NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *60 H 4.7506 8.3033 117.3740 54.5289 30.6682 175.0116 61 D 4.3762 7.9080 119.7173 55.6397 40.7268 177.1277 62 D 4.2439 8.2720 121.5156 57.2909 41.7456 177.5315 63 A 4.0109 7.9036 120.6863 55.2725 18.3706 179.4526 64 L 4.0340 7.9209 116.7380 57.5797 41.5952 179.2430 65 L 4.1923 7.6481 118.6726 56.8667 41.6200 179.0374 66 N 4.3466 8.0617 116.9012 56.6664 38.6088 177.6264 67 T 3.8609 8.3149 117.4455 66.3276 68.4473 176.5104 68 L 3.9570 7.7209 122.2956 57.8598 42.0093 178.9261 69 A 3.9684 7.7418 120.5146 55.1952 18.4033 179.4018 70 I 3.6311 7.8998 118.5387 64.7556 37.1487 178.6680 71 L 3.9947 8.0225 119.4864 57.8912 41.6001 179.4109 72 Q 4.0116 8.3518 121.9684 59.4900 28.8491 179.1701 73 K 4.0014 8.2777 125.0499 59.7546 31.7981 181.5096 74 E 4.1253 8.2096 121.0604 59.0256 29.4973 178.7269 75 L 3.9410 8.2107 120.5958 57.7775 42.1069 178.9142 76 K 3.9463 7.8711 119.4747 59.2571 32.0957 178.7547 77 S 4.0487 8.3979 113.8433 61.5172 62.3662 176.3597 78 K 3.9521 8.2708 121.2881 59.4552 31.8023 178.9889 79 E 4.0139 8.1624 119.6340 59.0360 29.4374 178.9290 80 Q 3.9905 7.9767 118.4330 58.7916 28.8862 177.9707 81 E 3.9269 8.4004 120.3989 59.2109 29.5780 179.0494 82 I 3.8265 7.8919 122.6017 64.9285 37.2340 179.1837 83 R 3.9837 7.8723 121.4365 61.2491 29.1794 180.8338 84 R 4.0765 8.2406 119.2009 59.4561 30.1537 178.6364 85 L 4.1146 7.9093 118.8014 57.7932 41.6918 179.6825 86 K 4.1024 8.1248 118.3322 58.9336 31.9446 179.4341 87 E 3.9129 8.0099 119.2060 59.3973 29.4023 179.0802 88 V 3.5941 8.1463 118.6402 66.4304 31.4816 178.0900 89 I 3.6729 7.8463 118.9493 64.3603 36.8909 178.3538 90 A 4.0353 7.8640 121.2107 55.0609 18.1924 179.7420 91 L 3.9986 8.1101 117.6242 57.7940 41.6013 179.8521 92 K 4.0224 8.3586 118.7716 59.4274 31.9610 179.2067 93 N 4.3362 8.2387 117.0113 55.8580 38.4227 177.3970 94 K 3.9123 7.9774 121.1497 59.6700 32.3106 178.4281 95 N 4.3176 8.2461 116.7361 56.9079 38.3818 177.5056 96 T 3.8742 8.0941 117.0576 66.6614 68.5104 176.6601 97 E 3.9615 8.2631 120.6113 59.2551 29.4781 179.3171 98 R 3.9109 8.1261 118.8493 59.3063 30.0468 178.6462 99 L 3.9718 8.1545 118.9355 57.9237 41.6201 179.1490 100 N 4.3179 8.4304 116.6784 56.5246 38.5811 177.2212 101 D 4.4055 8.2024 120.2379 57.3672 40.8741 178.7098 102 E 3.9982 8.1310 119.2300 59.0582 29.4514 179.1478 103 L 3.9105 8.1392 120.6851 58.3429 42.2220 178.6616 104 I 3.6829 8.1106 120.3267 64.8099 37.1098 178.6240 105 S 4.3141 8.2249 114.4404 61.2419 62.7603 176.7013 106 G 3.5894 8.0754 109.7741 47.7530 0.0000 176.0604 107 T 3.8867 7.9076 117.9920 66.6918 68.5386 176.9413 108 I 3.7166 7.7505 121.7424 64.3253 36.6396 178.0794 109 E 3.9489 8.3715 120.2507 59.3811 29.3624 178.6748 110 N 4.4741 7.9835 116.1217 56.1291 38.5950 177.1872 111 N 4.3036 8.3286 118.0558 56.0784 38.5323 177.3837 112 V 3.5764 7.7569 119.6926 66.3080 31.8173 178.2793 113 L 4.0986 7.7545 119.4532 58.1112 41.2186 180.2628 114 Q 4.1851 8.3566 123.7917 60.8120 28.1241 183.2937 115 Q 4.3051 8.5901 125.7449 60.5502 28.0106 181.1155 116 K 4.4435 8.2328 126.6809 59.5902 31.7161 181.4019 117 L 4.4321 7.1856 119.8641 59.9180 41.1057 183.8651 118 S 4.3666 7.9051 118.2551 62.1737 63.2848 175.2688 119 D 4.5451 7.9493 122.4297 53.4494 39.5182 178.1690 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 *60 H 8.30 4.75 0.00 2.85 3.09 0.00 7.17 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 7.91 4.38 0.00 2.79 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.27 4.24 0.00 2.73 2.65 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 0.00 0.00 0.00 0.00 63 A 7.90 4.01 1.32 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 0.00 0.00 64 L 7.92 4.03 0.00 1.70 1.73 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.65 4.19 0.00 2.05 1.70 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.06 4.35 0.00 2.94 2.85 0.00 0.00 6.86 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.31 3.86 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 68 L 7.72 3.96 0.00 1.81 1.79 0.92 1.33 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 69 A 7.74 3.97 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.90 3.63 2.02 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 1.09 0.91 0.00 0.00 71 L 8.02 3.99 0.00 1.84 1.71 0.92 0.81 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 72 Q 8.35 4.01 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 73 K 8.28 4.00 0.00 1.80 1.79 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.31 7.81 74 E 8.21 4.13 0.00 2.18 2.11 0.00 0.00 0.00 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 2.32 0.00 75 L 8.21 3.94 0.00 2.05 1.64 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.87 3.95 0.00 2.15 1.78 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.58 7.81 77 S 8.40 4.05 0.00 3.90 4.05 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 0.00 0.00 0.00 78 K 8.27 3.95 0.00 2.12 1.84 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.49 7.81 79 E 8.16 4.01 0.00 2.30 2.06 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 2.30 2.39 0.00 80 Q 7.98 3.99 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.71 0.00 81 E 8.40 3.93 0.00 2.07 2.10 0.00 0.00 0.00 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 82 I 7.89 3.83 2.02 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 1.38 0.67 0.91 0.00 0.00 83 R 7.87 3.98 0.00 1.85 1.94 0.00 3.27 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 84 R 8.24 4.08 0.00 1.86 2.08 0.00 3.07 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 85 L 7.91 4.11 0.00 1.88 1.70 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.12 4.10 0.00 1.97 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.68 7.81 87 E 8.01 3.91 0.00 2.26 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 2.46 0.00 88 V 8.15 3.59 2.24 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 1.10 0.00 0.00 0.93 0.00 0.00 89 I 7.85 3.67 2.01 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 1.45 0.55 0.91 0.00 0.00 90 A 7.86 4.04 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 91 L 8.11 4.00 0.00 1.85 1.72 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.36 4.02 0.00 1.92 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 93 N 8.24 4.34 0.00 2.91 2.86 0.00 0.00 6.60 7.60 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 94 K 7.98 3.91 0.00 1.98 1.90 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.48 7.81 95 N 8.25 4.32 0.00 3.01 2.86 0.00 0.00 7.11 6.61 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 96 T 8.09 3.87 4.40 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 1.21 0.00 0.00 97 E 8.26 3.96 0.00 2.19 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 2.48 0.00 98 R 8.13 3.91 0.00 1.89 2.11 0.00 3.09 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 99 L 8.15 3.97 0.00 1.91 1.70 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 100 N 8.43 4.32 0.00 2.87 2.87 0.00 0.00 7.08 8.85 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 0.00 101 D 8.20 4.41 0.00 2.92 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 0.00 102 E 8.13 4.00 0.00 2.23 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 2.50 0.00 103 L 8.14 3.91 0.00 1.87 1.85 0.92 1.32 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 0.00 104 I 8.11 3.68 2.01 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 1.58 0.64 0.91 0.00 0.00 105 S 8.22 4.31 0.00 4.08 4.13 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 0.00 0.00 0.00 0.00 106 G 8.08 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 0.00 107 T 7.91 3.89 4.37 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 1.21 0.00 0.00 108 I 7.75 3.72 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 1.63 0.81 0.91 0.00 0.00 109 E 8.37 3.95 0.00 2.28 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 2.35 0.00 110 N 7.98 4.47 0.00 2.91 2.84 0.00 0.00 7.01 7.95 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 0.00 111 N 8.33 4.30 0.00 2.88 2.87 0.00 0.00 6.60 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 0.00 112 V 7.76 3.58 2.31 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 1.03 0.00 0.00 1.01 0.00 0.00 113 L 7.75 4.10 0.00 1.89 1.70 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 8.36 4.19 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 115 Q 8.59 4.31 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 116 K 8.23 4.44 0.00 1.85 1.76 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.32 7.81 117 L 7.19 4.43 0.00 1.84 1.56 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 118 S 7.91 4.37 0.00 3.82 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 0.00 119 D 7.95 4.55 0.00 2.73 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 * Residues marked with a * may have inaccurate shift predictions.