NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 P 4.3487 0.0000 0.0000 61.7332 32.8561 176.3021 -2 R 3.6882 8.3499 119.4724 57.5535 29.5993 175.7335 -1 G 3.9393 9.2034 110.8197 46.0603 0.0000 174.2993 0 S 4.3293 7.5114 115.7068 57.5518 62.8305 177.7025 1 M 4.3353 8.4199 120.2938 54.9204 31.9047 175.6626 2 I 4.4161 8.1934 123.2341 59.5486 39.3031 175.3904 3 R 4.4293 8.3881 123.9656 55.2973 31.4753 175.8439 4 T 4.5113 8.2725 117.5249 62.2816 69.7010 174.2185 5 M 4.7523 8.2169 125.4209 52.6754 35.4600 175.1811 6 L 3.9614 8.4360 123.6570 55.5058 42.4749 176.6961 7 Q 4.0483 8.9430 128.1516 58.1636 29.3547 175.7894 8 G 4.0647 7.4940 102.9335 45.4577 0.0000 172.0488 9 K 4.5237 8.3194 117.4712 55.3869 35.2211 175.4869 10 L 4.3498 8.3411 120.7016 53.6774 42.1068 175.8646 11 H 4.5277 8.7374 124.6553 55.4375 30.3105 174.8631 12 R 3.7330 8.3062 127.9361 57.1156 26.7635 176.9061 13 V 3.9960 7.4985 115.7651 60.8271 33.1391 175.2285 14 K 4.4354 8.1329 122.0909 54.3097 33.6468 176.1592 15 V 3.7211 8.3476 126.4051 63.2623 31.7921 175.5598 16 T 4.4001 8.3823 116.6502 62.4948 70.0009 174.0793 17 H 4.6540 7.7615 119.5920 54.9520 32.6407 172.7282 18 A 4.2712 8.2447 130.7294 51.6073 20.3208 176.0562 *19 D 4.8579 8.3736 121.0581 51.7305 42.2778 172.7030 20 L 4.1162 8.9093 130.2119 57.8196 42.3439 178.0040 *21 H 4.6592 7.8876 116.1072 52.7930 26.5108 173.4450 22 Y 4.8558 8.0039 124.1810 55.6963 40.3877 175.4446 23 E 4.4746 8.2878 127.2980 56.0610 30.4291 176.1828 24 G 3.3291 6.0377 113.2727 45.4720 0.0000 174.2756 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 -3 P 0.00 4.35 0.00 2.19 2.03 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 -2 R 8.35 3.69 0.00 1.91 1.74 0.00 3.34 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.26 0.00 -1 G 9.20 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 7.51 4.33 0.00 3.62 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.42 4.34 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 2 I 8.19 4.42 1.87 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 1.59 0.91 0.91 0.00 0.00 3 R 8.39 4.43 0.00 1.79 1.84 0.00 3.35 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 4 T 8.27 4.51 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 5 M 8.22 4.75 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 6 L 8.44 3.96 0.00 1.58 1.60 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.94 4.05 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 8 G 7.49 4.06 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 0.00 0.00 0.00 9 K 8.32 4.52 0.00 1.84 1.75 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.48 7.81 10 L 8.34 4.35 0.00 1.65 1.66 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 11 H 8.74 4.53 0.00 3.07 3.24 0.00 6.05 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.31 3.73 0.00 1.92 1.95 0.00 3.20 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.16 0.00 13 V 7.50 4.00 2.07 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 0.67 0.00 0.00 0.92 0.00 0.00 14 K 8.13 4.44 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.38 7.81 15 V 8.35 3.72 2.07 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 0.89 0.00 0.00 0.92 0.00 0.00 16 T 8.38 4.40 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 17 H 7.76 4.65 0.00 3.03 3.13 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.24 4.27 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *19 D 8.37 4.86 0.00 2.66 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.91 4.12 0.00 1.58 1.74 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 *21 H 7.89 4.66 0.00 2.96 2.86 0.00 7.22 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.00 4.86 0.00 2.84 2.91 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 23 E 8.29 4.47 0.00 1.80 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 24 G 6.04 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.