NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7469 8.1827 119.3641 57.4252 40.6172 175.5800 2 V 3.6037 8.4439 124.1309 64.0492 31.4430 176.7031 3 N 4.2265 8.4412 116.7678 56.1385 37.4543 176.4485 4 Q 3.9981 8.1692 121.4368 58.9309 29.0453 177.2078 5 H 4.2057 8.4595 119.3938 59.3043 29.6570 177.2840 6 L 4.0050 8.8521 121.8489 57.8783 41.4388 178.9263 7 C 4.2573 8.4715 119.0490 62.6386 31.5513 175.9929 8 G 3.6560 8.5117 107.3618 47.6423 0.0000 175.6209 9 S 3.9976 7.7521 115.3854 61.5890 62.3130 175.9144 10 H 4.3305 7.9706 117.6428 58.4632 28.3901 177.6791 11 L 3.9257 8.0767 121.1205 57.8960 41.4938 179.7784 12 V 3.2578 7.6292 118.0570 65.6109 31.3989 177.7758 13 E 3.9082 7.8287 118.3546 59.1283 29.5347 178.6397 14 A 3.9793 8.1355 120.9839 55.1877 18.4439 179.6190 15 L 3.8242 8.0824 117.9334 57.7343 41.6112 178.9873 16 Y 4.2041 7.7767 119.4930 60.8095 38.5127 178.4008 17 L 3.9545 7.6501 118.2098 57.7259 41.8322 179.4041 18 V 3.6925 7.9534 117.2040 66.1193 31.8758 177.3133 19 C 4.3730 8.7613 115.0481 58.8292 28.1829 175.6124 20 G 3.6870 7.9624 109.2103 46.6360 0.0000 177.3364 21 E 4.0500 8.8238 123.4484 58.5204 29.4840 178.0411 22 R 3.8822 7.9148 117.6383 56.9984 30.3805 178.1736 23 G 3.9794 7.4499 105.7965 46.3052 0.0000 172.2265 24 F 4.8053 7.6889 109.8848 56.2912 39.8984 173.0240 25 F 4.5727 8.9784 120.8544 56.1333 40.4896 174.9731 26 Y 4.8443 8.8017 124.8756 56.1524 40.2930 175.5060 27 T 4.3723 7.7414 117.2956 58.7337 69.5757 172.0644 28 P 4.1173 0.0000 0.0000 63.3439 31.3224 176.4338 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 F 8.18 4.75 0.00 3.18 3.21 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 0.00 2 V 8.44 3.60 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 1.12 0.00 0.00 0.96 0.00 0.00 3 N 8.44 4.23 0.00 2.98 3.10 0.00 0.00 5.91 7.90 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 4 Q 8.17 4.00 0.00 2.31 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.94 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 5 H 8.46 4.21 0.00 3.50 3.54 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.85 4.00 0.00 1.69 1.75 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.47 4.26 0.00 3.03 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 8 G 8.51 3.66 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 0.00 0.00 0.00 9 S 7.75 4.00 0.00 3.77 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 10 H 7.97 4.33 0.00 3.35 3.30 0.00 5.68 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 11 L 8.08 3.93 0.00 1.73 1.70 1.06 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.63 3.26 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.20 0.00 0.00 13 E 7.83 3.91 0.00 2.04 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 2.30 2.32 0.00 14 A 8.14 3.98 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 15 L 8.08 3.82 0.00 0.84 0.84 0.73 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.78 4.20 0.00 3.27 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 17 L 7.65 3.95 0.00 1.81 1.70 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.95 3.69 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 0.81 0.00 0.00 0.95 0.00 0.00 19 C 8.76 4.37 0.00 3.12 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.96 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.82 4.05 0.00 1.96 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 2.27 2.31 0.00 22 R 7.91 3.88 0.00 1.97 2.03 0.00 3.34 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 23 G 7.45 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 0.00 0.00 0.00 24 F 7.69 4.81 0.00 3.17 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 25 F 8.98 4.57 0.00 3.16 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 8.80 4.84 0.00 3.32 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.74 4.37 4.17 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 1.26 0.00 0.00 28 P 0.00 4.12 0.00 2.02 2.04 0.00 3.62 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00