NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 Q 4.3153 8.2027 118.8242 56.3010 30.8332 177.0765 23 Q 3.7684 7.9029 119.3224 58.0685 28.9263 176.3315 24 A 4.0063 8.1304 121.8240 54.7767 18.8871 179.0192 25 R 3.7897 7.8891 116.9863 59.4847 30.2786 178.2069 26 Q 3.9600 8.1887 119.4092 59.4523 29.0645 178.1554 27 N 4.3388 8.4657 117.7057 56.2048 38.5318 177.1376 28 L 3.9705 8.1550 121.8434 58.2454 42.1149 178.8080 29 Q 4.0938 8.3033 119.5414 59.2161 28.9589 177.9473 30 N 4.3471 8.3612 117.5563 56.4568 38.6403 177.4214 31 L 4.0343 8.0393 120.3468 57.7428 41.6763 178.9588 32 Y 4.0852 8.4504 119.9953 60.8320 38.7151 178.1891 33 I 3.5225 8.1287 121.0378 64.1515 37.1430 177.7265 34 N 4.1924 8.2173 117.9896 56.8701 38.7570 176.8630 35 R 3.8142 7.9751 119.8151 59.4831 30.1511 178.1364 36 C 3.9279 7.7903 116.5222 62.9294 28.0456 176.2444 37 L 3.9673 8.0914 120.6812 57.5238 41.1572 179.4355 38 R 3.8431 8.1152 118.8861 59.5127 30.0053 178.4684 39 E 3.9578 8.0746 118.1948 59.4608 29.3680 179.3776 40 I 3.9507 7.7542 121.1591 63.9969 37.0564 178.2321 41 C 4.0823 8.2742 117.7058 62.8052 27.9582 175.8092 42 Q 3.9380 8.0821 121.0154 59.3640 28.0991 178.3625 43 E 3.9541 8.1758 119.3653 59.5629 29.4403 179.4558 44 L 4.0757 8.2544 119.1972 57.6457 41.6014 179.7435 45 K 3.9769 8.3891 118.8798 59.3508 31.7045 179.2619 46 E 3.9666 7.9917 118.1750 59.3835 29.4634 179.1001 47 I 3.8482 7.6201 118.6666 64.4376 37.2619 178.1661 48 R 4.1185 8.0021 117.6023 59.2178 29.9771 179.9781 49 A 4.1335 7.5961 117.2952 52.3286 18.4020 177.3603 *51 L 4.0555 7.9706 126.4349 56.6820 42.1922 177.0278 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 Q 8.20 4.32 0.00 2.25 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 23 Q 7.90 3.77 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 24 A 8.13 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 25 R 7.89 3.79 0.00 1.88 2.13 0.00 3.18 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 26 Q 8.19 3.96 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 27 N 8.47 4.34 0.00 2.89 2.86 0.00 0.00 6.72 6.70 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 28 L 8.15 3.97 0.00 1.82 1.82 0.94 0.60 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 29 Q 8.30 4.09 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 30 N 8.36 4.35 0.00 2.99 2.87 0.00 0.00 7.03 6.35 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 31 L 8.04 4.03 0.00 1.90 1.75 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.45 4.09 0.00 3.08 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.52 1.88 0.00 0.00 0.91 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 0.78 0.89 0.00 0.00 34 N 8.22 4.19 0.00 2.81 3.05 0.00 0.00 6.86 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 35 R 7.98 3.81 0.00 1.93 2.06 0.00 3.39 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 36 C 7.79 3.93 0.00 2.95 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.09 3.97 0.00 1.63 1.68 0.90 1.07 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 38 R 8.12 3.84 0.00 1.92 2.08 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 39 E 8.07 3.96 0.00 2.18 1.95 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 2.30 2.42 0.00 40 I 7.75 3.95 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.30 0.89 0.00 0.00 41 C 8.27 4.08 0.00 3.13 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.08 3.94 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 43 E 8.18 3.95 0.00 2.23 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 0.00 2.32 2.53 0.00 44 L 8.25 4.08 0.00 1.79 1.71 0.91 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.39 3.98 0.00 1.93 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.63 7.81 46 E 7.99 3.97 0.00 2.11 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 2.34 2.51 0.00 47 I 7.62 3.85 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 0.60 0.91 0.00 0.00 48 R 8.00 4.12 0.00 1.96 2.00 0.00 3.16 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 49 A 7.60 4.13 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 *51 L 7.97 4.06 0.00 1.67 1.64 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.