NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9257 8.3544 109.7380 45.3902 0.0000 172.7465 2 Y 4.2911 8.2830 120.4552 56.1456 39.5327 173.2835 3 I 3.8047 7.2628 127.8772 59.3262 38.2114 173.7041 4 P 4.4799 0.0000 0.0000 61.6403 32.1479 175.8996 5 R 3.8009 8.5074 118.6826 56.4811 30.2290 175.6251 6 A 4.0849 8.2393 128.5639 49.9126 19.2305 175.9339 7 P 4.5552 0.0000 0.0000 62.2334 30.1755 177.5041 8 R 4.7040 7.3745 110.5531 56.6566 30.6617 178.1329 9 D 4.4425 7.4477 121.1699 50.9791 38.0028 176.3717 10 G 3.7145 7.2652 105.9042 46.0575 0.0000 172.4760 11 Q 4.0224 7.5904 118.7209 53.6488 30.8858 173.9637 12 A 4.4918 8.3038 125.9101 52.3109 18.3603 174.6435 13 Y 5.9563 8.3819 118.5450 57.2931 39.1350 176.1951 14 V 4.2380 8.7102 124.3757 61.2893 33.6622 175.6167 15 R 3.7793 8.6384 121.6281 55.6428 30.7897 176.0894 16 K 4.5036 7.8198 121.5376 53.7569 36.0400 175.1094 17 D 4.1163 8.5038 118.9529 54.4280 38.0862 175.5694 18 G 3.8169 8.4457 111.6413 45.9775 0.0000 171.2244 19 E 4.5282 7.3706 117.6040 53.7082 32.3801 174.7551 20 W 5.2055 8.4208 121.8027 55.0857 31.5208 175.6930 21 V 4.1099 8.1691 115.9991 59.0799 35.5556 174.6147 22 L 4.9360 8.5661 127.6319 55.2043 42.2493 176.7865 23 L 4.2839 9.0734 126.9234 56.7277 41.7058 178.7527 24 S 4.0845 8.0611 114.9091 62.1012 62.2920 176.2787 25 T 3.7224 7.7159 114.7241 64.8559 66.8466 175.4448 26 F 4.5950 7.8344 119.1136 60.2285 39.1389 175.2860 27 L 4.3654 7.6185 121.4759 54.8212 41.6737 176.3269 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 G 8.35 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 Y 8.28 4.29 0.00 2.94 2.90 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 3 I 7.26 3.80 1.64 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.83 0.90 0.00 0.00 4 P 0.00 4.48 0.00 2.31 2.15 0.00 3.62 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.99 0.00 5 R 8.51 3.80 0.00 1.83 1.93 0.00 3.25 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 6 A 8.24 4.08 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 P 0.00 4.56 0.00 2.03 2.14 0.00 3.90 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.96 0.00 8 R 7.37 4.70 0.00 1.68 1.63 0.00 2.33 0.00 0.00 3.75 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.36 0.00 9 D 7.45 4.44 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.27 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 7.59 4.02 0.00 1.51 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.10 0.00 0.00 0.00 0.00 0.00 2.25 2.16 0.00 12 A 8.30 4.49 1.27 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 13 Y 8.38 5.96 0.00 2.49 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 14 V 8.71 4.24 2.25 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 1.02 0.00 0.00 1.02 0.00 0.00 15 R 8.64 3.78 0.00 1.84 1.79 0.00 3.32 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.87 0.00 16 K 7.82 4.50 0.00 1.77 1.55 0.00 1.53 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.32 7.81 17 D 8.50 4.12 0.00 2.70 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 18 G 8.45 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.37 4.53 0.00 1.84 1.69 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 2.25 2.30 0.00 20 W 8.42 5.21 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.17 4.11 2.17 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 0.67 0.00 0.00 1.00 0.00 0.00 22 L 8.57 4.94 0.00 1.86 1.53 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.07 4.28 0.00 2.28 2.08 1.05 1.11 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 24 S 8.06 4.08 0.00 4.04 4.18 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 0.00 0.00 0.00 25 T 7.72 3.72 4.04 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 0.00 0.00 0.53 0.00 0.00 26 F 7.83 4.59 0.00 3.15 2.98 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 27 L 7.62 4.37 0.00 1.66 1.61 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00