NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.1702 0.0000 0.0000 62.5489 32.4136 179.2837 *3 G 3.8872 8.7484 107.8596 44.5912 0.0000 170.6185 4 P 4.4104 0.0000 0.0000 62.8490 29.3971 179.9121 *6 G 3.8927 8.9131 115.6557 45.1419 0.0000 172.6283 7 P 4.3415 0.0000 0.0000 63.0863 29.7725 179.3061 *9 G 3.8568 8.9111 107.2213 44.2109 0.0000 170.1083 10 P 3.9506 0.0000 0.0000 64.2919 29.6635 178.1532 *12 G 3.7626 8.9208 101.0912 43.6584 0.0000 170.9697 13 P 3.9316 0.0000 0.0000 61.3597 30.6682 176.7316 14 G 3.9148 8.8230 114.3864 45.0042 0.0000 171.1087 15 P 4.4394 0.0000 0.0000 62.3899 29.6226 179.9741 *17 G 3.9084 8.8667 118.4244 45.3784 0.0000 172.1051 18 P 4.7485 0.0000 0.0000 62.0665 30.0744 179.6086 *20 G 3.8535 8.6089 107.2511 44.2679 0.0000 170.6482 21 P 4.0327 0.0000 0.0000 63.9939 29.4842 178.4784 *23 G 3.9056 8.9022 106.7614 44.4291 0.0000 171.1882 24 P 4.4110 0.0000 0.0000 62.7943 29.6294 179.8014 *26 G 3.8233 8.8774 116.8270 45.3691 0.0000 171.8247 27 P 4.4854 0.0000 0.0000 62.0259 31.4904 177.2585 *29 G 3.7274 8.6227 111.4196 46.9346 0.0000 172.2528 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 P 0.00 4.17 0.00 2.19 1.32 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.97 0.00 *3 G 8.75 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.41 0.00 2.05 1.39 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 *6 G 8.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 P 0.00 4.34 0.00 2.19 1.54 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 *9 G 8.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 3.95 0.00 2.19 1.89 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 *12 G 8.92 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.93 0.00 2.19 1.98 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 14 G 8.82 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.44 0.00 2.05 1.37 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 *17 G 8.87 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.75 0.00 2.19 1.18 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 *20 G 8.61 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 0.00 0.00 0.00 21 P 0.00 4.03 0.00 2.19 1.75 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 *23 G 8.90 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.41 0.00 2.05 1.40 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 *26 G 8.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.49 0.00 2.05 1.92 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 *29 G 8.62 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.