NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9807 8.3393 109.7364 44.7405 0.0000 175.4438 2 P 4.1862 0.0000 0.0000 61.4918 31.8315 173.5040 *4 G 3.8807 9.1042 107.9662 45.1095 0.0000 174.7704 5 P 4.6050 0.0000 0.0000 62.1720 30.2333 180.5263 *7 G 3.9051 8.7958 113.1394 45.2883 0.0000 173.7175 8 P 4.5818 0.0000 0.0000 62.2940 30.3880 179.9968 *10 G 3.8456 8.7683 103.2684 44.0862 0.0000 173.2850 11 P 4.5226 0.0000 0.0000 61.7327 30.3931 176.0822 *13 G 3.8180 8.3614 107.4395 44.2426 0.0000 172.3345 14 P 4.7372 0.0000 0.0000 61.8479 30.6372 176.4675 15 R 4.6255 8.3545 122.6073 54.7261 33.3774 175.3065 16 G 3.8540 8.8420 110.5873 45.9120 0.0000 173.3473 17 R 3.9451 8.4799 122.4031 55.9193 30.6613 176.5235 18 T 3.8013 8.6420 116.6589 62.2428 67.6877 173.6551 19 G 4.0303 8.5637 116.6182 44.9615 0.0000 174.5457 20 P 4.4931 0.0000 0.0000 62.4978 30.4072 179.9180 *22 G 3.8558 8.7921 104.5816 44.0925 0.0000 173.5686 23 P 4.5538 0.0000 0.0000 61.7978 30.3407 177.1906 *25 G 3.8344 8.3974 107.1982 44.2508 0.0000 172.4979 26 P 4.5622 0.0000 0.0000 61.6669 30.6008 176.9748 *28 G 3.7451 8.3949 115.1207 45.8083 0.0000 170.3926 29 P 4.4298 0.0000 0.0000 62.7069 31.6554 175.8676 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 G 8.34 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 0.00 0.00 0.00 2 P 0.00 4.19 0.00 2.27 2.07 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 2.02 0.00 *4 G 9.10 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 0.00 0.00 0.00 5 P 0.00 4.61 0.00 2.05 1.22 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 2.08 0.00 *7 G 8.80 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 8 P 0.00 4.58 0.00 2.19 1.27 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 *10 G 8.77 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 11 P 0.00 4.52 0.00 2.19 1.86 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 1.99 1.97 0.00 *13 G 8.36 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 14 P 0.00 4.74 0.00 2.05 1.89 0.00 3.62 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 2.02 2.11 0.00 15 R 8.35 4.63 0.00 1.74 1.78 0.00 3.24 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 16 G 8.84 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 17 R 8.48 3.95 0.00 1.81 1.89 0.00 3.25 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 18 T 8.64 3.80 4.24 0.00 0.00 0.00 0.00 0.00 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 19 G 8.56 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.49 0.00 2.19 1.30 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 1.99 1.96 0.00 *22 G 8.79 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 23 P 0.00 4.55 0.00 2.19 1.69 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 1.99 1.97 0.00 *25 G 8.40 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.56 0.00 2.05 1.84 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 2.08 0.00 *28 G 8.39 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 29 P 0.00 4.43 0.00 2.18 2.03 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 * Residues marked with a * may have inaccurate shift predictions.