NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 I 4.0688 8.0249 121.4417 60.1138 38.6768 175.7521 13 P 4.0629 0.0000 0.0000 62.9761 32.4692 173.8073 14 E 4.0110 8.6976 122.5845 59.0966 30.0363 179.1324 15 W 4.3815 8.3066 116.3511 59.6117 28.0091 178.3738 16 K 3.2297 6.7200 118.7585 58.8712 31.4589 179.1653 17 Q 3.9287 7.3950 117.3472 58.8099 28.5655 178.4515 18 E 4.0246 8.5988 120.2289 59.0829 29.5024 178.9690 19 E 3.9315 8.1725 119.4830 59.3924 29.7030 179.0175 20 V 3.8675 7.6777 117.9231 65.6639 31.3534 177.6004 21 D 4.3285 7.5511 117.8788 57.1816 40.9921 178.1818 22 A 4.0825 8.3365 121.5114 55.5052 18.3158 179.8280 23 I 3.6509 8.3147 118.4084 64.6300 37.2295 178.9247 24 V 3.6572 7.5388 119.0083 65.6453 31.2543 178.0203 25 E 3.9083 8.5513 119.0234 59.8366 29.2103 179.2871 26 M 4.1697 7.8339 116.9043 58.1771 32.0133 178.6062 27 I 3.9307 7.6011 119.3811 63.8830 37.3016 177.7819 28 E 4.1658 7.9533 119.4297 58.5942 29.4715 178.3220 29 S 4.3508 7.8999 112.6326 59.0513 64.8045 174.8595 *63 R 4.1904 7.1265 119.4712 55.5180 31.4570 175.9792 64 N 4.3584 8.7819 118.6561 56.8548 38.5137 177.8284 65 T 4.1429 7.9545 110.5307 64.9005 68.6711 176.1658 66 L 4.0539 7.7389 121.1685 57.1053 41.7259 179.2387 67 L 3.9765 7.7388 118.7902 57.9712 41.8279 179.2670 68 E 4.0676 8.7102 118.6413 59.1424 29.0259 179.6352 69 R 3.7951 7.4851 117.7844 59.3538 30.5393 177.8576 70 A 4.4393 7.9254 121.8220 54.5948 18.1444 179.4078 71 L 3.9580 8.0472 116.6102 58.1282 41.8770 179.2070 72 D 4.5468 7.7132 114.6228 55.6231 40.7579 176.2976 73 D 4.5557 8.4238 126.4913 54.3693 41.3307 175.8117 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 4.07 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.04 0.88 0.00 0.00 13 P 0.00 4.06 0.00 1.79 2.05 0.00 3.43 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 2.06 2.24 0.00 14 E 8.70 4.01 0.00 2.08 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 2.40 2.37 0.00 15 W 8.31 4.38 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 6.72 3.23 0.00 1.40 1.36 0.00 1.26 0.00 0.00 1.42 0.00 0.00 2.76 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.30 0.21 7.81 17 Q 7.39 3.93 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 18 E 8.60 4.02 0.00 2.18 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 2.35 2.53 0.00 19 E 8.17 3.93 0.00 2.34 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 2.40 2.39 0.00 20 V 7.68 3.87 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.88 0.00 0.00 21 D 7.55 4.33 0.00 3.12 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 3.65 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.11 0.91 0.00 0.00 24 V 7.54 3.66 2.19 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 1.03 0.00 0.00 0.98 0.00 0.00 25 E 8.55 3.91 0.00 2.18 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 2.33 2.35 0.00 26 M 7.83 4.17 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.59 0.00 27 I 7.60 3.93 2.06 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 1.52 0.75 0.91 0.00 0.00 28 E 7.95 4.17 0.00 2.24 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 2.31 0.00 29 S 7.90 4.35 0.00 4.03 3.98 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 0.00 0.00 0.00 *63 R 7.13 4.19 0.00 1.98 1.98 0.00 3.26 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 64 N 8.78 4.36 0.00 2.77 2.87 0.00 0.00 6.73 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 7.95 4.14 4.22 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 0.00 0.00 0.00 1.21 0.00 0.00 66 L 7.74 4.05 0.00 1.88 1.73 0.89 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.74 3.98 0.00 1.85 1.71 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.71 4.07 0.00 1.94 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 2.33 2.52 0.00 69 R 7.49 3.80 0.00 1.99 2.10 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 1.59 1.65 0.00 70 A 7.93 4.44 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 3.96 0.00 1.77 1.75 0.92 0.96 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 72 D 7.71 4.55 0.00 2.87 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 73 D 8.42 4.56 0.00 2.77 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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.