NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.3189 8.3093 122.8236 58.2101 40.5076 173.0422 2 V 4.2278 7.6366 121.7827 58.3912 33.6926 173.5574 3 N 4.1331 9.5004 117.5790 54.3693 39.8079 177.8169 4 Q 4.3559 8.5294 123.9546 55.1419 27.2180 174.5245 5 H 4.6879 7.9231 114.7714 54.1235 30.0120 175.1918 6 L 4.8388 8.3972 124.0852 53.3183 45.0407 175.3844 7 C 4.4945 8.8860 118.8696 61.3546 31.5469 176.1338 *9 S 4.2709 8.0093 112.5879 58.0811 63.7683 174.9680 10 D 4.3834 8.0624 119.5817 56.4554 40.8765 177.9369 11 L 3.8263 7.7890 120.1519 58.7049 41.7292 179.1666 12 V 3.3809 7.2155 116.6948 66.1427 31.6279 177.7593 13 E 3.5034 7.7790 117.8377 59.6292 28.8968 179.0794 14 A 4.0200 8.4359 121.5190 54.8338 18.2202 179.4005 15 L 3.4220 7.7265 116.6834 57.6934 41.6044 179.4133 16 Y 3.5271 7.8528 120.0336 60.6422 38.5430 178.2865 17 L 4.1735 7.5544 118.1376 57.5266 41.9397 179.2831 18 V 3.7370 8.7030 118.3884 65.9961 31.5481 176.3121 19 C 4.5103 9.0868 114.2629 60.5381 30.1553 176.3594 20 G 4.1855 8.1874 108.0233 44.6797 0.0000 175.2372 21 E 4.1548 8.5424 121.8114 58.0138 29.5860 178.0475 22 R 3.8805 7.8767 117.7661 57.8506 30.2026 176.8812 23 G 3.9518 8.0812 105.5125 45.8160 0.0000 171.8691 24 F 5.0272 7.6554 118.6536 55.0419 40.4833 176.4890 25 F 4.4710 8.6250 125.6521 56.9543 39.7774 173.1006 26 Y 4.4614 8.6298 125.8659 56.9976 38.9018 175.3368 27 T 4.2895 7.5121 116.0895 64.3178 70.8148 172.2852 28 K 4.0860 7.7993 128.0604 57.6819 36.7092 175.3468 29 P 4.3507 0.0000 0.0000 65.7085 31.8954 176.1672 30 T 4.0097 7.8309 113.3835 61.1721 68.4254 173.6073 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 F 8.31 4.32 0.00 3.01 3.24 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 2 V 7.64 4.23 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 0.72 0.00 0.00 0.92 0.00 0.00 3 N 9.50 4.13 0.00 2.78 2.93 0.00 0.00 6.97 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 4 Q 8.53 4.36 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 5 H 7.92 4.69 0.00 3.14 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.40 4.84 0.00 1.55 1.51 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.89 4.49 0.00 3.00 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 *9 S 8.01 4.27 0.00 3.84 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 10 D 8.06 4.38 0.00 2.76 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 11 L 7.79 3.83 0.00 1.45 1.14 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.22 3.38 2.03 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 1.46 0.00 0.00 0.53 0.00 0.00 13 E 7.78 3.50 0.00 2.25 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 2.17 2.36 0.00 14 A 8.44 4.02 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 15 L 7.73 3.42 0.00 0.52 1.27 1.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.85 3.53 0.00 2.95 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 17 L 7.55 4.17 0.00 1.83 1.79 0.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.70 3.74 1.99 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 0.71 0.00 0.00 0.90 0.00 0.00 19 C 9.09 4.51 0.00 3.21 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 20 G 8.19 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.54 4.15 0.00 1.95 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 0.00 2.25 2.26 0.00 22 R 7.88 3.88 0.00 1.94 2.04 0.00 3.22 0.00 0.00 3.46 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 23 G 8.08 3.95 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 0.00 0.00 0.00 24 F 7.66 5.03 0.00 3.17 3.08 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 0.00 0.00 0.00 25 F 8.63 4.47 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.63 4.46 0.00 3.20 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 27 T 7.51 4.29 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 28 K 7.80 4.09 0.00 1.40 1.44 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.15 1.27 7.81 29 P 0.00 4.35 0.00 2.21 2.15 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 30 T 7.83 4.01 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 * Residues marked with a * may have inaccurate shift predictions.