NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.7102 7.4774 119.7088 63.2803 32.5993 174.9706 2 G 3.7033 9.0664 111.2605 43.6777 0.0000 169.3373 3 E 4.5298 8.7624 119.8772 54.9048 31.7705 175.3077 4 C 4.8381 8.8137 121.0224 56.6120 39.9511 174.2700 5 V 3.8244 8.6590 121.7851 63.8612 29.6545 176.2791 6 R 4.3835 7.9006 111.4249 55.4179 28.2553 178.8893 7 G 5.1528 6.3693 119.8202 46.8332 0.0000 173.2546 8 R 4.7387 7.0797 117.4420 54.8052 34.2325 174.0564 9 C 4.9957 8.2023 115.1733 54.8658 40.5846 171.5314 10 P 4.3684 0.0000 0.0000 62.7366 31.1316 177.1144 11 S 4.6760 8.3520 113.9667 56.7009 60.3296 174.1078 12 G 4.7997 7.6840 127.0700 47.6416 0.0000 170.3576 13 M 4.3552 7.1061 120.1083 54.9446 33.1082 174.2708 14 C 5.2116 9.0476 117.1638 55.4264 44.2974 172.3706 15 C 5.5741 8.7918 119.7545 55.0868 46.2704 173.0261 16 S 4.9591 8.4235 118.2922 55.2265 65.7917 173.0700 17 Q 4.0863 8.2722 116.7916 56.3710 28.7471 177.4465 *19 G 3.5439 8.0084 107.6869 45.4175 0.0000 171.5145 *21 C 4.8940 8.3998 119.8285 54.5273 39.9854 174.4252 22 G 3.1674 7.2349 106.6160 46.0208 0.0000 173.3162 23 K 4.7367 8.4709 120.8203 56.1776 32.9617 176.6067 24 G 4.2713 8.0202 105.0997 42.4629 0.0000 172.5019 25 P 3.9772 0.0000 0.0000 66.5682 31.8810 178.1312 26 K 4.1080 7.7213 116.9875 58.1797 32.8108 178.8588 27 Y 4.3482 8.0322 117.3213 60.0292 38.2201 175.6197 28 C 4.8401 7.6639 112.2681 55.6330 44.5946 174.4361 29 G 3.8804 8.7748 106.6066 45.2337 0.0000 174.1362 30 R 4.1461 7.6398 121.6741 56.9903 28.8534 173.9655 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 V 7.48 4.71 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 0.81 0.00 0.00 0.92 0.00 0.00 2 G 9.07 3.70 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 0.00 0.00 0.00 3 E 8.76 4.53 0.00 2.14 2.11 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 0.00 2.33 2.27 0.00 4 C 8.81 4.84 0.00 2.95 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 5 V 8.66 3.82 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 0.91 0.00 0.00 0.93 0.00 0.00 6 R 7.90 4.38 0.00 1.95 1.96 0.00 3.59 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 7 G 6.37 5.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.08 4.74 0.00 1.79 1.78 0.00 3.26 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 9 C 8.20 5.00 0.00 2.88 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.37 0.00 2.15 2.01 0.00 3.57 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 2.10 2.08 0.00 11 S 8.35 4.68 0.00 3.97 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 12 G 7.68 4.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.11 4.36 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 14 C 9.05 5.21 0.00 2.89 3.01 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 15 C 8.79 5.57 0.00 2.99 2.99 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 0.00 0.00 0.00 16 S 8.42 4.96 0.00 3.80 3.87 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 17 Q 8.27 4.09 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 *19 G 8.01 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *21 C 8.40 4.89 0.00 3.22 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.23 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.47 4.74 0.00 1.63 1.72 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.40 7.81 24 G 8.02 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.98 0.00 2.17 2.00 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 26 K 7.72 4.11 0.00 1.46 1.81 0.00 1.57 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.34 7.81 27 Y 8.03 4.35 0.00 3.12 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 C 7.66 4.84 0.00 2.93 3.29 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 29 G 8.77 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.64 4.15 0.00 2.01 2.05 0.00 3.33 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 1.45 1.33 0.00 * Residues marked with a * may have inaccurate shift predictions.