NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 G 3.8165 8.3544 109.7365 45.3535 0.0000 172.9765 12 D 4.4818 8.3788 120.2588 51.6900 41.4317 174.1609 13 P 4.3981 0.0000 0.0000 65.0883 33.0858 176.2841 14 E 4.5222 8.3179 119.1483 55.9773 29.2624 177.6069 15 L 4.2104 7.8950 117.7275 56.7288 42.0333 178.0151 16 C 4.5173 7.7585 114.5937 59.3453 29.5917 174.0218 17 A 4.0205 7.6886 123.5031 52.6590 18.3407 177.2904 18 T 4.3482 8.2048 112.6729 60.7472 70.2544 174.4658 19 D 4.4924 8.3964 123.2186 54.0270 41.7232 175.5560 20 E 4.4850 8.3826 123.1461 54.3939 30.4934 175.7803 21 M 4.2088 8.5043 126.2061 55.4721 32.7161 175.7633 22 I 4.1402 8.0179 122.7933 59.1394 38.5045 174.9037 23 P 4.5007 0.0000 0.0000 61.2044 30.0017 175.4684 24 F 4.4768 7.9326 124.6599 58.4427 40.4406 175.7299 25 K 4.3272 8.2627 122.7497 56.5701 34.9381 177.4897 26 D 4.9473 8.5913 117.1184 53.5081 39.5589 174.6362 27 E 4.7048 7.7734 119.4524 54.8939 33.5916 177.9174 28 G 3.7804 8.4989 106.0539 44.9256 0.0000 171.9265 29 D 4.4846 8.4446 119.2090 53.4199 41.6508 176.3857 30 P 4.4972 0.0000 0.0000 64.3568 31.4501 176.9012 31 Q 4.3038 8.2450 116.6587 56.5810 29.1313 176.4604 32 K 4.4421 7.9615 116.2887 56.5876 32.4070 176.7386 33 E 4.6308 8.0812 117.2084 55.7734 30.1173 175.2865 34 K 4.6139 7.6314 117.6967 53.9452 35.0718 175.8480 35 I 3.8498 8.1041 121.2929 61.3117 37.3541 175.9738 36 F 4.0970 9.3034 128.1651 61.1798 39.2522 175.7125 37 A 4.1405 7.9642 121.0012 51.9962 18.7479 176.7330 38 E 4.1068 8.4398 120.3404 56.2497 30.2284 176.8090 39 I 4.5449 7.9274 125.3918 60.5861 40.8220 177.2242 40 S 4.6689 8.2046 121.5478 58.1585 63.8045 173.6775 *41 H 4.3299 8.0457 120.2123 57.2956 29.2773 177.7483 *45 E 4.2080 7.8098 117.6927 58.5863 29.5848 176.1504 46 G 3.9436 9.1580 105.0702 45.3491 0.0000 172.9777 47 D 4.5922 7.5595 117.4265 56.2449 42.3063 177.8557 48 L 4.2220 7.6596 117.7624 56.2631 41.9856 178.7286 49 A 3.9861 7.5808 121.3786 55.5389 17.8450 179.3271 50 D 4.2946 8.0355 116.5230 57.6042 41.0567 178.6755 51 I 3.8531 7.6929 118.2422 63.3584 38.2112 177.8415 52 K 3.9799 8.2791 119.9719 59.3878 31.7237 179.0535 53 S 4.1190 7.9309 115.2664 61.7753 62.9071 176.7446 54 S 4.0914 7.6992 114.8652 61.5996 62.0977 176.1603 55 L 4.0102 7.7430 121.0270 57.9213 41.0899 179.7949 56 V 3.7214 7.5344 117.0084 65.7603 31.4516 177.7173 57 N 4.4647 7.7292 115.8006 56.4033 38.5403 176.5157 58 E 4.1044 7.7369 118.3075 59.3604 30.6816 179.6028 59 S 4.5319 7.5838 112.5598 56.5977 60.5157 173.9877 60 E 4.6525 7.6518 123.1699 58.0792 28.7512 176.8065 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 11 G 8.35 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.38 4.48 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.40 0.00 2.08 2.09 0.00 3.72 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 14 E 8.32 4.52 0.00 2.00 1.93 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 2.27 2.41 0.00 15 L 7.89 4.21 0.00 1.63 1.72 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 C 7.76 4.52 0.00 2.94 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.69 4.02 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 18 T 8.20 4.35 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 19 D 8.40 4.49 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.38 4.49 0.00 1.89 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 2.17 2.28 0.00 21 M 8.50 4.21 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.64 0.00 22 I 8.02 4.14 1.48 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 1.33 0.48 -0.13 0.00 0.00 23 P 0.00 4.50 0.00 2.08 2.02 0.00 3.24 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.01 0.00 24 F 7.93 4.48 0.00 3.08 3.02 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 25 K 8.26 4.33 0.00 1.73 1.63 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.49 7.81 26 D 8.59 4.95 0.00 2.65 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 27 E 7.77 4.70 0.00 2.04 1.91 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 2.21 2.32 0.00 28 G 8.50 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 29 D 8.44 4.48 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.08 2.09 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 31 Q 8.24 4.30 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 32 K 7.96 4.44 0.00 1.79 1.87 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.48 1.63 7.81 33 E 8.08 4.63 0.00 1.93 1.91 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 2.21 2.31 0.00 34 K 7.63 4.61 0.00 1.70 1.70 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.59 7.81 35 I 8.10 3.85 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.48 1.02 0.00 0.00 36 F 9.30 4.10 0.00 2.99 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 4.14 1.30 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 0.00 0.00 38 E 8.44 4.11 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 39 I 7.93 4.54 1.85 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 1.26 0.74 0.90 0.00 0.00 40 S 8.20 4.67 0.00 3.57 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.05 4.33 0.00 2.92 3.01 0.00 7.20 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *45 E 7.81 4.21 0.00 1.92 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 2.19 2.46 0.00 46 G 9.16 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 47 D 7.56 4.59 0.00 2.62 2.66 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 0.00 0.00 0.00 0.00 48 L 7.66 4.22 0.00 2.14 1.69 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.58 3.99 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 50 D 8.04 4.29 0.00 2.70 2.73 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 0.00 0.00 0.00 51 I 7.69 3.85 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 1.64 1.35 0.91 0.00 0.00 52 K 8.28 3.98 0.00 2.09 1.84 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 53 S 7.93 4.12 0.00 4.11 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 54 S 7.70 4.09 0.00 3.89 4.02 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 55 L 7.74 4.01 0.00 1.90 1.71 0.92 0.85 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 56 V 7.53 3.72 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.02 0.00 0.00 57 N 7.73 4.46 0.00 2.83 2.86 0.00 0.00 7.02 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.74 4.10 0.00 2.11 2.04 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 2.36 2.35 0.00 59 S 7.58 4.53 0.00 4.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.65 4.65 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.