NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1669 8.3144 121.7885 56.1546 33.2568 178.1888 2 E 4.2603 8.9251 117.9562 52.7630 30.2214 174.1777 3 T 4.2266 8.6184 118.8800 61.1399 71.9588 174.7787 4 A 3.9565 8.4359 123.0628 55.2137 18.4410 179.5270 5 A 4.0681 7.9009 117.9305 55.2775 18.8429 179.2755 6 A 4.4166 7.9931 120.7227 54.2846 18.4084 180.2653 7 K 4.3299 8.1388 116.9596 56.8713 31.8342 178.6580 *9 E 4.2587 8.1489 118.1661 55.9570 31.4309 178.2472 10 R 3.8346 8.0621 117.3191 59.4241 30.1945 177.6543 11 Q 4.1038 8.0805 115.5069 57.8894 29.4673 175.9489 12 H 4.8774 7.2917 113.4406 54.8512 29.0901 175.2184 *14 D 4.4059 7.6106 117.8375 54.2212 41.6344 174.8932 15 S 4.3171 8.0980 116.8080 57.9870 63.1887 175.0655 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 8.31 4.17 0.00 1.73 0.86 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.43 7.81 2 E 8.93 4.26 0.00 2.04 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 3 T 8.62 4.23 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 4 A 8.44 3.96 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 5 A 7.90 4.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.99 4.42 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.14 4.33 0.00 1.92 1.95 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.48 7.81 *9 E 8.15 4.26 0.00 2.24 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 2.31 2.60 0.00 10 R 8.06 3.83 0.00 1.77 2.09 0.00 3.24 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 11 Q 8.08 4.10 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.13 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 12 H 7.29 4.88 0.00 2.94 3.21 0.00 5.69 0.00 0.00 0.00 0.00 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *14 D 7.61 4.41 0.00 2.64 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.10 4.32 0.00 4.02 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.