NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2995 8.1733 119.9978 56.5339 34.3149 176.0679 9 T 3.6915 8.5109 114.9213 66.7413 68.1115 172.9268 10 E 3.9745 8.4072 120.1308 59.4043 29.9305 178.6672 11 E 3.8646 8.1740 118.5833 59.3859 29.8137 178.3392 12 I 3.6425 7.9812 120.3306 64.6276 37.1652 177.7020 13 L 3.8566 8.1252 120.7889 58.2606 41.9552 179.0107 14 S 4.3120 8.0446 112.8451 61.5942 62.3827 175.9888 15 K 3.9029 8.2013 121.1578 59.8512 31.7110 179.1938 16 L 3.9750 7.6591 118.6725 57.8086 41.4853 178.7868 17 Y 4.2415 7.8830 117.1194 61.6176 37.7758 178.5085 18 H 4.2182 8.3449 118.4525 59.0317 29.8940 177.1328 19 I 3.8476 8.2456 122.2408 64.8259 36.9845 178.2862 20 E 4.0966 8.6057 119.2333 59.3063 29.0451 179.2509 21 N 4.4089 8.5526 117.3073 55.9530 38.6058 177.3428 22 E 3.9051 8.4350 120.4115 59.4578 29.6242 179.2098 23 L 3.9642 8.2866 119.1396 57.7288 41.6839 179.2310 24 A 3.9451 8.3026 120.9171 55.5336 18.3450 179.6001 25 R 3.8801 7.7010 116.1099 59.6658 30.0767 179.2553 26 I 3.6978 7.7465 119.1125 64.5528 37.0361 178.7632 27 K 4.0372 8.0561 119.2112 58.9317 31.5859 179.3312 28 K 3.9927 7.6537 118.8761 59.7666 32.2786 178.5460 29 L 4.0922 7.7527 117.4893 57.0716 41.8907 177.8958 30 L 4.6835 7.5924 118.7190 52.7110 44.7013 177.5243 31 G 3.6380 8.1462 105.2294 46.8533 0.0000 173.3108 32 E 4.6385 8.3505 126.1779 57.3927 31.2559 174.2090 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 8 K 8.17 4.30 0.00 1.95 2.05 0.00 1.52 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.48 7.81 9 T 8.51 3.69 4.25 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 1.22 0.00 0.00 10 E 8.41 3.97 0.00 1.99 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 2.42 2.33 0.00 11 E 8.17 3.86 0.00 2.04 2.06 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 2.38 2.41 0.00 12 I 7.98 3.64 2.00 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 1.40 1.34 0.89 0.00 0.00 13 L 8.13 3.86 0.00 1.98 1.92 0.81 0.90 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 14 S 8.04 4.31 0.00 4.14 4.02 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 0.00 0.00 0.00 15 K 8.20 3.90 0.00 1.90 1.88 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.65 7.81 16 L 7.66 3.97 0.00 1.59 1.51 0.83 1.25 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 17 Y 7.88 4.24 0.00 3.22 3.07 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 0.00 0.00 0.00 18 H 8.34 4.22 0.00 3.26 3.49 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.25 3.85 1.98 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 1.55 0.59 0.91 0.00 0.00 20 E 8.61 4.10 0.00 2.22 2.04 0.00 0.00 0.00 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 2.40 0.00 21 N 8.55 4.41 0.00 2.78 2.84 0.00 0.00 6.88 7.22 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 22 E 8.44 3.91 0.00 2.11 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 2.26 2.32 0.00 23 L 8.29 3.96 0.00 1.88 1.72 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.30 3.95 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 25 R 7.70 3.88 0.00 1.93 2.01 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 26 I 7.75 3.70 1.98 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 1.56 0.91 0.00 0.00 27 K 8.06 4.04 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.74 7.81 28 K 7.65 3.99 0.00 1.75 2.00 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 29 L 7.75 4.09 0.00 1.83 1.74 0.94 0.85 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 30 L 7.59 4.68 0.00 1.87 1.61 0.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.15 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.35 4.64 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00