NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4254 8.4045 118.7933 54.8444 30.8255 175.3871 2 K 4.0714 8.5834 122.0754 53.9423 36.4805 168.9403 3 E 4.1019 9.1561 121.8262 56.2017 28.3797 171.6363 4 G 4.2421 8.7763 106.5109 47.5599 0.0000 173.2623 5 I 4.2498 7.3670 117.7223 60.7745 36.9645 181.3443 *6 H 5.0059 7.7562 121.1410 54.1723 28.4585 180.2049 7 P 4.8704 0.0000 0.0000 64.0261 35.2712 176.6479 8 K 4.3001 8.4043 122.0741 56.6129 35.7144 173.0267 9 L 4.5444 7.2101 112.7497 52.9890 44.6170 175.5749 10 V 3.6605 8.1059 119.8150 61.4006 30.7171 173.7603 11 P 5.0651 0.0000 0.0000 62.1431 33.5805 177.7618 12 A 4.5346 8.2107 125.0928 51.1030 18.5760 177.5800 13 R 4.3069 7.6027 132.1284 56.7088 36.6461 179.9221 14 I 4.1634 9.2221 116.2288 61.1376 34.8171 180.8117 15 I 4.2107 7.3309 123.8256 59.2345 33.7127 178.6721 16 C 4.3407 7.8247 122.3631 55.3355 40.9666 175.0570 17 G 3.9773 7.8304 114.0771 45.0602 0.0000 174.5572 18 C 5.0585 8.5626 118.0503 53.4363 38.7930 174.3903 19 G 3.4213 8.1905 113.7866 46.6117 0.0000 175.1094 20 N 4.7087 8.2847 116.6472 53.4510 36.9288 179.9914 21 V 4.6420 7.4996 115.2122 62.3563 33.8067 181.1383 22 I 4.0529 8.5388 122.9733 64.1905 35.3686 182.4230 23 E 4.6454 7.6417 117.7078 55.7108 30.9502 173.8782 24 T 4.0059 8.5218 121.6736 60.9799 69.6471 175.0877 *25 Y 4.5253 8.1616 126.2440 56.9307 36.2895 174.0856 26 S 4.8070 8.9917 116.3134 60.3135 63.7767 176.1986 27 T 4.1549 8.4429 118.2672 63.2173 66.9440 180.9941 28 K 4.1985 9.2450 118.8394 56.1706 33.4711 177.0553 29 P 4.0674 0.0000 0.0000 64.0598 27.5901 176.1129 30 E 4.2907 8.1079 115.7151 58.0157 30.0086 179.6968 31 I 3.3939 7.7404 117.6467 61.3731 33.2511 176.3095 *32 Y 4.3314 7.3595 123.3807 57.5058 37.5852 176.7520 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 M 8.40 4.43 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 K 8.58 4.07 0.00 1.69 1.64 0.00 1.85 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.07 7.81 3 E 9.16 4.10 0.00 2.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.86 0.00 4 G 8.78 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 0.00 0.00 0.00 0.00 5 I 7.37 4.25 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 1.16 0.77 0.91 0.00 0.00 *6 H 7.76 5.01 0.00 2.92 2.24 0.00 7.23 0.00 0.00 0.00 0.00 6.93 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 4.87 0.00 2.03 0.97 0.00 3.76 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 1.69 1.41 0.00 8 K 8.40 4.30 0.00 1.71 1.60 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.12 0.84 7.81 9 L 7.21 4.54 0.00 1.51 1.45 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.11 3.66 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 0.82 0.00 0.00 0.93 0.00 0.00 11 P 0.00 5.07 0.00 2.01 1.85 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 1.83 1.57 0.00 12 A 8.21 4.53 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.60 4.31 0.00 1.78 1.22 0.00 3.27 0.00 0.00 3.26 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.09 0.00 14 I 9.22 4.16 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 1.27 1.10 0.91 0.00 0.00 15 I 7.33 4.21 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 1.27 1.14 0.91 0.00 0.00 16 C 7.82 4.34 0.00 2.72 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 7.83 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 18 C 8.56 5.06 0.00 2.69 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.19 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.28 4.71 0.00 2.66 2.80 0.00 0.00 6.63 7.67 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 21 V 7.50 4.64 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 0.90 0.00 0.00 0.93 0.00 0.00 22 I 8.54 4.05 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 1.16 1.10 0.91 0.00 0.00 23 E 7.64 4.65 0.00 1.91 1.76 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 2.12 1.86 0.00 24 T 8.52 4.01 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 *25 Y 8.16 4.53 0.00 2.32 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 0.00 0.00 0.00 26 S 8.99 4.81 0.00 3.62 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 27 T 8.44 4.15 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 28 K 9.24 4.20 0.00 1.77 1.62 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.36 1.00 7.81 29 P 0.00 4.07 0.00 2.26 2.05 0.00 3.71 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 1.82 1.57 0.00 30 E 8.11 4.29 0.00 1.98 1.82 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 2.21 1.87 0.00 31 I 7.74 3.39 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 1.27 1.00 0.91 0.00 0.00 *32 Y 7.36 4.33 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 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.