NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 Q 4.2940 8.3449 121.7161 55.3676 30.2841 174.9780 22 P 4.5281 0.0000 0.0000 61.8584 32.8993 175.7173 23 T 4.9009 8.3340 115.8864 60.4628 71.4846 172.2256 24 S 5.2680 8.6419 120.7398 56.8747 66.8501 172.5862 25 F 5.1446 7.9802 113.9911 55.1017 41.1765 171.9743 26 P 5.0657 0.0000 0.0000 62.7273 32.8329 174.4157 27 L 5.0520 8.6256 119.8813 52.9578 46.3279 176.0848 28 E 4.1240 8.7146 118.6528 57.3807 30.1422 176.3073 29 H 4.0671 9.2553 114.1647 57.6770 26.3175 175.1578 30 N 4.3858 8.3108 110.9855 54.6265 36.6132 174.3827 31 H 5.2489 8.2486 116.3246 55.7975 30.7330 174.0939 32 F 5.1734 8.6193 112.9857 56.1432 41.3463 173.3586 33 G 3.8493 8.5774 108.1441 44.7287 0.0000 172.9594 34 V 5.2302 8.0964 120.3514 60.0996 35.7644 173.7204 *36 E 4.2360 8.6886 119.0746 57.1356 30.0130 175.8073 37 D 4.3346 9.8480 126.6054 54.4432 38.4987 174.5848 38 G 3.6701 8.3983 105.8550 45.8698 0.0000 172.0260 39 Y 5.2173 7.5302 117.0282 56.1602 40.6199 175.2276 40 I 4.6056 9.0376 126.3874 60.4445 39.0885 175.1474 41 K 4.9423 9.1987 126.2201 54.6360 35.4927 175.0249 42 I 4.6610 8.5430 126.2614 59.9949 39.3182 174.5797 43 Y 4.9097 8.6742 123.6290 55.8946 42.4405 173.9025 44 E 4.9263 8.7977 120.2886 54.6660 33.3637 173.3747 45 Y 5.2087 8.9229 127.4945 56.3318 40.6816 175.3614 46 N 4.3928 9.2993 127.7050 51.4145 38.1750 174.5943 47 E 3.1342 8.0014 125.2801 58.5876 30.0895 179.4048 48 S 4.0695 7.9996 111.1489 61.3086 62.8838 175.2358 49 R 4.1023 8.4945 117.3639 55.3093 30.5277 175.4469 50 N 4.2240 7.9787 116.5538 54.7990 37.9550 173.3890 51 E 4.9372 7.9767 115.4265 54.5948 34.2713 176.4684 52 V 5.2742 8.6081 122.3011 61.2399 34.5097 174.5274 53 K 4.7826 8.7315 124.2838 55.2929 36.6576 174.6754 54 L 4.0268 8.4048 123.6790 54.7358 41.9635 176.2941 55 K 4.2302 8.8334 127.0901 58.5880 32.9075 177.2227 56 K 4.6613 7.4533 118.6816 55.0843 35.9802 174.3481 57 E 5.2354 8.5695 122.7276 54.9712 33.2864 174.3963 58 Y 4.9698 9.2093 123.1895 56.2666 43.0814 173.1207 59 A 5.1447 7.7499 125.7909 49.8096 21.7983 176.4798 60 D 4.3302 8.7556 121.8397 57.0172 41.8903 175.4195 61 D 4.1909 7.6356 120.1027 55.2061 40.2404 177.1791 *62 E 4.2024 8.2874 116.3037 56.1637 31.7621 174.3193 63 L 4.1044 7.3997 121.9473 55.0659 41.6266 175.6465 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 21 Q 8.34 4.29 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 22 P 0.00 4.53 0.00 2.08 1.99 0.00 3.69 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 2.03 2.36 0.00 23 T 8.33 4.90 4.31 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 1.36 0.00 0.00 24 S 8.64 5.27 0.00 3.87 3.73 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 25 F 7.98 5.14 0.00 3.22 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 26 P 0.00 5.07 0.00 2.20 2.16 0.00 3.93 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 27 L 8.63 5.05 0.00 1.54 1.67 1.09 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.71 4.12 0.00 1.85 1.64 0.00 0.00 0.00 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 2.30 0.00 29 H 9.26 4.07 0.00 3.33 3.42 0.00 5.86 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.31 4.39 0.00 3.02 3.21 0.00 0.00 7.00 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 31 H 8.25 5.25 0.00 3.32 3.31 0.00 5.85 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.62 5.17 0.00 3.08 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.58 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 34 V 8.10 5.23 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 1.51 0.00 0.00 0.98 0.00 0.00 *36 E 8.69 4.24 0.00 2.20 2.08 0.00 0.00 0.00 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 2.33 0.00 37 D 9.85 4.33 0.00 2.88 2.83 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 0.00 0.00 0.00 38 G 8.40 3.67 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 0.00 0.00 0.00 39 Y 7.53 5.22 0.00 3.00 2.86 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 40 I 9.04 4.61 2.12 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.13 1.08 0.00 0.00 41 K 9.20 4.94 0.00 1.83 1.28 0.00 1.61 0.00 0.00 1.91 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.40 7.81 42 I 8.54 4.66 1.77 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.86 0.89 0.00 0.00 43 Y 8.67 4.91 0.00 1.43 2.43 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 0.00 0.00 0.00 0.00 44 E 8.80 4.93 0.00 1.57 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.05 0.00 45 Y 8.92 5.21 0.00 3.13 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 46 N 9.30 4.39 0.00 2.67 2.56 0.00 0.00 6.35 6.65 0.00 0.00 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 E 8.00 3.13 0.00 1.83 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 2.38 2.45 0.00 48 S 8.00 4.07 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.49 4.10 0.00 1.82 2.14 0.00 3.29 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 50 N 7.98 4.22 0.00 2.77 2.85 0.00 0.00 6.89 7.24 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 51 E 7.98 4.94 0.00 1.94 1.80 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 2.23 2.36 0.00 52 V 8.61 5.27 2.23 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 1.08 0.00 0.00 1.20 0.00 0.00 53 K 8.73 4.78 0.00 1.84 1.86 0.00 1.53 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.53 7.81 54 L 8.40 4.03 0.00 1.59 1.48 0.79 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.83 4.23 0.00 1.67 1.79 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.48 7.81 56 K 7.45 4.66 0.00 1.74 1.54 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.47 7.81 57 E 8.57 5.24 0.00 1.83 1.78 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 2.09 2.18 0.00 58 Y 9.21 4.97 0.00 2.99 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.75 5.14 1.26 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 0.00 0.00 0.00 60 D 8.76 4.33 0.00 2.63 2.66 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 0.00 0.00 0.00 0.00 61 D 7.64 4.19 0.00 2.54 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *62 E 8.29 4.20 0.00 1.88 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 2.18 2.41 0.00 63 L 7.40 4.10 0.00 1.81 1.84 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.