 3.9325 8.0879 121.9625 59.0256 28.8503 177.7897 62 A 3.9516 8.0349 121.8581 55.1042 18.4595 179.7553 63 V 3.5793 8.1083 116.9518 66.1450 31.6833 178.2703 64 V 3.5807 8.0486 118.2315 66.1119 31.3806 177.4211 65 E 3.9221 8.3339 118.9957 59.4386 29.4228 178.8171 66 L 3.9398 8.1512 119.0966 57.5761 41.5995 179.4586 67 L 4.1344 8.0042 118.9256 58.0736 41.4076 179.8170 68 R 3.9704 7.7876 116.4363 59.4282 30.0714 178.5046 69 M 4.2765 7.8276 116.5835 55.6084 32.1339 177.5024 70 G 3.9452 7.7506 106.8286 45.8182 0.0000 174.6967 71 E 4.0807 8.1868 120.0973 58.1166 29.6889 176.7782 72 L 4.8523 7.5048 118.0883 53.1772 45.4153 174.5176 73 E 4.8093 8.3388 120.8439 54.4227 33.5633 175.9920 74 L 4.2332 8.3910 118.7425 55.2132 41.8433 177.1239 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 4.48 0.00 2.04 2.03 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 2.06 0.00 11 L 8.73 3.86 0.00 1.56 1.82 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.84 4.38 0.00 1.63 1.54 0.76 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.48 4.30 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 1.22 0.00 0.00 14 K 8.48 3.84 0.00 1.84 1.85 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.55 7.81 15 R 7.80 4.40 0.00 1.77 1.78 0.00 3.81 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.51 0.00 16 E 8.11 4.11 0.00 2.34 2.12 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 2.61 2.34 0.00 17 R 8.29 4.04 0.00 2.01 2.06 0.00 3.09 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 18 E 8.20 4.10 0.00 2.26 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 0.00 2.36 2.49 0.00 19 V 7.66 3.54 2.03 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 0.91 0.00 0.00 0.61 0.00 0.00 20 F 8.19 3.96 0.00 3.23 3.14 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 0.00 0.00 0.00 0.00 21 E 8.79 4.03 0.00 2.22 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 2.36 2.41 0.00 22 L 7.78 4.03 0.00 1.90 1.68 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.85 4.06 0.00 1.74 1.68 0.28 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.68 3.92 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 0.89 0.00 0.00 1.03 0.00 0.00 25 Q 7.45 4.21 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 5.90 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 26 D 8.27 4.69 0.00 2.76 2.80 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 27 K 7.49 4.30 0.00 1.83 0.97 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.60 7.81 *43 V 8.46 3.91 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 0.99 0.00 0.00 0.87 0.00 0.00 44 R 8.22 4.00 0.00 1.83 1.96 0.00 3.12 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 45 N 8.06 4.35 0.00 2.70 2.81 0.00 0.00 7.18 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.01 4.35 0.00 3.34 3.41 0.00 5.64 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 47 I 7.64 3.93 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.36 0.95 0.00 0.00 48 S 8.15 4.18 0.00 4.19 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 49 N 8.20 4.47 0.00 3.00 2.90 0.00 0.00 7.00 7.43 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 50 A 7.82 4.02 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 51 M 8.39 4.13 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.65 0.00 52 Q 7.85 4.01 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 53 K 7.98 4.12 0.00 1.96 1.83 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.14 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.58 7.81 54 L 8.48 4.29 0.00 1.66 1.67 0.79 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.82 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 56 V 7.12 4.37 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 0.72 0.00 0.00 1.01 0.00 0.00 57 K 8.50 4.39 0.00 1.76 1.71 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.33 1.24 7.81 58 G 7.61 4.38 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 0.00 59 R 8.53 4.17 0.00 2.14 2.25 0.00 2.85 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 60 S 8.10 4.16 0.00 3.91 3.98 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 0.00 0.00 0.00 61 Q 8.09 3.93 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 62 A 8.03 3.95 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 63 V 8.11 3.58 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 1.05 0.00 0.00 1.22 0.00 0.00 64 V 8.05 3.58 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 0.94 0.00 0.00 0.95 0.00 0.00 65 E 8.33 3.92 0.00 2.21 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 2.28 2.37 0.00 66 L 8.15 3.94 0.00 1.77 1.60 0.25 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.00 4.13 0.00 1.91 1.72 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.79 3.97 0.00 1.95 1.99 0.00 3.15 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 69 M 7.83 4.28 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.52 0.00 70 G 7.75 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 0.00 0.00 0.00 71 E 8.19 4.08 0.00 2.07 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 2.30 2.32 0.00 72 L 7.50 4.85 0.00 1.49 1.47 1.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.34 4.81 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 2.20 2.29 0.00 74 L 8.39 4.23 0.00 1.64 1.58 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.