NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9469 8.2133 109.7365 45.9596 0.0000 176.6097 0 S 4.0166 8.2404 114.1941 57.6463 62.5298 173.5831 2 E 3.4339 8.1128 117.9393 58.6257 32.8008 177.7771 3 R 4.0185 7.5579 119.7531 59.0865 29.5584 178.7309 4 I 3.7800 7.5406 119.2934 63.2034 38.0448 177.8438 5 K 4.1017 7.9793 119.0356 58.9913 32.0446 178.7645 6 E 4.0930 8.1740 118.9766 58.5736 29.1538 178.9493 7 L 3.8596 7.6365 119.8650 58.1373 42.3152 178.2546 8 R 4.0246 7.5972 117.2843 59.7967 29.9672 177.3966 9 N 4.4831 7.8047 114.7103 56.4141 39.2398 177.1648 10 L 4.2699 7.5424 119.9415 54.8475 42.1186 178.0827 *12 S 4.4555 7.9536 113.2180 58.0158 65.0011 174.1383 13 Q 4.5767 7.5248 119.7670 53.2060 32.6511 176.0945 14 S 4.1432 8.7160 117.6641 61.1282 63.1930 176.8461 15 R 3.8439 7.8662 122.3382 59.6441 30.1040 178.3844 16 T 3.8969 7.8450 109.1620 64.5737 68.6943 175.9411 17 R 3.8478 8.1716 121.6923 59.2637 30.0039 177.8138 18 E 3.8936 7.9241 118.3268 59.5113 29.6240 178.5831 19 I 3.6778 7.5024 119.0237 64.6794 37.0421 178.2724 20 L 4.1622 7.8553 119.8044 58.1429 41.9486 178.7855 21 T 4.0862 8.2406 109.7339 64.0925 69.0987 176.2196 22 K 4.4663 8.1799 118.9998 55.5640 32.9406 176.5538 23 T 4.3255 7.9222 117.5938 62.5624 69.0965 174.8443 24 T 4.2818 8.1360 116.8056 60.4016 70.2891 175.6044 25 V 3.5929 8.4902 122.5525 66.4336 30.1885 177.2114 26 D 4.5264 8.1170 118.7685 57.6857 41.2719 177.0093 27 H 4.6936 8.0126 117.3632 55.7361 28.3109 176.9616 *29 A 4.3311 7.9449 123.4949 52.3326 20.6512 179.7807 30 I 3.8961 7.1633 115.5070 64.4068 37.7420 177.8342 31 I 4.0321 8.1088 121.4458 64.1255 37.3460 177.9516 32 K 3.7969 8.3235 121.0815 59.5208 31.8783 177.9294 33 K 4.0603 7.5917 115.9219 57.9480 31.7678 176.3330 34 Y 4.8644 7.8692 114.0493 58.5332 39.7929 175.2261 35 T 4.0810 7.7130 116.2966 62.1337 68.6754 173.7764 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 8.21 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 0 S 8.24 4.02 0.00 3.98 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 E 8.11 3.43 0.00 2.27 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 2.31 2.40 0.00 3 R 7.56 4.02 0.00 2.10 2.23 0.00 2.77 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 4 I 7.54 3.78 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 1.52 1.19 0.97 0.00 0.00 5 K 7.98 4.10 0.00 1.98 1.83 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.52 7.81 6 E 8.17 4.09 0.00 2.03 1.99 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 2.33 2.64 0.00 7 L 7.64 3.86 0.00 1.85 1.82 0.92 0.88 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 8 R 7.60 4.02 0.00 1.86 2.20 0.00 3.32 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 9 N 7.80 4.48 0.00 2.78 2.97 0.00 0.00 7.34 7.25 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 10 L 7.54 4.27 0.00 1.92 1.68 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 *12 S 7.95 4.46 0.00 4.05 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 13 Q 7.52 4.58 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 14 S 8.72 4.14 0.00 4.05 4.12 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 15 R 7.87 3.84 0.00 1.94 1.95 0.00 3.23 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 16 T 7.85 3.90 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 1.21 0.00 0.00 17 R 8.17 3.85 0.00 1.97 2.17 0.00 3.11 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 18 E 7.92 3.89 0.00 2.17 2.25 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 2.31 2.37 0.00 19 I 7.50 3.68 2.05 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 1.41 0.45 0.92 0.00 0.00 20 L 7.86 4.16 0.00 1.97 1.79 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.24 4.09 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 22 K 8.18 4.47 0.00 1.80 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.61 7.81 23 T 7.92 4.33 4.33 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 1.25 0.00 0.00 24 T 8.14 4.28 4.16 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 0.00 0.00 0.00 1.14 0.00 0.00 25 V 8.49 3.59 2.07 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 0.82 0.00 0.00 0.93 0.00 0.00 26 D 8.12 4.53 0.00 2.71 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 27 H 8.01 4.69 0.00 3.38 3.29 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *29 A 7.94 4.33 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 30 I 7.16 3.90 2.05 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 1.36 0.81 1.02 0.00 0.00 31 I 8.11 4.03 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.82 0.95 0.00 0.00 32 K 8.32 3.80 0.00 1.79 1.97 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.44 7.81 33 K 7.59 4.06 0.00 1.52 1.55 0.00 1.63 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.36 1.02 7.81 34 Y 7.87 4.86 0.00 3.00 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 35 T 7.71 4.08 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 1.33 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.