NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 P 4.3846 0.0000 0.0000 62.9249 32.2769 176.1041 15 V 3.9955 8.2070 118.4671 63.1520 31.5655 177.3806 16 F 3.9483 8.4323 121.8957 61.8682 39.9959 176.1818 17 A 4.1329 8.2765 119.8500 55.4386 18.0573 179.3826 18 R 3.9765 8.0251 116.5807 59.4733 30.0287 178.1423 19 E 3.9552 7.7562 118.4873 58.7439 29.6602 178.3643 20 L 3.9041 8.2359 121.0378 57.9714 42.0481 178.2885 21 H 4.0580 8.8113 118.5479 59.3003 29.8820 177.1438 22 A 4.0054 7.8646 122.3178 55.0350 18.1273 179.7114 23 Q 3.8863 7.6844 116.7273 59.2301 28.7854 178.9242 24 L 3.9656 7.9117 119.9132 57.8144 41.7708 179.6460 25 V 3.5309 8.0411 118.5051 66.2634 31.4490 178.1660 26 Q 4.0105 8.0435 117.0594 58.7114 28.6143 178.3883 27 A 4.2019 7.9115 121.9114 55.2007 18.3180 179.6924 28 L 4.1060 8.3458 117.9047 57.8209 41.5870 179.9004 29 G 3.4338 7.9264 105.3338 47.8907 0.0000 175.5063 30 D 4.2958 7.9547 120.9173 57.0005 40.8363 178.9832 31 V 3.4263 7.6527 118.4399 66.0175 31.4308 177.9023 32 K 3.8490 8.5347 117.9115 59.8073 32.1721 179.1320 33 R 3.9785 8.1224 118.0123 59.2984 29.9968 178.8269 34 R 3.5640 7.7394 118.4802 59.4958 29.6117 178.0088 35 L 4.1353 7.6285 116.3359 56.3847 41.7132 178.4161 36 L 4.3019 7.9079 118.7290 56.0988 41.9552 177.5453 37 R 4.0322 7.6047 116.0118 55.4073 30.4474 177.4820 38 G 4.4474 7.8349 108.8035 44.1313 0.0000 172.4200 39 G 3.7103 7.6032 103.2908 45.1701 0.0000 172.7391 40 T 4.3821 7.5825 110.5769 61.1756 71.3104 175.1480 41 Q 4.3305 8.6561 119.2846 58.6996 28.5922 178.6742 42 Q 3.9458 8.1108 120.6883 59.4007 29.2206 177.9720 43 Q 4.0766 8.1560 118.9377 59.1208 28.7084 178.5382 44 Y 4.2124 8.0784 117.6857 61.2567 37.9535 178.5127 45 Q 4.0456 8.2175 120.2256 59.3945 29.1647 178.2346 46 Q 3.8907 8.1683 118.9428 58.9980 28.7003 179.1672 47 W 4.1482 8.3763 119.6782 59.5402 29.0075 178.7337 48 Q 4.1324 8.6497 118.8078 58.7253 28.1352 178.3076 49 Q 4.0799 8.4516 121.3816 58.9977 29.0739 177.8252 50 E 3.8724 8.1438 120.2399 59.2578 29.6329 178.6015 51 A 4.0971 8.3408 120.9235 55.2947 18.4102 179.3793 52 D 4.5143 8.6078 118.6587 56.8273 40.9159 178.6688 53 A 3.9713 8.0288 121.2177 55.4530 18.1993 179.7731 54 I 3.6977 7.5489 116.6906 64.6324 37.1292 178.2920 55 E 4.1070 8.6085 119.5148 59.2354 29.1971 179.1930 56 A 4.2551 8.6625 121.5121 54.9000 18.3725 180.4798 57 G 3.8541 7.8740 101.2972 45.5174 0.0000 175.2194 *59 N 4.6817 8.0843 119.0362 53.1748 40.6907 176.8345 60 I 3.6810 7.9554 118.7517 64.6609 36.8402 178.4002 61 I 3.7397 7.8393 119.0805 63.9291 37.4770 177.2986 62 E 4.1518 8.0075 118.9697 58.3340 29.7764 177.5295 63 K 4.3001 7.9983 116.0817 57.0018 32.4347 178.2268 64 I 4.0786 7.2827 120.5806 63.4776 37.7391 176.0486 65 K 4.2326 7.5031 122.1894 56.8128 32.1768 176.0783 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 4.38 0.00 2.17 2.16 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.09 0.00 15 V 8.21 4.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 16 F 8.43 3.95 0.00 3.22 3.04 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 0.00 0.00 0.00 17 A 8.28 4.13 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 18 R 8.03 3.98 0.00 1.90 2.12 0.00 3.18 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 19 E 7.76 3.96 0.00 2.21 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 20 L 8.24 3.90 0.00 1.72 1.66 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 21 H 8.81 4.06 0.00 3.35 3.44 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 7.86 4.01 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 23 Q 7.68 3.89 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 24 L 7.91 3.97 0.00 1.74 1.69 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.04 3.53 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.86 0.00 0.00 26 Q 8.04 4.01 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 27 A 7.91 4.20 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 28 L 8.35 4.11 0.00 1.82 1.74 0.93 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.93 3.43 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 0.00 0.00 0.00 30 D 7.95 4.30 0.00 2.88 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 31 V 7.65 3.43 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.20 0.00 0.00 32 K 8.53 3.85 0.00 1.78 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.61 7.81 33 R 8.12 3.98 0.00 2.00 1.88 0.00 3.10 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 34 R 7.74 3.56 0.00 1.17 1.42 0.00 2.68 0.00 0.00 2.57 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.64 0.00 35 L 7.63 4.14 0.00 1.84 1.81 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.91 4.30 0.00 1.68 1.69 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.60 4.03 0.00 1.78 1.88 0.00 3.16 0.00 0.00 3.12 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 38 G 7.83 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.60 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 4.38 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 1.24 0.00 0.00 41 Q 8.66 4.33 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.95 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 42 Q 8.11 3.95 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 43 Q 8.16 4.08 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 44 Y 8.08 4.21 0.00 3.25 3.03 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 0.00 0.00 0.00 0.00 45 Q 8.22 4.05 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 46 Q 8.17 3.89 0.00 2.12 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 47 W 8.38 4.15 0.00 3.64 3.30 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 0.00 48 Q 8.65 4.13 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 49 Q 8.45 4.08 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 50 E 8.14 3.87 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 51 A 8.34 4.10 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 52 D 8.61 4.51 0.00 2.89 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 8.03 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 3.70 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.74 0.92 0.00 0.00 55 E 8.61 4.11 0.00 2.15 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 2.35 2.62 0.00 56 A 8.66 4.26 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 57 G 7.87 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 *59 N 8.08 4.68 0.00 2.98 2.93 0.00 0.00 7.02 7.31 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 60 I 7.96 3.68 1.89 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 1.42 1.59 0.93 0.00 0.00 61 I 7.84 3.74 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 1.05 0.00 0.00 62 E 8.01 4.15 0.00 2.02 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 2.29 2.46 0.00 63 K 8.00 4.30 0.00 1.86 1.84 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.58 7.81 64 I 7.28 4.08 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.82 0.92 0.00 0.00 65 K 7.50 4.23 0.00 1.81 1.87 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 * Residues marked with a * may have inaccurate shift predictions.