NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 P 4.4108 0.0000 0.0000 62.6264 34.0891 178.2229 15 V 3.3698 7.5981 116.5003 65.5422 31.8484 177.3239 16 F 4.1744 8.5093 117.6818 59.1745 39.2952 176.8677 17 A 4.1112 7.9269 120.9494 54.9581 18.7458 179.3582 18 R 3.9655 7.6154 116.3859 58.9264 29.9307 178.1696 19 E 4.0246 7.7759 119.2803 58.9237 29.7548 177.8965 20 L 3.9322 8.2276 120.2615 58.6444 42.1895 178.2525 21 H 3.9279 8.2650 117.6995 59.6924 29.8089 176.7826 22 A 4.2016 7.7534 120.5941 55.1129 18.1511 179.7242 23 Q 3.9564 7.8445 116.6084 59.2228 28.7667 178.9122 24 L 4.0079 8.0748 120.0652 57.6593 41.5151 179.5104 25 V 3.5734 8.2441 118.6932 66.3570 31.1653 178.1820 26 Q 4.0312 7.8580 115.9432 58.5750 28.6989 178.2769 27 A 4.3036 7.8985 121.8657 55.3085 18.3825 179.3266 28 L 4.0383 8.1982 117.8292 58.3639 41.7588 180.2650 29 G 3.2180 7.9954 105.0065 47.6404 0.0000 175.6388 30 D 4.3335 8.2719 121.3954 57.3320 40.9761 178.9124 31 V 3.6735 7.8152 118.2333 65.8470 31.3953 177.9152 32 K 3.9180 8.7299 118.2749 59.7631 32.1483 179.2354 33 R 3.9858 8.0195 118.1353 59.1406 29.9916 179.1056 34 R 3.5587 7.8379 118.5558 59.2248 29.7965 178.5562 35 L 3.7889 7.5916 118.2318 57.1527 41.3178 179.0510 36 L 4.1647 7.4014 117.7202 56.5655 41.6494 178.2687 37 R 4.2795 7.5384 116.6150 55.4951 30.5160 177.7504 38 G 3.8219 7.8049 109.4853 45.3578 0.0000 172.5253 39 G 3.7864 7.8320 104.1412 45.1551 0.0000 172.5943 40 T 4.4567 7.6853 110.0430 60.8461 71.3886 175.1022 41 Q 4.1608 8.7965 120.5812 59.5077 28.6515 178.9600 42 Q 3.9921 8.3422 119.6848 59.9329 28.8498 179.0408 43 Q 4.1555 7.9919 118.5494 59.0857 28.8529 178.2768 44 Y 4.0709 8.2206 117.7893 61.2388 37.9073 178.5842 45 Q 4.1436 8.4988 120.3851 59.2534 29.2391 178.0539 46 Q 3.8713 8.1673 120.3764 59.2519 29.0406 178.5458 47 W 3.8817 8.5907 120.1770 59.5791 29.0120 178.5604 48 Q 4.1086 9.0586 118.6510 59.2576 28.2793 178.9220 49 Q 4.2616 8.4418 119.2134 58.7250 28.6341 178.6136 50 E 3.7913 7.9743 120.0965 59.3307 29.6820 178.8187 51 A 4.0957 8.2539 120.8976 55.2868 18.3967 179.3243 52 D 4.4069 8.6328 117.5155 56.9351 40.7392 178.9139 53 A 3.9797 7.8113 121.6102 55.1847 18.2890 179.7426 54 I 3.6687 7.5504 117.0806 64.4564 37.2239 178.2471 55 E 4.0895 8.4120 118.6874 59.2473 29.6243 178.8253 56 A 4.3011 8.2030 120.9440 55.0916 18.3152 180.5114 57 G 3.5852 8.0166 103.6110 45.6944 0.0000 175.0169 *59 N 4.7206 8.1805 119.8337 53.0657 40.6608 177.1547 60 I 3.7702 7.8372 117.9359 64.3709 37.2998 178.0130 61 I 3.7990 7.6485 120.8052 65.0625 36.8608 177.5552 62 E 3.7146 8.2270 117.7634 59.8125 29.3377 178.6284 63 K 3.9027 8.1622 120.8541 59.8588 32.3507 179.0042 64 I 3.8997 7.7897 119.6532 64.0792 37.2998 176.0909 65 K 4.1808 7.5019 120.5382 57.0647 32.6542 176.5175 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 P 0.00 4.41 0.00 2.22 2.12 0.00 3.63 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 15 V 7.60 3.37 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.88 0.00 0.00 16 F 8.51 4.17 0.00 3.13 3.06 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 17 A 7.93 4.11 1.36 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 0.00 0.00 0.00 18 R 7.62 3.97 0.00 2.00 1.92 0.00 3.07 0.00 0.00 3.07 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 19 E 7.78 4.02 0.00 2.41 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 2.25 2.36 0.00 20 L 8.23 3.93 0.00 2.03 1.73 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 21 H 8.26 3.93 0.00 3.44 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.75 4.20 1.37 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 23 Q 7.84 3.96 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 24 L 8.07 4.01 0.00 1.80 1.68 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.24 3.57 2.26 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 1.06 0.00 0.00 1.04 0.00 0.00 26 Q 7.86 4.03 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 27 A 7.90 4.30 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.20 4.04 0.00 1.88 1.78 0.94 1.22 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 29 G 8.00 3.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.27 4.33 0.00 2.97 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 3.67 2.34 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 1.34 0.00 0.00 1.21 0.00 0.00 32 K 8.73 3.92 0.00 1.65 1.86 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.53 7.81 33 R 8.02 3.99 0.00 2.04 1.90 0.00 3.09 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 34 R 7.84 3.56 0.00 1.24 1.37 0.00 2.62 0.00 0.00 2.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.53 0.00 35 L 7.59 3.79 0.00 1.92 1.69 1.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.40 4.16 0.00 1.63 1.68 0.89 1.28 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 37 R 7.54 4.28 0.00 1.75 1.84 0.00 3.41 0.00 0.00 3.15 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 38 G 7.80 3.82 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 39 G 7.83 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.69 4.46 4.30 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 1.25 0.00 0.00 41 Q 8.80 4.16 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 42 Q 8.34 3.99 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.59 0.00 43 Q 7.99 4.16 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.54 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 44 Y 8.22 4.07 0.00 3.24 3.06 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 45 Q 8.50 4.14 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 46 Q 8.17 3.87 0.00 2.32 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 47 W 8.59 3.88 0.00 3.54 3.33 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 0.00 48 Q 9.06 4.11 0.00 2.43 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 49 Q 8.44 4.26 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 50 E 7.97 3.79 0.00 1.91 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 1.85 2.16 0.00 51 A 8.25 4.10 1.41 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 0.00 0.00 52 D 8.63 4.41 0.00 2.81 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 53 A 7.81 3.98 1.37 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 54 I 7.55 3.67 1.89 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 1.53 0.76 0.95 0.00 0.00 55 E 8.41 4.09 0.00 1.99 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 2.36 2.48 0.00 56 A 8.20 4.30 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.02 3.59 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 0.00 0.00 0.00 *59 N 8.18 4.72 0.00 3.00 2.92 0.00 0.00 7.03 7.28 0.00 0.00 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 I 7.84 3.77 1.88 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 0.69 0.91 0.00 0.00 61 I 7.65 3.80 1.92 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 1.56 1.03 0.99 0.00 0.00 62 E 8.23 3.71 0.00 2.07 2.14 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 2.41 2.44 0.00 63 K 8.16 3.90 0.00 1.83 2.04 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.52 7.81 64 I 7.79 3.90 2.06 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 1.59 0.77 0.94 0.00 0.00 65 K 7.50 4.18 0.00 1.93 1.82 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.65 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.