NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 I 4.0261 8.0249 121.4392 59.8702 38.6741 175.4595 13 P 4.0695 0.0000 0.0000 62.5526 32.1130 174.6259 14 E 4.0928 8.6426 121.1690 58.8461 30.3458 179.2365 15 W 4.2855 8.0417 116.4711 59.0554 28.4620 178.4660 16 K 3.4134 6.5339 118.2493 58.7483 31.1926 179.3814 17 Q 3.8700 7.6108 118.0406 59.0340 28.5859 178.3096 18 E 4.0050 8.1958 118.5448 59.0872 29.6883 178.8188 19 E 4.0861 8.2614 119.5658 59.2453 29.8191 178.6022 20 V 3.5490 7.6389 118.2513 66.5821 31.4782 177.8914 21 D 4.6442 7.9565 117.5367 56.8092 40.0153 178.5234 22 A 4.2168 8.3282 122.1109 54.6250 18.6643 179.7521 23 I 3.6876 7.5127 117.9010 64.6670 37.4104 178.5703 24 V 3.7490 8.2600 119.3685 66.0360 31.0314 177.6121 25 E 3.9927 7.8127 117.6646 59.0068 29.1905 178.6399 26 M 4.0995 7.3962 117.1796 58.2617 32.3367 178.3362 27 I 3.8357 7.9979 119.1538 64.1198 37.2530 177.8923 28 E 4.0739 8.0987 119.7353 59.3970 29.6467 178.7052 29 S 4.1693 7.5089 112.6974 59.9371 64.0413 174.7713 *63 R 4.1498 7.3519 120.0572 55.5562 31.4389 175.6122 64 N 4.3093 8.9848 120.3999 56.9095 38.5464 177.4269 65 T 4.0076 8.0211 110.3501 65.1838 68.4376 176.0834 66 L 3.9641 7.7369 121.0623 57.4212 41.7157 179.2484 67 L 3.9976 8.1348 119.0533 57.6289 41.5251 179.4599 68 E 3.9128 8.6141 119.0200 59.3372 29.2358 178.9303 69 R 3.8125 7.8538 117.2036 59.6103 30.3505 177.8546 70 A 4.1176 8.1478 120.1231 55.4186 18.2744 179.6892 71 L 4.2271 8.0703 116.0955 57.8050 41.7269 179.1470 72 D 4.5002 8.4020 117.8875 56.0794 40.8264 176.5792 73 D 4.6389 8.2493 124.5364 54.3372 41.1947 175.9402 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 12 I 8.02 4.03 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.03 0.85 0.00 0.00 13 P 0.00 4.07 0.00 1.56 2.07 0.00 3.36 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 2.10 2.19 0.00 14 E 8.64 4.09 0.00 2.07 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 0.00 2.40 2.37 0.00 15 W 8.04 4.29 0.00 3.64 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 16 K 6.53 3.41 0.00 1.41 1.38 0.00 1.21 0.00 0.00 1.23 0.00 0.00 2.70 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 0.21 7.81 17 Q 7.61 3.87 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 18 E 8.20 4.01 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 19 E 8.26 4.09 0.00 2.39 2.14 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 2.41 2.41 0.00 20 V 7.64 3.55 2.18 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 0.87 0.00 0.00 0.90 0.00 0.00 21 D 7.96 4.64 0.00 2.80 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 22 A 8.33 4.22 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.51 3.69 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.74 0.92 0.00 0.00 24 V 8.26 3.75 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 0.99 0.00 0.00 0.95 0.00 0.00 25 E 7.81 3.99 0.00 2.34 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 0.00 2.31 2.35 0.00 26 M 7.40 4.10 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 27 I 8.00 3.84 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 1.41 0.68 0.91 0.00 0.00 28 E 8.10 4.07 0.00 2.31 1.98 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 2.32 2.32 0.00 29 S 7.51 4.17 0.00 4.04 3.97 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 *63 R 7.35 4.15 0.00 1.98 1.98 0.00 3.27 0.00 0.00 3.43 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 64 N 8.98 4.31 0.00 2.77 2.89 0.00 0.00 6.87 7.05 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 65 T 8.02 4.01 4.23 0.00 0.00 0.00 0.00 0.00 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 66 L 7.74 3.96 0.00 1.87 1.75 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.13 4.00 0.00 1.82 1.72 0.93 0.81 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 68 E 8.61 3.91 0.00 2.15 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 0.00 2.33 2.55 0.00 69 R 7.85 3.81 0.00 1.96 2.16 0.00 3.29 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 70 A 8.15 4.12 1.37 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 0.00 0.00 71 L 8.07 4.23 0.00 1.77 1.75 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.40 4.50 0.00 2.79 2.72 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 0.00 0.00 0.00 0.00 73 D 8.25 4.64 0.00 2.70 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.