NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 30 T 4.1721 8.1744 110.9397 60.9923 69.4849 169.8177 31 D 4.2509 8.6488 127.2429 52.4398 42.8331 172.3699 32 A 4.1670 8.3111 128.9595 52.4020 20.0449 176.6460 33 T 4.7662 8.6998 111.7435 59.0308 73.1081 174.9702 34 L 4.1478 8.4974 121.2254 58.0985 41.8926 178.9141 35 G 3.6805 8.0789 105.5943 47.8996 0.0000 175.7390 36 S 4.6278 8.1032 118.8830 59.9584 62.6755 176.8188 37 V 3.5283 7.6396 122.1195 66.1435 31.2149 177.6255 38 Y 3.9006 7.7029 116.3069 60.9952 37.8912 178.2757 39 S 4.2686 8.7662 115.5759 60.2786 63.1994 175.2305 40 E 4.6440 8.2775 119.2107 56.0924 29.8778 175.7157 41 I 4.4453 6.9720 118.1995 61.8794 40.5908 177.1859 42 I 4.0001 8.4475 122.1570 64.0776 37.0544 178.9000 43 S 4.1448 8.2830 115.6868 61.1132 62.6270 174.8825 44 P 4.2212 0.0000 0.0000 65.6684 31.1258 178.7198 45 V 3.5558 7.9308 117.0324 65.8736 31.5205 177.7867 46 K 3.8927 8.1861 119.3086 59.7311 32.0095 178.4711 47 D 4.3716 8.2867 119.2082 57.5465 40.6799 178.4545 48 C 4.1268 8.3819 117.5258 62.9131 28.0639 176.1893 49 I 3.7059 7.9111 121.2919 64.4171 36.4757 178.4122 50 L 3.9861 7.5563 118.0465 58.1883 41.7952 179.5083 51 T 4.0225 7.9688 115.5912 66.6741 68.4300 177.0594 52 V 3.6258 8.2685 120.3520 65.8291 31.5077 177.8358 53 A 4.0627 8.2201 120.8391 55.1013 18.0000 179.7812 54 K 4.0153 8.0485 116.8606 59.3879 32.0361 179.4880 55 A 4.1076 7.8729 120.8472 54.9429 18.1635 179.5693 56 V 3.5087 7.6628 115.8441 66.4200 31.7942 177.9592 57 S 4.1951 7.9977 111.2856 61.0381 62.1128 175.2802 58 F 4.7395 7.7496 122.2558 58.4312 40.1451 174.6091 59 N 4.4178 8.2224 117.8807 50.3421 38.0876 171.8395 60 P 4.0389 0.0000 0.0000 64.7436 32.1289 176.8354 61 G 3.6840 7.8460 108.3687 46.4055 0.0000 170.7721 62 G 3.3954 8.4584 108.7628 44.2000 0.0000 173.9949 63 K 4.2028 8.6575 127.0486 58.2530 32.4937 178.1544 64 D 4.3703 8.0398 119.0633 57.6364 40.9591 178.3517 65 N 4.3396 8.1330 116.2195 56.6631 38.5485 177.5233 66 T 3.9895 7.8225 116.7070 66.5286 68.5958 176.5043 67 D 4.3503 8.3362 120.7551 57.1802 40.7511 178.6005 68 A 3.9666 8.2698 121.5410 55.2969 18.3484 179.8357 69 V 3.5153 7.6695 116.2516 65.9388 31.4614 177.8271 70 E 3.8779 8.1495 119.0577 59.3354 29.4806 178.8646 71 V 3.5813 7.9817 118.4410 66.2046 31.4865 178.0238 72 L 3.9933 8.1802 118.7116 57.9745 41.3900 179.6761 73 T 3.8768 8.1999 116.0875 66.3842 68.4436 176.3927 74 E 3.9009 8.5240 121.7231 59.0826 29.5879 178.5254 75 L 3.8915 8.0217 120.4231 58.4192 42.0751 178.7389 76 N 4.2570 8.3249 116.4569 56.5887 38.6052 177.3247 77 T 3.8401 8.0781 114.4913 65.0673 67.3859 176.3853 78 K 3.9905 8.0032 120.3848 59.3454 32.0339 179.5750 79 V 3.5421 7.9615 118.7135 65.9954 31.2137 177.9458 80 E 3.7850 8.2230 117.7161 59.4125 29.3462 179.3055 81 R 4.0711 7.7177 116.5757 59.1264 30.2173 178.5544 82 A 4.1604 7.9219 119.4102 54.8046 18.5112 179.1159 83 A 4.1946 7.8902 118.3792 52.5927 19.2241 177.3024 *85 N 4.4716 8.2421 124.3371 55.1572 39.1156 174.7847 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 30 T 8.17 4.17 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 31 D 8.65 4.25 0.00 2.83 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 32 A 8.31 4.17 1.24 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 0.00 0.00 0.00 33 T 8.70 4.77 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 1.22 0.00 0.00 34 L 8.50 4.15 0.00 1.83 1.77 1.10 1.07 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 35 G 8.08 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.10 4.63 0.00 4.24 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.64 3.53 2.22 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 0.83 0.00 0.00 0.95 0.00 0.00 38 Y 7.70 3.90 0.00 3.22 2.99 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 0.00 0.00 0.00 39 S 8.77 4.27 0.00 4.05 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 0.00 40 E 8.28 4.64 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 41 I 6.97 4.45 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.85 0.00 0.00 42 I 8.45 4.00 1.93 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.92 0.00 0.00 43 S 8.28 4.14 0.00 3.93 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 44 P 0.00 4.22 0.00 2.24 2.10 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.15 0.00 45 V 7.93 3.56 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 1.05 0.00 0.00 0.94 0.00 0.00 46 K 8.19 3.89 0.00 2.09 1.98 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.66 7.81 47 D 8.29 4.37 0.00 2.96 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 48 C 8.38 4.13 0.00 3.14 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.91 3.71 2.06 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 0.76 0.92 0.00 0.00 50 L 7.56 3.99 0.00 1.85 1.74 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.97 4.02 4.38 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 1.21 0.00 0.00 52 V 8.27 3.63 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.97 0.00 0.00 53 A 8.22 4.06 1.43 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 54 K 8.05 4.02 0.00 2.03 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 55 A 7.87 4.11 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 56 V 7.66 3.51 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 0.84 0.00 0.00 0.95 0.00 0.00 57 S 8.00 4.20 0.00 4.03 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.75 4.74 0.00 3.03 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 59 N 8.22 4.42 0.00 2.71 2.72 0.00 0.00 7.26 7.26 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 60 P 0.00 4.04 0.00 2.02 1.94 0.00 3.61 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 61 G 7.85 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.46 3.40 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 0.00 63 K 8.66 4.20 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.82 0.00 0.00 3.22 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 64 D 8.04 4.37 0.00 2.77 2.71 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 65 N 8.13 4.34 0.00 2.75 2.89 0.00 0.00 7.07 7.05 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 66 T 7.82 3.99 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 67 D 8.34 4.35 0.00 2.95 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.27 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 69 V 7.67 3.52 2.22 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 1.06 0.00 0.00 1.01 0.00 0.00 70 E 8.15 3.88 0.00 2.16 2.12 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 2.31 2.46 0.00 71 V 7.98 3.58 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 72 L 8.18 3.99 0.00 1.86 1.70 0.92 0.70 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 73 T 8.20 3.88 4.39 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 1.21 0.00 0.00 74 E 8.52 3.90 0.00 2.20 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 0.00 2.30 2.32 0.00 75 L 8.02 3.89 0.00 1.85 1.85 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.32 4.26 0.00 2.86 2.83 0.00 0.00 6.75 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.08 3.84 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 1.37 0.00 0.00 78 K 8.00 3.99 0.00 2.00 1.82 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.63 7.81 79 V 7.96 3.54 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.94 0.00 0.00 80 E 8.22 3.79 0.00 1.95 2.04 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 2.18 2.50 0.00 81 R 7.72 4.07 0.00 1.94 1.99 0.00 3.17 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.99 0.00 82 A 7.92 4.16 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 83 A 7.89 4.19 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 *85 N 8.24 4.47 0.00 2.76 2.80 0.00 0.00 6.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.