NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 R 4.3371 8.1127 119.0727 56.6035 32.1516 177.1320 2 M 3.8382 8.0723 118.0861 57.6505 32.1010 176.4636 3 K 4.1461 8.3323 120.6832 60.1666 32.7987 178.8030 *4 Q 4.0062 8.0036 120.7543 59.7755 28.0612 181.0685 5 L 4.1037 7.9137 122.0823 58.2313 42.2702 178.6402 6 E 3.9400 8.2847 118.6609 59.7435 29.3242 179.3417 7 D 4.3386 8.3791 118.7617 57.4428 40.8580 179.0220 8 K 3.9321 8.0933 118.9426 59.2269 31.8881 179.6078 9 V 3.5349 7.9811 118.6903 66.0949 31.5253 177.8591 10 E 3.8869 8.1521 118.2509 59.3049 29.3071 178.7231 11 E 3.8497 8.3555 119.5165 59.4315 29.6719 178.6170 12 L 3.8866 8.0967 120.2617 58.3047 42.1218 179.0439 13 L 3.6808 7.9919 118.9400 57.5178 41.4109 179.7684 14 S 3.7868 7.8327 115.0848 61.3283 62.7861 176.4062 15 K 3.8218 7.9062 120.9315 59.8659 31.8033 179.1101 16 A 3.9992 8.3933 120.7432 55.3294 18.2264 179.3786 17 Y 4.2795 7.7177 115.3611 61.6818 37.9068 178.1160 18 H 4.2416 8.3884 117.2122 58.9843 28.7978 177.8676 19 L 4.0347 8.2234 120.8143 57.7037 41.5562 179.0787 20 E 4.0258 8.5824 119.6228 59.4239 29.5691 178.6623 21 N 4.4592 8.3160 116.4594 56.0411 38.6987 177.3881 22 E 3.9851 8.6232 120.5627 59.2250 29.4742 179.3508 23 V 3.5256 8.3548 118.3851 66.0636 31.4856 177.6212 24 A 3.9737 7.7901 119.8742 55.3550 18.1714 179.5517 25 R 3.8546 7.9481 116.8142 59.5605 30.1927 178.6554 26 L 3.9783 8.3535 119.0817 57.7324 41.6018 179.3476 27 K 3.9170 8.3352 121.0499 60.3043 31.8269 179.6588 28 K 3.8979 7.4887 122.0401 60.1199 31.7080 180.2996 29 L 4.2894 7.8357 119.1714 57.8765 41.6274 179.8018 30 V 3.7358 7.7739 117.4366 63.9763 31.5395 176.0503 31 G 4.0077 7.8458 111.1331 45.5710 0.0000 172.8331 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 R 8.11 4.34 0.00 1.75 2.00 0.00 3.23 0.00 0.00 3.33 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.20 0.00 2 M 8.07 3.84 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.71 0.00 3 K 8.33 4.15 0.00 1.86 1.79 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 *4 Q 8.00 4.01 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.70 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 5 L 7.91 4.10 0.00 1.77 1.89 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.28 3.94 0.00 2.20 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 2.34 2.59 0.00 7 D 8.38 4.34 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.09 3.93 0.00 2.01 1.84 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 9 V 7.98 3.53 2.23 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 1.09 0.00 0.00 0.99 0.00 0.00 10 E 8.15 3.89 0.00 2.18 1.97 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 2.45 2.47 0.00 11 E 8.36 3.85 0.00 1.99 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 2.28 2.31 0.00 12 L 8.10 3.89 0.00 1.77 1.86 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.99 3.68 0.00 1.51 1.20 0.93 1.06 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 14 S 7.83 3.79 0.00 4.03 3.90 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 0.00 0.00 0.00 0.00 15 K 7.91 3.82 0.00 1.89 1.85 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.58 7.81 16 A 8.39 4.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.72 4.28 0.00 2.87 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 H 8.39 4.24 0.00 3.43 3.37 0.00 5.62 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 19 L 8.22 4.03 0.00 1.89 1.74 0.92 0.67 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 20 E 8.58 4.03 0.00 2.22 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 0.00 2.32 2.38 0.00 21 N 8.32 4.46 0.00 2.97 2.87 0.00 0.00 7.03 7.11 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 22 E 8.62 3.99 0.00 2.12 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 2.51 2.48 0.00 23 V 8.35 3.53 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 1.09 0.00 0.00 0.98 0.00 0.00 24 A 7.79 3.97 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 25 R 7.95 3.85 0.00 2.04 2.03 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 26 L 8.35 3.98 0.00 1.85 1.71 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.34 3.92 0.00 1.95 1.88 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.66 7.81 28 K 7.49 3.90 0.00 1.81 1.74 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.37 7.81 29 L 7.84 4.29 0.00 1.80 1.79 0.92 0.83 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 30 V 7.77 3.74 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.01 0.00 0.00 31 G 7.85 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.