NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 I 4.0988 8.0249 121.4465 60.4820 37.5331 174.5211 13 P 4.2972 0.0000 0.0000 61.6232 32.5686 174.6829 14 E 3.8420 8.7515 121.8535 59.1594 30.4745 179.4210 15 W 4.3099 8.2929 116.4119 59.3549 28.1522 178.4158 16 K 3.4525 6.7331 119.0260 58.7656 31.4220 179.2286 17 Q 3.9731 7.6254 118.0655 58.6707 28.9670 178.0232 18 E 4.0703 8.3283 119.5437 58.9215 29.4361 178.8615 19 E 4.0852 8.1181 119.5788 58.9454 29.7859 178.7555 20 V 3.5805 7.5254 118.4312 66.0865 31.3116 177.7368 21 D 4.4272 8.1288 117.5733 56.6229 40.7593 178.2181 22 A 4.0118 7.4931 120.6488 54.4572 18.8456 179.5625 23 I 3.8588 7.7705 118.6192 64.3387 37.1302 178.6953 24 V 3.6660 7.9332 119.0541 65.6187 30.7928 177.6768 25 E 3.9996 7.8502 118.9923 58.9561 29.2265 178.1348 26 M 4.3384 7.3549 116.5424 57.2588 32.4100 178.1709 27 I 3.9647 7.5531 119.4157 63.9893 37.3796 177.7927 28 E 4.1448 7.9728 119.1977 58.4155 29.3480 177.8148 29 S 4.4015 7.3364 112.5295 59.4772 64.6013 174.8020 *63 R 4.1862 7.5035 118.2483 55.4645 31.2157 176.2145 64 N 4.3893 8.5674 117.9391 56.4692 38.3736 177.9118 65 T 3.9812 7.8192 111.0931 64.5647 68.7230 176.5160 66 L 4.0852 7.7472 121.3857 56.7058 41.6376 179.3012 67 L 4.0493 7.7597 119.0529 57.6645 41.6116 178.7407 68 E 3.9685 7.9730 118.0559 59.4516 29.1271 179.5267 69 R 3.8651 7.6132 117.5624 59.3253 30.1470 178.2075 70 A 4.1344 7.7693 119.8155 54.5959 18.0998 179.6342 71 L 3.8496 7.5836 117.3999 57.9541 41.8722 178.9750 72 D 4.4693 7.7192 117.4301 56.5969 40.7403 176.2592 73 D 4.5076 7.4394 123.2583 54.3451 41.0012 176.1046 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 4.10 1.85 0.00 0.00 0.84 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 0.86 0.00 0.00 13 P 0.00 4.30 0.00 1.88 2.09 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 2.19 0.00 14 E 8.75 3.84 0.00 2.10 2.05 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 0.00 2.41 2.39 0.00 15 W 8.29 4.31 0.00 3.64 3.32 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 16 K 6.73 3.45 0.00 1.45 1.46 0.00 1.25 0.00 0.00 1.27 0.00 0.00 2.57 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 0.21 7.81 17 Q 7.63 3.97 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 18 E 8.33 4.07 0.00 2.24 2.05 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 0.00 2.35 2.48 0.00 19 E 8.12 4.09 0.00 2.33 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 20 V 7.53 3.58 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 0.90 0.00 0.00 21 D 8.13 4.43 0.00 2.75 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 22 A 7.49 4.01 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.77 3.86 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 1.42 1.08 0.91 0.00 0.00 24 V 7.93 3.67 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 1.03 0.00 0.00 0.95 0.00 0.00 25 E 7.85 4.00 0.00 2.35 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 7.35 4.34 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 27 I 7.55 3.96 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 1.52 0.64 0.91 0.00 0.00 28 E 7.97 4.14 0.00 1.89 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 2.34 2.42 0.00 29 S 7.34 4.40 0.00 4.13 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 7.50 4.19 0.00 1.94 1.95 0.00 3.18 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 64 N 8.57 4.39 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 7.82 3.98 4.21 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 0.00 0.00 1.20 0.00 0.00 66 L 7.75 4.09 0.00 1.79 1.71 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.76 4.05 0.00 1.82 1.70 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 68 E 7.97 3.97 0.00 2.19 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 2.32 2.47 0.00 69 R 7.61 3.87 0.00 1.87 1.92 0.00 3.27 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 70 A 7.77 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 3.85 0.00 1.82 1.73 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 72 D 7.72 4.47 0.00 2.77 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 7.44 4.51 0.00 2.67 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.