NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *5 E 4.3630 8.4449 116.7535 55.3420 31.8317 176.2194 6 K 4.1162 8.1069 120.2213 54.2675 33.0814 175.7971 7 T 4.2012 8.9945 114.3828 61.3746 71.9064 175.4770 8 I 3.6778 8.2148 122.5914 64.3499 37.1480 178.3137 9 L 3.9733 7.8828 120.5983 58.5443 42.0552 178.8279 10 N 4.5015 8.3227 116.0615 56.4447 38.3986 177.3318 11 M 4.2152 8.3753 120.2355 57.9680 31.9699 178.5252 12 A 4.1598 8.2685 121.3072 54.9721 18.5973 179.9013 13 R 3.8725 8.2752 116.9038 59.2017 30.0606 178.9127 14 F 4.0706 8.2808 120.4192 61.4566 39.4001 177.2636 15 I 3.6479 7.9873 119.3430 64.3050 36.4384 178.3220 16 R 3.8469 8.2171 119.3126 59.6106 29.9750 179.2927 17 S 4.0482 7.8329 114.1589 61.8198 62.9305 176.7417 18 Q 3.7977 7.8742 120.5666 58.7727 28.3101 178.9308 19 A 3.9630 8.2939 122.1829 55.2669 18.4863 179.7662 20 L 3.9534 7.6237 116.6472 57.9049 41.6071 179.8920 21 T 3.8931 7.8266 116.1321 66.5410 68.3584 176.8743 22 I 3.7208 7.8152 121.8977 63.9220 37.0377 178.0192 23 L 3.8674 7.8922 121.3560 58.2770 41.8891 178.7464 24 E 3.8918 8.1701 118.9453 59.3726 29.2267 178.9794 25 K 4.2080 8.2500 118.2463 59.1421 32.0266 179.3503 26 A 4.0035 8.5801 121.7198 55.0819 18.2114 179.3276 27 N 4.2476 8.3081 115.0952 56.6747 38.4380 177.4384 28 E 3.9671 7.8614 118.1143 58.6558 29.5374 178.4267 29 L 4.5083 7.2307 115.8799 53.3913 42.0383 175.9282 30 D 4.3837 7.9707 117.1756 55.3260 39.3301 175.4163 31 A 4.4078 7.8143 123.2742 50.9133 16.4305 178.0011 32 D 4.3403 8.0365 124.1665 55.9965 40.0285 178.7309 33 E 3.9562 8.0895 119.5379 59.2667 29.5025 179.0780 34 I 3.6883 7.7595 119.1468 64.2595 37.2186 178.1158 35 A 3.9644 8.0442 121.5436 55.3637 18.2539 179.4282 36 D 4.3191 8.1317 117.3448 57.5507 40.8484 179.1858 37 I 3.7215 7.7932 120.0152 64.2615 37.0609 178.2454 38 A 4.0263 8.2398 121.9067 55.2413 18.1602 179.3558 39 E 3.8614 8.3265 117.8036 59.3112 29.7156 178.9708 40 S 4.0061 8.1054 113.3484 61.2128 62.3461 176.0999 41 I 3.7162 8.1865 123.0246 64.6450 36.8263 177.7169 42 H 3.9987 8.3582 119.0186 59.5438 29.2101 176.9839 43 D 4.4755 8.2230 120.5337 57.7458 40.7099 178.5942 44 H 4.3675 8.2687 116.5816 58.6435 28.6299 177.6598 45 A 4.0541 8.3033 122.9455 55.2067 18.0899 179.2082 46 D 4.2768 8.1928 117.5133 57.7889 40.8039 179.0964 47 E 4.0345 7.9024 118.2781 59.2928 29.3725 179.4990 48 I 3.7157 7.6718 119.5570 64.4737 37.2044 177.6554 49 Y 4.1108 8.3828 120.7123 61.0073 38.6134 178.5889 50 R 3.8469 8.5287 119.1159 59.3180 29.9364 179.3338 51 S 4.0978 8.1660 113.9947 61.5499 62.9453 176.3206 52 A 4.0852 8.4710 122.8117 54.8486 18.1063 179.1822 53 L 3.8542 7.5725 118.2286 58.1399 42.2588 178.7169 54 A 4.0467 7.8677 121.4526 54.8570 18.4642 178.1417 *55 R 4.0878 7.8810 119.8423 56.4480 30.2674 180.5804 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 *5 E 8.44 4.36 0.00 1.73 1.79 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 2.13 2.40 0.00 6 K 8.11 4.12 0.00 1.78 1.74 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.44 7.81 7 T 8.99 4.20 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 8 I 8.21 3.68 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 1.53 0.57 0.93 0.00 0.00 9 L 7.88 3.97 0.00 1.73 1.67 0.76 0.62 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 10 N 8.32 4.50 0.00 2.82 2.90 0.00 0.00 7.14 7.01 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 11 M 8.38 4.22 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.51 0.00 12 A 8.27 4.16 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.28 3.87 0.00 2.17 2.05 0.00 3.42 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.04 0.00 14 F 8.28 4.07 0.00 3.18 3.28 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 0.00 0.00 0.00 0.00 15 I 7.99 3.65 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.81 0.93 0.00 0.00 16 R 8.22 3.85 0.00 1.85 1.91 0.00 3.01 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 17 S 7.83 4.05 0.00 3.75 3.78 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 18 Q 7.87 3.80 0.00 1.73 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.48 1.16 0.00 19 A 8.29 3.96 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 20 L 7.62 3.95 0.00 1.77 1.65 0.74 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.83 3.89 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 1.17 0.00 0.00 22 I 7.82 3.72 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.90 0.00 0.00 23 L 7.89 3.87 0.00 1.85 1.78 0.87 0.70 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 24 E 8.17 3.89 0.00 2.05 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 2.28 2.33 0.00 25 K 8.25 4.21 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.58 7.81 26 A 8.58 4.00 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 27 N 8.31 4.25 0.00 2.89 2.87 0.00 0.00 7.04 7.18 0.00 0.00 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 E 7.86 3.97 0.00 2.08 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 2.34 2.65 0.00 29 L 7.23 4.51 0.00 1.72 1.67 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.97 4.38 0.00 2.79 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 31 A 7.81 4.41 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 32 D 8.04 4.34 0.00 2.95 2.93 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 33 E 8.09 3.96 0.00 2.03 2.03 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 2.40 2.40 0.00 34 I 7.76 3.69 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 1.57 0.65 0.91 0.00 0.00 35 A 8.04 3.96 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 36 D 8.13 4.32 0.00 2.86 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 37 I 7.79 3.72 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 1.46 0.69 0.92 0.00 0.00 38 A 8.24 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 3.86 0.00 2.04 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 2.28 2.28 0.00 40 S 8.11 4.01 0.00 3.91 3.98 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 41 I 8.19 3.72 2.06 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 1.44 0.65 0.92 0.00 0.00 42 H 8.36 4.00 0.00 3.22 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.22 4.48 0.00 2.75 2.67 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 44 H 8.27 4.37 0.00 3.35 3.33 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 45 A 8.30 4.05 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 46 D 8.19 4.28 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 4.03 0.00 2.23 2.03 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 2.37 2.53 0.00 48 I 7.67 3.72 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.01 0.96 0.00 0.00 49 Y 8.38 4.11 0.00 3.04 3.21 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 0.00 0.00 0.00 0.00 50 R 8.53 3.85 0.00 2.07 1.99 0.00 3.41 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 1.80 2.12 0.00 51 S 8.17 4.10 0.00 4.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.47 4.09 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 53 L 7.57 3.85 0.00 1.51 1.59 0.58 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.87 4.05 1.30 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 0.00 0.00 *55 R 7.88 4.09 0.00 1.59 1.76 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.