NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.7838 8.3501 109.7346 45.5019 0.0000 172.3664 3 A 4.5305 7.5267 123.1805 50.8610 21.7917 176.1510 4 Q 4.3169 9.3021 117.8186 54.6080 33.2749 173.1924 5 V 4.2967 8.4527 125.0015 61.8604 32.6081 174.9265 6 S 4.7965 7.7954 121.8975 56.4738 67.1612 173.2012 7 T 4.5914 7.9461 110.3930 60.7811 69.8506 174.6501 8 Q 4.6685 8.3778 122.1512 54.6279 30.8594 175.1123 9 K 4.2896 8.5767 122.1665 56.3037 32.9073 175.9214 10 T 4.7212 8.2735 115.6657 60.4047 71.5427 173.0928 11 G 3.8908 8.5148 107.5903 46.1231 0.0000 172.5331 *25 I 4.1858 7.2112 119.6960 61.6195 39.0291 173.7716 26 H 5.1889 8.7360 117.8370 55.1070 33.3145 173.4876 27 Y 4.7562 8.6294 118.3062 55.8141 40.1689 174.5779 28 T 4.4090 8.7161 121.6803 63.9058 69.6280 173.6311 29 N 5.1453 9.2190 123.0812 52.2083 42.7719 173.1101 30 I 4.8598 8.2937 125.0113 59.5443 41.0208 174.4015 31 N 4.3916 8.4664 121.8840 51.6771 40.8695 174.3378 32 Y 4.4551 7.7133 117.3369 58.1164 39.5571 175.5304 33 Y 4.7935 7.4615 117.6306 56.2700 39.5841 176.6012 34 K 4.1299 8.7783 121.7418 57.9271 32.8697 176.7136 35 D 4.9747 7.5623 120.0745 52.0209 42.9393 177.2900 36 A 4.0861 8.5730 125.7863 54.5735 18.6959 179.2145 37 A 4.1050 7.8776 117.6707 54.6736 18.6416 178.3639 38 S 4.3010 7.8323 110.2369 59.2035 63.1216 174.2286 39 N 4.7669 7.5828 118.6999 51.9379 39.3002 174.9103 40 S 4.3052 8.2747 114.2292 57.7415 63.8006 173.7718 41 A 4.2242 8.2630 123.9473 52.6417 18.9498 178.0711 42 N 4.8478 8.1264 117.9370 52.0260 37.3307 175.6641 43 R 4.1629 7.9418 118.9972 58.3775 30.9907 177.3682 44 Q 3.8246 7.7367 116.3310 55.7970 29.1959 175.9239 45 D 4.4086 7.4757 119.0389 52.7993 40.5028 174.5243 46 F 5.0988 7.4751 122.9083 57.3150 39.4599 176.6686 47 T 4.1385 7.7013 116.9311 64.1503 68.8648 173.5087 48 Q 4.6668 8.1771 122.2942 55.9769 32.2713 174.3819 49 D 4.7984 8.1182 121.1808 52.9586 42.5720 173.8077 50 P 4.7140 0.0000 0.0000 64.8627 32.0902 178.6050 51 S 5.5306 7.8831 112.7547 57.9316 62.4910 175.2656 52 K 4.0290 7.0959 120.7933 58.6783 33.0989 178.0342 53 F 4.6192 7.4265 115.5568 59.1829 40.1627 176.1978 54 T 4.2089 8.4292 113.2688 61.9251 69.2963 174.3716 55 E 3.7544 8.8325 127.1824 56.7272 25.5682 173.1145 56 P 4.6757 0.0000 0.0000 62.9365 32.1107 176.6483 57 V 3.8516 7.1377 112.2167 61.6396 32.1883 176.6548 58 K 4.0434 8.7352 125.0264 59.3016 32.3667 176.8033 59 D 4.8198 7.7171 117.1017 52.3782 42.1374 176.4715 60 I 3.6929 8.2978 124.5547 61.8492 37.6207 175.4392 61 M 4.5218 8.4251 124.1055 53.5680 33.0511 175.4582 62 I 4.1160 8.0567 125.5505 60.0212 38.4370 176.5748 63 K 3.8228 8.9138 127.2240 59.9664 31.9146 178.1101 64 S 4.2881 8.0278 111.7007 60.0147 63.0026 174.1748 65 L 4.6870 7.1974 120.4665 51.8258 43.4050 174.4194 66 P 4.3283 0.0000 0.0000 62.4728 31.8938 176.1308 67 A 4.0384 8.9047 126.4514 54.4821 18.4251 177.1992 68 L 4.6283 7.7583 115.6059 53.0798 43.0259 176.0794 69 N 4.5356 8.5080 121.4369 53.7282 39.2459 173.6965 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 G 8.35 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 7.53 4.53 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.30 4.32 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.58 0.00 5 V 8.45 4.30 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 0.78 0.00 0.00 0.91 0.00 0.00 6 S 7.80 4.80 0.00 3.08 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.95 4.59 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 8 Q 8.38 4.67 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.96 0.00 0.00 0.00 0.00 0.00 2.63 2.52 0.00 9 K 8.58 4.29 0.00 1.81 1.78 0.00 1.66 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.51 7.81 10 T 8.27 4.72 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 1.23 0.00 0.00 11 G 8.51 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 *25 I 7.21 4.19 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.44 0.98 0.00 0.00 26 H 8.74 5.19 0.00 2.91 3.10 0.00 5.86 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.63 4.76 0.00 2.95 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.72 4.41 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 29 N 9.22 5.15 0.00 3.02 2.84 0.00 0.00 6.88 7.72 0.00 0.00 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 I 8.29 4.86 1.76 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 0.78 0.00 0.00 31 N 8.47 4.39 0.00 2.56 2.61 0.00 0.00 6.86 7.46 0.00 0.00 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 Y 7.71 4.46 0.00 2.09 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 7.46 4.79 0.00 3.05 2.88 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 34 K 8.78 4.13 0.00 1.80 1.90 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.53 7.81 35 D 7.56 4.97 0.00 2.78 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.57 4.09 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 37 A 7.88 4.11 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.83 4.30 0.00 4.06 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.58 4.77 0.00 2.79 2.77 0.00 0.00 6.95 8.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.27 4.31 0.00 3.98 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 41 A 8.26 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.13 4.85 0.00 2.70 2.75 0.00 0.00 6.96 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.94 4.16 0.00 1.87 2.08 0.00 3.39 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 44 Q 7.74 3.82 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.11 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 45 D 7.48 4.41 0.00 2.47 2.49 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 46 F 7.48 5.10 0.00 3.10 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.70 4.14 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 48 Q 8.18 4.67 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.20 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 49 D 8.12 4.80 0.00 2.74 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.71 0.00 2.28 2.21 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 51 S 7.88 5.53 0.00 3.93 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 52 K 7.10 4.03 0.00 0.79 1.21 0.00 1.16 0.00 0.00 1.40 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.12 1.26 7.81 53 F 7.43 4.62 0.00 3.04 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.43 4.21 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 55 E 8.83 3.75 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 56 P 0.00 4.68 0.00 2.16 2.36 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 57 V 7.14 3.85 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 0.65 0.00 0.00 0.96 0.00 0.00 58 K 8.74 4.04 0.00 1.71 1.83 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.45 7.81 59 D 7.72 4.82 0.00 2.70 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.30 3.69 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.46 0.91 0.00 0.00 61 M 8.43 4.52 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 62 I 8.06 4.12 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 1.30 1.28 0.91 0.00 0.00 63 K 8.91 3.82 0.00 1.71 1.86 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 64 S 8.03 4.29 0.00 3.90 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 65 L 7.20 4.69 0.00 1.69 1.57 0.92 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.33 0.00 2.33 2.07 0.00 3.78 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 67 A 8.90 4.04 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 68 L 7.76 4.63 0.00 1.62 1.61 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.51 4.54 0.00 2.61 2.60 0.00 0.00 7.09 7.56 0.00 0.00 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.