NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8812 8.3549 109.7363 45.2179 0.0000 173.0235 2 K 4.2805 8.4686 121.9790 52.3623 33.4148 174.4276 3 K 4.3786 8.2931 124.1722 55.5540 35.1264 177.1101 4 S 4.4749 8.2904 117.5628 57.3648 65.5467 175.2537 5 K 3.9029 8.4571 121.7022 59.5246 31.8921 178.4076 6 A 3.9709 7.9077 120.4865 55.5785 18.4439 179.4229 7 T 3.8206 7.8627 114.2961 66.7548 68.4947 176.6974 8 K 3.9607 8.1647 121.4032 59.4559 32.2227 179.0620 9 K 4.0095 8.0485 118.8283 59.4043 31.9037 179.6548 10 R 3.9238 8.0390 118.4089 59.3110 30.0657 179.0826 11 L 3.9973 8.1155 118.5640 57.5559 41.6245 179.4393 12 A 3.9875 8.1414 120.8455 55.0490 18.2866 179.5854 13 K 3.8871 8.0589 118.0994 59.6625 32.0639 178.8935 14 L 4.1388 7.8393 118.1496 57.9700 41.6948 178.7312 15 D 4.4668 8.2444 117.9173 57.3651 41.2356 177.8591 16 N 4.3625 8.0896 117.4555 56.6236 38.7765 176.8203 17 Q 4.1461 8.3141 118.6855 58.0558 28.8561 177.2057 18 N 4.6029 7.5846 116.8486 53.5716 39.3218 174.9253 19 S 4.3625 7.1558 114.0043 58.3103 64.0007 173.8691 20 R 4.0408 8.0738 121.4709 55.6059 30.5643 176.0506 21 V 3.6540 8.0326 121.5159 61.3162 31.4083 173.8675 22 P 4.0951 0.0000 0.0000 62.8992 31.6252 176.5969 23 A 3.9941 8.8534 122.3434 55.4820 18.1579 180.3084 24 W 4.2835 8.1943 114.3389 59.7508 28.0014 178.3752 25 V 3.4146 6.7137 118.6049 65.7918 30.7036 178.0323 26 M 4.0077 7.7184 118.6128 58.3179 31.4663 178.6621 27 L 4.0124 7.8826 118.6464 57.6491 41.6632 179.3858 28 K 4.0731 8.2466 118.9273 59.4526 32.3675 178.2229 29 T 4.2266 8.0759 106.8555 60.9859 69.7754 173.9005 30 D 4.2950 8.3994 120.3627 55.6025 39.1256 170.4903 31 R 3.6351 7.9062 123.1719 55.6397 31.0264 177.5402 *35 R 3.8775 8.2352 119.4485 56.3295 29.6834 173.9495 36 N 4.5347 7.8783 120.9395 51.8206 37.8403 175.2063 37 H 4.4054 8.2450 121.7229 57.4587 29.0702 176.3796 38 K 4.5292 7.5416 118.6366 55.9914 32.4057 176.7104 39 R 4.1498 7.5278 118.4764 55.7919 29.8785 176.2408 40 R 4.6244 8.2875 123.8493 54.4923 32.4583 174.4695 41 H 5.0093 8.3180 123.1602 53.5875 32.0988 175.0228 42 W 4.2161 8.6400 123.2948 59.5364 27.9926 177.2888 43 R 3.7453 5.8400 117.5728 58.2778 29.8547 177.3337 44 R 3.8754 7.7631 115.5101 58.6283 30.2254 176.4122 45 N 4.8616 7.6487 113.9412 51.7646 40.8834 173.3954 46 D 4.5233 8.1418 117.9831 53.5409 43.6335 175.3664 47 T 4.2783 8.3504 117.1871 60.8951 70.2988 173.2973 48 D 4.6078 8.2165 121.8331 54.1673 42.2305 176.7950 49 E 4.1438 8.6384 118.4645 56.9608 28.9050 174.9471 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 G 8.35 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 0.00 0.00 0.00 2 K 8.47 4.28 0.00 1.82 1.75 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.43 7.81 3 K 8.29 4.38 0.00 1.85 1.80 0.00 1.56 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.41 7.81 4 S 8.29 4.47 0.00 4.07 4.05 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 0.00 0.00 0.00 0.00 5 K 8.46 3.90 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.51 7.81 6 A 7.91 3.97 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 7 T 7.86 3.82 4.46 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 1.25 0.00 0.00 8 K 8.16 3.96 0.00 1.96 2.01 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 9 K 8.05 4.01 0.00 2.02 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.69 7.81 10 R 8.04 3.92 0.00 2.04 1.98 0.00 3.35 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 11 L 8.12 4.00 0.00 1.84 1.72 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.14 3.99 1.42 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 13 K 8.06 3.89 0.00 1.86 2.00 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 L 7.84 4.14 0.00 1.86 1.74 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.24 4.47 0.00 2.81 2.85 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 0.00 0.00 0.00 16 N 8.09 4.36 0.00 2.88 2.93 0.00 0.00 7.22 6.52 0.00 0.00 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 Q 8.31 4.15 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 18 N 7.58 4.60 0.00 2.92 2.86 0.00 0.00 7.20 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.16 4.36 0.00 4.05 3.85 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 0.00 0.00 0.00 20 R 8.07 4.04 0.00 1.77 1.84 0.00 3.21 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 21 V 8.03 3.65 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.83 0.00 0.00 22 P 0.00 4.10 0.00 1.38 2.01 0.00 3.51 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 1.28 1.57 0.00 23 A 8.85 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.19 4.28 0.00 3.58 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.71 3.41 1.79 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 0.92 0.00 0.00 -0.21 0.00 0.00 26 M 7.72 4.01 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 27 L 7.88 4.01 0.00 1.93 1.78 0.99 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.25 4.07 0.00 2.07 2.00 0.00 2.07 0.00 0.00 2.04 0.00 0.00 3.17 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.55 7.81 29 T 8.08 4.23 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 1.28 0.00 0.00 30 D 8.40 4.29 0.00 2.82 2.76 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 31 R 7.91 3.64 0.00 1.96 1.93 0.00 3.19 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 *35 R 8.24 3.88 0.00 1.75 1.77 0.00 3.21 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 36 N 7.88 4.53 0.00 2.72 2.66 0.00 0.00 7.09 7.89 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 37 H 8.24 4.41 0.00 3.16 3.34 0.00 5.92 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.54 4.53 0.00 1.72 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.40 7.81 39 R 7.53 4.15 0.00 1.84 1.89 0.00 3.10 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 40 R 8.29 4.62 0.00 1.71 2.00 0.00 3.24 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 41 H 8.32 5.01 0.00 3.11 2.98 0.00 5.93 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.64 4.22 0.00 3.51 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 43 R 5.84 3.75 0.00 0.67 1.14 0.00 2.59 0.00 0.00 2.92 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.22 0.00 44 R 7.76 3.88 0.00 1.74 1.90 0.00 3.31 0.00 0.00 3.09 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 45 N 7.65 4.86 0.00 2.96 2.77 0.00 0.00 6.75 8.02 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 46 D 8.14 4.52 0.00 2.57 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 47 T 8.35 4.28 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 1.24 0.00 0.00 48 D 8.22 4.61 0.00 2.69 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 49 E 8.64 4.14 0.00 2.12 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 0.00 2.18 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.