NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3681 8.1133 119.0730 55.4312 32.0607 176.7990 2 M 4.2188 7.5660 116.8934 55.2246 32.9616 176.3082 3 K 3.9334 8.7966 119.0616 58.1314 33.1242 177.4395 4 Q 4.2587 7.8732 117.4154 58.2631 29.1973 177.1928 5 L 4.1327 7.4921 120.4732 57.3609 42.1098 177.7391 6 E 4.2566 9.1145 116.7817 57.3421 29.7679 177.4324 7 D 4.6466 7.7483 119.3068 56.1249 41.7901 178.0520 8 K 4.3378 7.6741 121.6921 58.7008 32.0013 178.8677 9 V 3.6345 8.3975 119.2432 65.7790 31.3952 177.9126 10 E 3.8198 7.9273 118.9274 59.3629 29.3505 178.5399 11 E 4.0740 8.2503 118.6029 59.5188 29.5419 179.3624 12 L 4.1125 7.9048 117.9995 57.0249 41.5514 179.4608 13 L 4.0799 7.4495 119.1983 57.6829 41.7807 178.8193 14 S 4.1858 7.6265 111.6065 61.6394 62.2450 176.5294 15 K 4.0548 8.1376 120.5396 59.4408 31.6254 179.3257 16 A 4.0943 7.7041 120.2302 54.8947 18.5796 178.7987 17 Y 5.1053 8.2567 119.8298 61.0928 38.6700 178.1675 18 H 3.9387 8.1631 116.6517 58.4495 28.4579 176.9238 19 L 4.4439 7.8367 118.6766 55.4588 41.5424 177.7709 20 E 4.5968 8.0339 118.6628 56.3220 31.3284 176.9059 21 N 4.5896 7.3851 112.8446 53.8631 38.7537 175.1545 22 E 4.4482 7.6232 118.8496 57.7574 32.4762 178.1130 23 V 3.6479 7.4166 118.0174 65.1299 31.6618 176.7926 24 A 4.4734 7.7603 120.4004 52.4665 18.8671 178.2322 25 R 4.1314 8.1247 116.7117 58.1282 30.2951 178.9538 26 L 3.5379 7.1710 114.4029 57.6289 42.7802 179.9340 27 K 4.3016 8.0717 121.1906 59.7889 32.6428 178.3221 28 K 4.1172 7.7681 116.6228 59.4207 32.4418 178.1362 29 L 4.1025 8.1626 118.4733 57.9606 41.8673 178.1095 30 V 3.7974 8.5680 116.1768 61.6551 31.3501 175.8815 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 R 8.11 4.37 0.00 1.75 1.94 0.00 3.20 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.23 0.00 2 M 7.57 4.22 0.00 2.09 2.12 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 2.61 2.60 0.00 3 K 8.80 3.93 0.00 1.75 1.82 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.52 7.81 4 Q 7.87 4.26 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.65 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 5 L 7.49 4.13 0.00 1.96 1.65 0.92 0.93 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 6 E 9.11 4.26 0.00 1.96 1.97 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 2.33 2.34 0.00 7 D 7.75 4.65 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.67 4.34 0.00 1.82 1.76 0.00 1.57 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.35 7.81 9 V 8.40 3.63 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 0.94 0.00 0.00 0.99 0.00 0.00 10 E 7.93 3.82 0.00 2.24 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 11 E 8.25 4.07 0.00 2.29 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 2.40 0.00 12 L 7.90 4.11 0.00 1.70 1.74 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.45 4.08 0.00 1.93 1.70 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.63 4.19 0.00 3.99 4.08 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 0.00 0.00 0.00 15 K 8.14 4.05 0.00 1.91 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.74 7.81 16 A 7.70 4.09 1.37 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 0.00 0.00 17 Y 8.26 5.11 0.00 3.00 3.24 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 0.00 18 H 8.16 3.94 0.00 3.13 3.28 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.84 4.44 0.00 1.92 1.69 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.03 4.60 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.49 0.00 21 N 7.39 4.59 0.00 2.42 2.64 0.00 0.00 6.75 7.54 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 22 E 7.62 4.45 0.00 2.08 1.88 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 2.25 2.20 0.00 23 V 7.42 3.65 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 0.92 0.00 0.00 0.92 0.00 0.00 24 A 7.76 4.47 1.29 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 0.00 0.00 25 R 8.12 4.13 0.00 1.92 1.90 0.00 3.14 0.00 0.00 3.25 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 26 L 7.17 3.54 0.00 1.92 1.60 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.07 4.30 0.00 1.75 2.04 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 28 K 7.77 4.12 0.00 1.88 1.82 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.45 7.81 29 L 8.16 4.10 0.00 1.62 1.74 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.57 3.80 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 0.64 0.00 0.00 0.93 0.00 0.00