NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 S 4.4690 8.2929 117.0992 57.6808 64.2529 174.8387 23 S 4.1576 8.5054 116.3242 64.6676 61.7234 172.2199 24 D 4.6879 8.2806 125.0653 58.7918 40.2812 179.8295 25 P 4.5778 0.0000 0.0000 67.3837 30.7013 181.0322 26 L 4.2796 8.2227 123.6222 60.3606 40.9287 183.5699 27 V 3.9355 7.5633 121.9488 66.2857 31.5387 181.2272 28 V 3.8264 7.6246 119.9472 65.8286 31.4931 180.2266 29 A 4.1713 8.0784 121.6335 55.0091 18.2400 179.5246 30 A 4.0074 8.2538 121.6277 56.0239 18.4386 180.6801 31 S 4.1582 8.2924 119.5008 64.1497 62.3924 179.2550 32 I 4.0077 7.9466 126.6270 65.4626 35.2041 180.6746 33 I 4.0172 7.9633 122.2900 64.9230 35.3437 180.2117 34 G 3.9531 8.2954 110.3953 48.2744 0.0000 176.3192 35 I 3.8086 7.9669 125.1319 65.3524 35.5125 180.5186 36 L 4.2770 8.1378 126.9959 60.2387 40.7307 181.4650 *37 H 4.3986 8.3408 122.5460 60.1447 27.9092 179.9033 38 L 4.2766 8.0990 127.8373 59.9581 40.7472 181.7696 39 I 3.9879 7.9564 123.7620 65.5170 35.4081 180.5129 40 L 4.2789 8.1226 126.8855 59.7344 40.7357 181.7944 *41 W 4.2959 8.2120 126.5128 61.9883 28.2104 180.7651 42 I 4.0130 7.9992 123.7986 65.5406 34.6500 180.6919 43 L 4.3092 7.9565 125.6749 59.9992 40.7843 181.3670 44 D 4.7915 8.1600 123.5549 59.0245 39.8320 181.3035 45 R 4.3632 8.0584 123.7115 61.6387 29.4713 179.7469 46 L 4.5295 7.8118 126.1632 56.6940 41.0883 179.1309 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 22 S 8.29 4.47 0.00 3.67 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 23 S 8.51 4.16 0.00 3.81 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.28 4.69 0.00 2.68 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 25 P 0.00 4.58 0.00 2.07 2.09 0.00 3.70 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 2.02 1.66 0.00 26 L 8.22 4.28 0.00 1.66 1.70 0.92 0.77 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 27 V 7.56 3.94 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 0.71 0.00 0.00 0.93 0.00 0.00 28 V 7.62 3.83 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 0.73 0.00 0.00 0.93 0.00 0.00 29 A 8.08 4.17 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 30 A 8.25 4.01 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 31 S 8.29 4.16 0.00 3.77 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.95 4.01 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 1.38 0.54 0.91 0.00 0.00 33 I 7.96 4.02 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 1.45 0.54 0.91 0.00 0.00 34 G 8.30 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 0.00 0.00 0.00 35 I 7.97 3.81 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 1.38 0.70 0.91 0.00 0.00 36 L 8.14 4.28 0.00 1.65 1.71 0.92 0.95 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 *37 H 8.34 4.40 0.00 2.93 3.11 0.00 7.18 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 38 L 8.10 4.28 0.00 1.66 1.71 0.92 0.79 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 39 I 7.96 3.99 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 1.38 0.53 0.91 0.00 0.00 40 L 8.12 4.28 0.00 1.65 1.71 0.92 0.95 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 *41 W 8.21 4.30 0.00 2.51 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.00 4.01 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 1.38 0.54 0.91 0.00 0.00 43 L 7.96 4.31 0.00 1.75 1.62 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.16 4.79 0.00 2.78 2.61 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 0.00 0.00 0.00 45 R 8.06 4.36 0.00 1.92 1.88 0.00 3.24 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 46 L 7.81 4.53 0.00 1.76 1.47 0.92 0.88 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 * Residues marked with a * may have inaccurate shift predictions.