NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8902 8.3549 109.7364 45.2400 0.0000 172.9638 2 K 4.2805 8.4374 121.0481 52.4620 33.4047 174.7103 3 K 4.4256 8.2820 123.7673 55.5937 35.4374 176.8386 4 S 4.5660 8.1390 116.4869 57.2221 66.1499 175.0670 5 K 3.9460 8.4042 121.0956 59.5431 31.8742 178.4356 6 A 4.0312 7.9052 120.7195 55.4079 18.4353 179.5713 7 T 3.8576 7.7549 114.2367 66.5856 68.4495 176.8496 8 K 3.9831 8.0401 121.5193 59.3438 32.2225 179.1561 9 K 4.0278 7.8739 118.4869 59.3720 31.9483 179.6573 10 R 3.9493 8.0976 118.4264 59.3032 30.0898 179.1507 11 L 4.0489 8.1695 118.5905 57.5064 41.6039 179.4767 12 A 3.9963 8.0166 121.0341 54.9641 18.2589 179.6121 13 K 3.9072 8.1322 118.1943 59.6824 32.0780 179.0618 14 L 4.1378 7.7580 118.2547 57.8171 41.6190 178.7214 15 D 4.4702 8.0328 117.7102 57.1963 40.9929 177.8263 16 N 4.3479 8.0975 117.5868 56.6265 38.7517 176.8939 17 Q 4.0739 8.2032 118.6637 58.1597 28.8667 177.1324 18 N 4.6274 7.5145 116.3673 53.4380 39.1580 174.7953 19 S 4.4363 6.9915 114.0842 58.0579 64.2457 173.8049 20 R 4.0794 8.0532 121.2347 55.4711 30.6008 175.9379 21 V 3.6819 7.9982 121.6700 61.1937 31.9302 174.0419 22 P 4.1540 0.0000 0.0000 62.7470 31.7175 176.7970 23 A 3.9966 8.7812 123.1487 55.4189 18.5918 180.0070 24 W 4.4482 8.0094 112.8767 59.4328 28.3413 178.6803 25 V 3.5193 7.0836 118.9819 65.8191 30.7970 177.8947 26 M 4.0947 7.6016 117.3692 57.9837 31.8918 178.4722 27 L 4.2189 7.7436 118.7066 57.0716 41.8905 179.0301 28 K 4.1394 8.1326 119.7486 59.2145 32.2733 177.6537 29 T 4.1499 7.9479 106.4710 61.2458 69.8683 173.8228 30 D 4.2141 7.9509 120.2763 55.5881 38.3628 170.5730 31 R 3.5289 8.3702 124.5586 55.5932 31.3423 177.2157 *35 R 3.8051 8.3906 120.3767 55.9296 30.1890 174.7744 36 N 4.4902 8.3607 122.5580 52.6708 38.6253 174.6344 37 H 4.5894 8.5302 122.7709 56.9639 29.2445 176.1907 38 K 4.5214 7.5231 118.0747 55.9292 32.3771 176.5783 39 R 4.0427 8.0585 118.9955 56.2044 29.8092 176.0343 40 R 4.5895 8.4609 123.3447 54.4834 32.5380 174.2634 41 H 5.0258 8.3826 124.0038 53.7454 32.0016 175.3315 42 W 4.2049 8.3287 121.8855 58.9850 28.3728 177.1435 43 R 3.9908 6.4303 117.6106 58.0866 30.1120 177.4585 44 R 3.8937 7.7505 115.1917 58.3371 30.2026 176.3004 45 N 4.9384 7.5760 113.4508 51.3034 41.0992 173.1723 46 D 4.7716 8.2038 117.4918 52.8796 44.0776 175.0831 47 T 4.4122 8.2231 116.0690 60.3338 71.1366 173.3054 48 D 4.5829 8.3103 121.7034 54.1089 42.1746 176.5804 49 E 4.1202 8.6070 118.4288 57.2836 29.4796 174.7883 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 1 G 8.35 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 2 K 8.44 4.28 0.00 1.82 1.75 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.43 7.81 3 K 8.28 4.43 0.00 1.85 1.79 0.00 1.56 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.41 7.81 4 S 8.14 4.57 0.00 4.07 4.06 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 5 K 8.40 3.95 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.50 7.81 6 A 7.91 4.03 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 7 T 7.75 3.86 4.46 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 1.24 0.00 0.00 8 K 8.04 3.98 0.00 2.00 1.98 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.47 7.81 9 K 7.87 4.03 0.00 2.02 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.61 7.81 10 R 8.10 3.95 0.00 2.04 1.98 0.00 3.30 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 L 8.17 4.05 0.00 1.70 1.72 0.92 0.90 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 12 A 8.02 4.00 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 13 K 8.13 3.91 0.00 1.96 1.98 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 L 7.76 4.14 0.00 1.87 1.74 0.94 1.15 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 15 D 8.03 4.47 0.00 2.82 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.10 4.35 0.00 3.00 2.90 0.00 0.00 7.20 6.75 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 17 Q 8.20 4.07 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 18 N 7.51 4.63 0.00 2.96 2.87 0.00 0.00 7.21 7.53 0.00 0.00 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 S 6.99 4.44 0.00 3.99 3.86 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 0.00 0.00 0.00 20 R 8.05 4.08 0.00 1.77 1.83 0.00 3.21 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 21 V 8.00 3.68 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 0.69 0.00 0.00 0.86 0.00 0.00 22 P 0.00 4.15 0.00 1.56 2.05 0.00 3.50 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.60 0.00 23 A 8.78 4.00 1.38 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 24 W 8.01 4.45 0.00 3.57 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 25 V 7.08 3.52 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 0.83 0.00 0.00 -0.24 0.00 0.00 26 M 7.60 4.09 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.79 0.00 27 L 7.74 4.22 0.00 1.94 1.76 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.13 4.14 0.00 2.10 1.95 0.00 2.13 0.00 0.00 1.98 0.00 0.00 3.14 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.49 7.81 29 T 7.95 4.15 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 1.26 0.00 0.00 30 D 7.95 4.21 0.00 2.94 2.76 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 31 R 8.37 3.53 0.00 1.92 1.94 0.00 3.19 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 *35 R 8.39 3.81 0.00 1.71 1.87 0.00 3.19 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 36 N 8.36 4.49 0.00 2.59 2.69 0.00 0.00 7.27 7.89 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 37 H 8.53 4.59 0.00 3.16 3.31 0.00 5.91 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.52 4.52 0.00 1.75 1.80 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 39 R 8.06 4.04 0.00 1.79 1.90 0.00 3.13 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 40 R 8.46 4.59 0.00 1.74 1.80 0.00 3.23 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 41 H 8.38 5.03 0.00 3.13 3.00 0.00 5.92 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.33 4.20 0.00 3.52 3.12 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 0.00 0.00 0.00 43 R 6.43 3.99 0.00 0.67 1.33 0.00 2.53 0.00 0.00 2.92 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.27 0.00 44 R 7.75 3.89 0.00 1.74 1.90 0.00 3.31 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.46 0.00 45 N 7.58 4.94 0.00 2.92 2.75 0.00 0.00 6.72 9.26 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 46 D 8.20 4.77 0.00 2.57 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 47 T 8.22 4.41 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 1.24 0.00 0.00 48 D 8.31 4.58 0.00 2.70 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 49 E 8.61 4.12 0.00 2.13 1.95 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 2.21 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.