NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 R 4.3416 8.1127 119.0729 56.2028 31.8903 175.3587 2 M 3.9933 8.2031 118.5303 57.1058 32.4064 176.7263 3 K 4.0385 8.2191 121.0329 60.0750 33.0628 178.7867 4 Q 4.0378 8.1172 120.5104 60.2739 27.8183 180.7927 5 I 3.9954 7.6553 122.7405 65.0395 37.1716 178.9282 6 E 3.9817 8.0301 118.8032 61.2898 29.5325 180.7350 7 D 4.5304 8.4191 120.5610 57.1001 40.8921 178.8856 8 K 3.9903 7.9983 119.8162 59.3884 32.1180 178.8748 9 L 3.9931 8.2442 119.7179 57.6385 41.6232 179.0230 10 E 3.8991 8.1928 119.3672 59.2291 29.6385 178.5546 11 E 3.9539 8.1970 119.3907 59.3354 29.6531 178.8388 12 I 3.7438 7.9501 119.9351 64.2956 37.1170 178.2408 13 L 4.0177 8.1323 120.2016 57.9526 41.4796 179.8481 14 S 4.1502 8.0418 113.8119 61.2615 63.0312 176.6788 15 K 4.0566 8.0549 121.9866 59.2988 31.7449 179.2691 16 L 4.0480 8.3408 119.6370 57.9381 41.5214 179.0101 17 Y 4.1478 8.2784 119.5606 60.9266 38.7370 177.7531 18 H 4.1224 8.3396 117.1154 58.9518 28.7779 177.6406 19 I 3.6951 7.7944 121.5321 64.7571 36.9174 178.0441 20 C 4.0340 8.2908 117.5272 63.1087 27.9787 176.1345 21 N 4.2312 7.9081 117.8049 56.1419 38.0625 177.3448 22 E 3.9426 8.1554 120.0136 59.5407 29.6039 179.5231 23 L 4.0265 8.3098 119.0154 57.5108 41.5244 179.3723 24 A 4.0544 7.8508 120.5958 54.7495 18.2881 179.6423 25 R 3.7968 8.0303 117.4286 59.5143 30.0662 178.7924 26 I 3.6582 7.7231 119.6446 64.2221 37.1266 178.2112 27 K 3.8521 8.0181 120.3533 59.3454 31.7959 178.3732 28 K 3.8115 7.9786 118.7157 59.7821 32.4286 178.2792 29 L 4.1335 8.1710 119.2112 57.8670 41.3118 179.5953 30 L 4.1457 8.0772 118.2926 57.5656 41.6394 179.3390 31 G 3.7493 8.0502 104.0614 46.1890 0.0000 173.4577 32 E 4.2847 7.7098 124.6948 56.4291 29.7654 175.6466 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 *1 R 8.11 4.34 0.00 1.71 1.86 0.00 3.14 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 2 M 8.20 3.99 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.71 0.00 3 K 8.22 4.04 0.00 1.95 1.78 0.00 1.90 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.50 1.07 7.81 4 Q 8.12 4.04 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.03 0.00 5 I 7.66 4.00 2.03 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 0.59 0.91 0.00 0.00 6 E 8.03 3.98 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 7 D 8.42 4.53 0.00 2.66 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.00 3.99 0.00 1.97 2.06 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 9 L 8.24 3.99 0.00 1.89 1.70 0.92 1.07 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 10 E 8.19 3.90 0.00 2.01 2.13 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 2.28 2.45 0.00 11 E 8.20 3.95 0.00 2.10 2.18 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 0.00 2.32 2.36 0.00 12 I 7.95 3.74 2.00 0.00 0.00 0.87 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 0.68 0.92 0.00 0.00 13 L 8.13 4.02 0.00 1.85 1.70 0.90 0.66 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 14 S 8.04 4.15 0.00 4.08 4.11 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 0.00 0.00 0.00 15 K 8.05 4.06 0.00 2.07 1.94 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.53 7.81 16 L 8.34 4.05 0.00 1.93 1.76 0.94 0.65 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 17 Y 8.28 4.15 0.00 3.04 3.06 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 0.00 0.00 0.00 18 H 8.34 4.12 0.00 3.43 3.30 0.00 5.71 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 19 I 7.79 3.70 2.02 0.00 0.00 0.87 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 0.84 0.91 0.00 0.00 20 C 8.29 4.03 0.00 3.14 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 21 N 7.91 4.23 0.00 2.72 2.72 0.00 0.00 7.06 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.16 3.94 0.00 2.27 1.97 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 2.33 2.23 0.00 23 L 8.31 4.03 0.00 1.64 1.70 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.85 4.05 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 25 R 8.03 3.80 0.00 1.95 2.08 0.00 3.08 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 1.61 1.65 0.00 26 I 7.72 3.66 2.01 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 0.63 0.90 0.00 0.00 27 K 8.02 3.85 0.00 1.93 1.95 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.45 7.81 28 K 7.98 3.81 0.00 1.86 2.06 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.49 7.81 29 L 8.17 4.13 0.00 1.89 1.69 0.91 0.84 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 30 L 8.08 4.15 0.00 1.75 1.73 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.05 3.75 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 0.00 0.00 0.00 32 E 7.71 4.28 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 * Residues marked with a * may have inaccurate shift predictions.