NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.0666 8.0393 120.3928 62.3863 32.9228 175.7709 3 S 4.1736 8.3231 121.8559 57.7564 64.9486 174.0643 4 K 3.9763 8.7586 123.2343 59.5399 32.2166 180.6074 5 L 3.9286 7.8511 120.2154 58.0918 42.0593 178.8225 6 S 4.3667 8.0934 114.3763 60.9381 62.3054 175.8448 7 Q 3.9388 8.0445 122.2651 59.1774 28.7092 178.0373 8 L 3.9444 8.1939 121.5227 58.2287 41.9480 178.9950 9 Q 3.9946 8.3444 118.1825 59.2681 28.4325 178.8668 10 T 3.8843 7.8519 115.7684 66.5417 68.7837 176.0917 11 E 4.1429 8.4344 121.4383 59.1073 29.5788 179.1689 12 L 4.1377 8.0497 115.6525 55.4062 41.3176 178.7131 *14 A 4.1875 7.9461 123.4395 52.2660 20.7090 179.8125 15 A 4.0256 8.0669 117.5248 55.2068 18.1978 179.8681 16 L 3.9564 8.3576 117.9474 57.8863 41.7191 179.6984 17 L 3.9719 7.8479 118.4054 57.9039 41.4613 179.1299 18 E 4.0345 8.0292 117.9521 58.7057 29.6234 178.0507 19 S 4.4761 7.6150 111.8535 58.7713 63.3412 174.6136 20 G 3.9226 7.9933 110.9621 45.4309 0.0000 173.5213 21 L 3.9357 7.3088 120.8302 55.2866 42.4773 177.6952 22 S 4.5915 8.4163 120.3396 57.4899 65.6976 175.5190 23 K 4.0018 8.4638 122.6311 60.1489 32.3818 179.2080 24 E 3.9442 8.1836 119.3066 59.1958 29.5253 178.8946 25 A 4.0279 8.0372 120.8371 55.0308 18.3911 179.7544 26 L 4.0080 7.6523 117.6891 57.9054 41.7237 179.6779 27 I 3.7524 8.1069 120.1879 64.3513 36.8097 178.2596 28 Q 3.9609 8.1081 119.1936 59.1024 29.2086 177.8733 29 A 4.2206 7.9921 121.5728 55.2177 18.4986 179.3957 30 L 4.2491 8.6717 119.2963 58.1132 41.8524 179.2747 31 G 3.8449 7.9434 104.9562 47.4657 0.0000 174.9498 32 E 4.0278 8.3483 119.4963 57.8226 29.3824 176.9829 33 W 4.3022 8.3367 123.9313 56.6659 29.4289 175.6509 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 2 V 8.04 4.07 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 1.01 0.00 0.00 0.93 0.00 0.00 3 S 8.32 4.17 0.00 4.17 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 4 K 8.76 3.98 0.00 1.79 1.90 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.44 7.81 5 L 7.85 3.93 0.00 1.71 1.67 0.93 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 6 S 8.09 4.37 0.00 3.95 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.04 3.94 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 8 L 8.19 3.94 0.00 1.89 1.86 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.34 3.99 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.65 0.00 10 T 7.85 3.88 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 11 E 8.43 4.14 0.00 2.25 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 0.00 2.31 2.39 0.00 12 L 8.05 4.14 0.00 1.98 1.67 0.97 1.18 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 A 7.95 4.19 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 15 A 8.07 4.03 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 16 L 8.36 3.96 0.00 1.73 1.73 0.93 0.48 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 L 7.85 3.97 0.00 1.84 1.71 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.03 4.03 0.00 2.09 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 2.36 0.00 19 S 7.62 4.48 0.00 4.11 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.99 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 0.00 0.00 0.00 21 L 7.31 3.94 0.00 1.74 1.61 0.93 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.42 4.59 0.00 4.09 3.97 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 23 K 8.46 4.00 0.00 2.00 2.11 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.53 7.81 24 E 8.18 3.94 0.00 2.08 2.05 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 2.40 2.44 0.00 25 A 8.04 4.03 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 26 L 7.65 4.01 0.00 1.85 1.72 0.92 0.84 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 27 I 8.11 3.75 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 1.42 0.88 0.93 0.00 0.00 28 Q 8.11 3.96 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 29 A 7.99 4.22 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.67 4.25 0.00 1.84 1.91 0.73 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.94 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.35 4.03 0.00 1.44 1.43 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 2.25 2.49 0.00 33 W 8.34 4.30 0.00 3.53 2.98 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 * Residues marked with a * may have inaccurate shift predictions.