NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B F 4.7836 8.2829 119.4489 56.2202 40.9793 177.3606 *2B V 3.1073 7.7211 116.3071 63.5825 32.5640 179.4006 3B N 3.8816 8.1187 115.6810 56.8945 40.8947 176.6770 4B Q 4.0979 8.0699 119.3565 58.9288 29.2813 178.2564 5B H 4.1933 7.9984 118.2585 59.2196 29.5912 177.3399 6B L 4.0652 7.9560 120.6618 58.0483 41.5692 178.4313 7B C 4.4587 8.3739 118.5310 59.9565 43.3827 175.9908 8B G 3.6361 8.1419 108.3841 47.1287 0.0000 175.2580 9B S 3.9476 7.5498 114.5328 61.9238 62.1353 176.3413 10B H 3.9080 7.6958 118.7253 58.6796 28.3885 177.8728 11B L 4.0422 7.8747 121.1896 57.5437 41.4763 179.8345 12B V 3.4008 7.9101 119.5597 64.6949 30.7166 178.4101 13B E 3.9477 7.6803 118.7107 59.0587 29.2469 179.1868 14B A 4.0125 7.7290 120.7489 55.2487 18.4774 179.7763 15B L 3.7012 8.4426 117.7305 57.4285 41.3327 178.8899 16B Y 4.1972 7.8851 119.8702 60.9765 38.4876 178.4640 17B L 3.8299 7.4268 117.3828 57.6314 41.8277 179.4461 18B V 3.6606 7.6992 117.2880 66.3545 31.8856 177.1691 19B C 4.4384 8.3045 116.3357 56.2389 40.1344 177.3251 20B G 3.6045 8.0501 107.2156 46.8858 0.0000 175.3196 21B E 4.2157 9.2106 124.0025 57.2599 29.8292 177.0415 22B R 4.1729 8.0567 117.3012 55.4979 30.8810 177.9427 23B G 3.9940 8.3070 107.0625 45.3801 0.0000 171.4389 24B F 4.9962 7.5629 112.3296 56.2511 40.3536 172.7959 25B F 4.6705 9.0938 118.6670 55.7980 41.2584 173.9737 26B Y 4.7316 8.7626 126.2285 56.0091 40.4871 174.3545 27B T 4.4790 7.6272 122.9232 60.9977 70.8490 172.4201 28B P 4.0552 0.0000 0.0000 63.6050 31.5440 176.5194 29B K 4.1322 8.6295 124.9971 56.9222 32.1561 176.0336 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 1B F 8.28 4.78 0.00 3.05 2.81 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 0.00 0.00 0.00 *2B V 7.72 3.11 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 0.71 0.00 0.00 0.93 0.00 0.00 3B N 8.12 3.88 0.00 2.81 2.77 0.00 0.00 6.96 7.09 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 4B Q 8.07 4.10 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5B H 8.00 4.19 0.00 3.28 3.50 0.00 5.59 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 6B L 7.96 4.07 0.00 1.94 1.75 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 7B C 8.37 4.46 0.00 3.04 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 8B G 8.14 3.64 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 0.00 0.00 0.00 9B S 7.55 3.95 0.00 3.89 4.11 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 0.00 0.00 0.00 10B H 7.70 3.91 0.00 3.45 3.35 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11B L 7.87 4.04 0.00 1.87 1.76 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12B V 7.91 3.40 1.77 0.00 0.00 0.00 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 0.51 0.00 0.00 13B E 7.68 3.95 0.00 2.01 2.02 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 2.28 2.26 0.00 14B A 7.73 4.01 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 15B L 8.44 3.70 0.00 0.84 0.77 0.76 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16B Y 7.89 4.20 0.00 3.28 3.19 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 17B L 7.43 3.83 0.00 1.81 1.71 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 18B V 7.70 3.66 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 0.80 0.00 0.00 0.90 0.00 0.00 19B C 8.30 4.44 0.00 3.27 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20B G 8.05 3.60 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 0.00 0.00 0.00 21B E 9.21 4.22 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 22B R 8.06 4.17 0.00 1.87 2.02 0.00 3.31 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 23B G 8.31 3.99 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 0.00 0.00 0.00 24B F 7.56 5.00 0.00 3.24 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 25B F 9.09 4.67 0.00 2.99 3.03 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 26B Y 8.76 4.73 0.00 3.44 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 27B T 7.63 4.48 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 1.17 0.00 0.00 28B P 0.00 4.06 0.00 2.17 2.25 0.00 3.61 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 1.97 2.08 0.00 29B K 8.63 4.13 0.00 1.61 1.70 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.31 7.81 * Residues marked with a * may have inaccurate shift predictions.