NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3812 8.2893 120.3178 54.6711 32.2237 174.8445 2 P 4.1948 0.0000 0.0000 60.2601 32.4015 175.2215 3 L 4.5322 7.9056 120.7603 53.1860 42.4857 175.4397 4 P 4.5126 0.0000 0.0000 61.8908 32.7709 173.9691 5 P 4.0459 0.0000 0.0000 64.4821 31.8369 176.3581 6 G 4.0287 9.5262 112.0048 44.7398 0.0000 171.9898 7 W 5.2765 7.7012 117.2426 54.5525 31.9729 174.7069 8 E 5.0060 9.8371 124.7504 54.3474 33.2179 173.9967 9 R 4.8695 8.6647 121.2328 54.3794 31.6816 175.0356 10 R 4.4922 8.2680 122.8175 54.1101 33.7115 174.5044 11 T 4.8632 8.1778 112.8736 60.4794 70.5159 173.9316 12 D 4.9886 9.2555 125.8051 52.6493 42.6381 176.6406 13 V 3.7988 8.5105 120.1015 64.6311 31.4201 177.3229 14 E 3.9877 8.4626 119.0655 58.5153 29.3215 178.3885 *16 G 4.2509 7.8058 106.0393 44.8004 0.0000 172.6987 17 K 4.7227 7.8287 119.5490 55.3333 34.3262 176.0150 18 V 4.7337 8.6922 122.7895 60.2370 33.0693 174.3338 19 Y 4.0894 8.2043 124.5288 55.0146 40.8481 174.0549 20 Y 5.0767 8.9002 119.5518 56.4448 40.5803 174.3286 21 F 5.0868 9.8272 128.1087 56.3110 41.8804 174.1589 22 N 3.4739 8.1099 127.0866 52.3178 37.9517 175.7869 23 V 3.8616 8.5607 128.2738 65.5283 32.1576 178.7726 24 R 3.7202 7.7997 118.8933 58.7593 29.8407 177.4809 25 T 4.2631 7.5450 103.7853 60.3373 69.4121 173.7198 26 L 3.1740 6.6504 120.3373 56.2992 39.7817 174.2706 27 T 4.2507 6.9004 114.4740 62.2348 70.6941 174.6636 28 T 4.9956 8.3439 123.0288 62.3159 69.9208 173.6205 29 T 4.7447 9.2432 121.1749 59.4715 71.6682 173.5799 30 W 5.1744 8.7190 124.0207 56.9258 29.4730 176.7438 31 E 4.5531 7.7052 116.7950 53.8734 31.3223 175.3424 32 R 2.5602 8.2459 125.3490 55.2854 30.4953 174.4095 33 P 2.9700 0.0000 0.0000 62.6483 31.1312 176.4731 34 T 4.1065 7.5719 113.7027 60.3142 69.9907 175.8891 35 I 3.7724 7.7192 122.6298 61.6075 34.7749 171.3428 36 I 3.4307 8.0566 129.7716 60.0768 39.1346 172.4271 37 L 4.7866 8.5393 127.7321 53.2926 44.5506 175.7922 38 E 4.3238 8.8598 124.2142 56.5681 29.9770 175.7260 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 8.29 4.38 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 2 P 0.00 4.19 0.00 2.23 2.02 0.00 3.65 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 3 L 7.91 4.53 0.00 1.69 1.70 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.51 0.00 2.30 2.28 0.00 3.43 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 2.29 2.00 0.00 5 P 0.00 4.05 0.00 2.00 2.11 0.00 3.70 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 6 G 9.53 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 7 W 7.70 5.28 0.00 3.43 3.14 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 0.00 0.00 0.00 8 E 9.84 5.01 0.00 2.10 1.83 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 2.16 2.23 0.00 9 R 8.66 4.87 0.00 1.28 1.93 0.00 3.26 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 10 R 8.27 4.49 0.00 0.67 1.34 0.00 2.89 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.21 0.00 11 T 8.18 4.86 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 12 D 9.26 4.99 0.00 2.96 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.51 3.80 2.11 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 0.91 0.00 0.00 0.95 0.00 0.00 14 E 8.46 3.99 0.00 2.17 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 0.00 2.37 2.54 0.00 *16 G 7.81 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 0.00 0.00 0.00 0.00 17 K 7.83 4.72 0.00 2.15 2.28 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.52 7.81 18 V 8.69 4.73 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 0.91 0.00 0.00 0.44 0.00 0.00 19 Y 8.20 4.09 0.00 2.03 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 20 Y 8.90 5.08 0.00 3.39 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.83 5.09 0.00 3.13 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 22 N 8.11 3.47 0.00 1.44 1.86 0.00 0.00 6.10 7.08 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 23 V 8.56 3.86 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.18 0.00 0.00 24 R 7.80 3.72 0.00 1.83 1.88 0.00 3.15 0.00 0.00 3.52 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 25 T 7.54 4.26 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 26 L 6.65 3.17 0.00 1.74 1.82 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 27 T 6.90 4.25 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 1.13 0.00 0.00 28 T 8.34 5.00 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 29 T 9.24 4.74 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 30 W 8.72 5.17 0.00 3.43 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.71 4.55 0.00 2.03 1.89 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 2.08 2.19 0.00 32 R 8.25 2.56 0.00 1.53 1.48 0.00 3.18 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.38 0.00 33 P 0.00 2.97 0.00 1.52 0.71 0.00 3.14 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.32 0.00 34 T 7.57 4.11 4.14 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 0.00 0.00 1.14 0.00 0.00 35 I 7.72 3.77 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.47 0.89 0.00 0.00 36 I 8.06 3.43 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.53 0.92 0.00 0.00 37 L 8.54 4.79 0.00 1.70 1.78 0.98 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.86 4.32 0.00 1.97 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.