NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2676 8.2993 121.7884 55.9420 33.1579 175.4214 2 V 3.6986 8.2549 126.4771 60.8951 32.2117 173.9022 3 S 4.6074 7.9757 115.7968 56.5806 66.2971 175.3460 4 V 3.8322 8.1220 126.1444 61.1544 32.0581 175.8052 5 V 3.6946 8.1714 121.5457 62.7538 31.8086 175.7245 6 R 4.4465 8.1990 128.3382 54.1993 32.4690 173.0329 *8 P 4.6096 0.0000 0.0000 62.3440 34.0911 174.8430 9 P 4.9403 0.0000 0.0000 61.1432 29.6221 178.7564 10 K 4.5684 8.4761 116.7714 54.9328 35.6165 174.9791 11 S 4.2073 8.4328 113.4252 57.8396 63.0049 172.5346 12 P 4.5108 0.0000 0.0000 63.1625 30.8766 176.1299 13 S 4.2715 7.9310 117.4749 59.3654 62.4311 172.9612 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 K 8.30 4.27 0.00 1.73 1.80 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.38 7.81 2 V 8.25 3.70 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 0.61 0.00 0.00 0.93 0.00 0.00 3 S 7.98 4.61 0.00 3.79 3.71 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 4 V 8.12 3.83 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 0.83 0.00 0.00 0.93 0.00 0.00 5 V 8.17 3.69 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 0.73 0.00 0.00 0.93 0.00 0.00 6 R 8.20 4.45 0.00 1.78 1.84 0.00 3.37 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 *8 P 0.00 4.61 0.00 2.24 2.20 0.00 3.81 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 9 P 0.00 4.94 0.00 2.20 1.24 0.00 3.74 0.00 0.00 3.71 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 10 K 8.48 4.57 0.00 1.82 1.80 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.42 7.81 11 S 8.43 4.21 0.00 3.87 3.77 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 0.00 0.00 0.00 0.00 12 P 0.00 4.51 0.00 2.22 2.10 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 13 S 7.93 4.27 0.00 3.83 3.72 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 * Residues marked with a * may have inaccurate shift predictions.