NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.0771 8.1744 117.3643 63.5102 69.2935 171.9849 3 S 4.4702 7.2579 118.0706 56.9072 64.6615 171.1082 4 Y 4.7180 7.7754 118.0988 57.1800 42.4233 174.1185 5 T 4.6545 8.5380 113.9463 59.7395 71.5820 172.7486 6 L 4.8041 8.5669 127.1645 53.1354 44.4469 174.8998 7 N 5.1560 8.1019 120.9049 51.8988 42.5641 173.4371 8 E 4.6702 8.1420 116.7493 56.1908 32.9973 176.8647 9 V 3.9150 7.9966 122.5358 61.6572 30.1653 175.0769 10 V 4.3618 7.8386 125.5257 60.2245 31.5158 173.9155 11 P 4.6028 0.0000 0.0000 60.9764 29.4779 176.9848 12 L 4.0115 8.3424 122.9225 57.9389 41.6573 178.3795 13 K 3.7102 8.0578 117.3778 59.8269 31.9421 177.5973 14 E 3.8670 8.0025 118.2334 57.5651 29.4964 176.8492 15 F 4.8710 7.6566 116.0391 58.3559 40.9256 176.1165 16 V 4.3664 7.5307 118.0647 58.9180 33.0414 173.7201 17 P 4.5358 0.0000 0.0000 62.4066 31.8299 176.0341 18 E 3.8115 8.4085 117.4769 58.8113 29.5333 177.5373 19 W 4.4508 7.9425 121.9240 55.9651 29.3423 176.0381 20 V 4.6522 8.2311 116.7255 59.2624 34.5016 174.7110 21 R 4.6528 8.2956 119.2701 54.7398 32.8050 174.1058 22 I 4.5331 7.8403 117.0970 59.0004 40.5825 175.6898 23 G 3.3467 7.0617 106.7154 45.9422 0.0000 171.5172 24 F 4.9352 7.8401 118.0899 55.8484 42.3513 174.1803 25 S 4.5882 8.2199 112.7177 58.0781 64.7994 174.3477 26 A 4.5537 8.1948 123.6985 51.5163 21.8011 175.3494 27 T 4.6664 7.7810 109.0665 60.9544 71.6829 172.5683 28 T 4.8045 7.7960 110.6582 61.8444 72.7087 173.4310 29 G 3.9337 8.2842 116.1360 45.5743 0.0000 175.8871 30 A 4.1133 9.2550 127.6045 54.1485 18.2359 177.4116 31 E 4.9257 8.0188 113.4764 54.6371 32.8890 174.3474 32 F 5.2224 7.3703 113.8124 55.4511 41.1217 173.3177 33 A 4.2574 7.9829 121.1226 51.7689 20.9605 175.6956 34 A 4.3615 8.5425 123.8157 51.5647 19.7089 176.8629 35 H 4.9335 8.6332 119.6387 53.6896 31.3797 173.3842 36 E 4.6001 8.3958 121.2062 54.6986 32.4042 174.6238 37 V 3.9280 8.0922 121.8260 61.7827 32.7073 175.3882 38 L 4.5480 8.1672 124.9666 55.8450 43.0756 176.6628 39 S 4.7997 7.6406 111.3352 57.6042 66.6463 173.6366 40 W 5.6560 8.5520 131.3673 56.5771 33.5680 173.3674 41 Y 4.8594 8.7307 124.8930 56.2154 41.5852 173.6405 42 F 4.1538 7.4585 124.4619 57.3525 42.1747 172.8490 43 N 4.4758 6.6153 122.9402 52.3534 41.5902 173.5005 44 S 4.3700 7.7262 119.1291 56.3030 65.2102 172.4374 45 E 4.6314 7.9197 116.3722 55.7437 30.8535 174.6743 46 L 4.5981 8.4785 130.6899 54.0520 44.2587 177.0644 47 S 4.1687 8.5952 122.1700 61.1339 62.8802 176.3299 *48 V 3.9936 7.6163 121.4985 60.7866 32.0675 176.9063 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 T 8.17 4.08 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 1.19 0.00 0.00 3 S 7.26 4.47 0.00 3.88 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.78 4.72 0.00 2.91 2.78 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 5 T 8.54 4.65 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 1.25 0.00 0.00 6 L 8.57 4.80 0.00 1.62 1.58 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.10 5.16 0.00 2.69 2.66 0.00 0.00 6.87 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 8 E 8.14 4.67 0.00 1.91 1.81 0.00 0.00 0.00 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 2.13 0.00 9 V 8.00 3.92 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 0.76 0.00 0.00 0.95 0.00 0.00 10 V 7.84 4.36 2.17 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 1.05 0.00 0.00 0.98 0.00 0.00 11 P 0.00 4.60 0.00 2.00 1.90 0.00 3.91 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 12 L 8.34 4.01 0.00 1.74 1.77 1.06 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.06 3.71 0.00 1.67 1.76 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.46 7.81 14 E 8.00 3.87 0.00 1.52 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 2.03 2.03 0.00 15 F 7.66 4.87 0.00 3.10 2.98 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 16 V 7.53 4.37 2.17 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 0.80 0.00 0.00 0.98 0.00 0.00 17 P 0.00 4.54 0.00 2.27 2.18 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 18 E 8.41 3.81 0.00 1.97 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 19 W 7.94 4.45 0.00 3.29 3.17 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 20 V 8.23 4.65 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 0.77 0.00 0.00 0.96 0.00 0.00 21 R 8.30 4.65 0.00 1.72 1.74 0.00 3.18 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 22 I 7.84 4.53 1.77 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.63 0.80 0.00 0.00 23 G 7.06 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.84 4.94 0.00 2.84 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.22 4.59 0.00 3.90 3.76 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 0.00 0.00 0.00 26 A 8.19 4.55 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 4.67 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 1.19 0.00 0.00 28 T 7.80 4.80 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 29 G 8.28 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.26 4.11 1.32 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 0.00 0.00 0.00 31 E 8.02 4.93 0.00 1.98 1.73 0.00 0.00 0.00 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 2.25 0.00 32 F 7.37 5.22 0.00 3.12 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.98 4.26 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.54 4.36 1.24 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 35 H 8.63 4.93 0.00 3.08 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.40 4.60 0.00 1.98 1.84 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 2.14 2.26 0.00 37 V 8.09 3.93 1.88 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 0.42 0.00 0.00 0.09 0.00 0.00 38 L 8.17 4.55 0.00 1.67 1.70 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.64 4.80 0.00 3.94 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 40 W 8.55 5.66 0.00 3.45 3.18 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 0.00 41 Y 8.73 4.86 0.00 2.92 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 42 F 7.46 4.15 0.00 2.67 2.28 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 43 N 6.62 4.48 0.00 2.47 2.30 0.00 0.00 6.79 7.63 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 44 S 7.73 4.37 0.00 3.96 3.79 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 0.00 0.00 0.00 45 E 7.92 4.63 0.00 1.83 1.75 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 2.02 2.05 0.00 46 L 8.48 4.60 0.00 1.51 1.45 0.83 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.60 4.17 0.00 3.67 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 *48 V 7.62 3.99 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 * Residues marked with a * may have inaccurate shift predictions.