NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9823 8.3249 119.3813 57.9914 40.5099 174.2721 2 V 4.3377 8.1271 111.5944 61.1123 32.2170 176.4948 3 N 4.3821 9.2874 122.0485 56.7672 39.1746 176.7898 4 Q 4.0268 8.1103 118.8531 59.1033 28.7412 178.0451 5 H 4.1500 8.2591 118.8190 59.3368 29.8600 177.2173 6 L 3.9972 8.1386 120.7892 57.7231 41.3621 178.8551 7 C 4.1880 8.4507 119.0949 62.6868 31.5508 175.9958 8 G 3.6715 8.3465 107.2154 47.7449 0.0000 175.5770 9 S 3.9701 7.6596 115.4526 61.6410 62.3803 176.0170 10 H 4.1119 7.9920 119.0509 58.6480 28.3009 177.7463 11 L 3.9551 8.1096 121.0902 58.0227 41.4188 180.0566 12 V 3.3006 7.6271 112.2105 64.0172 31.3633 177.9128 13 E 3.8919 7.8310 118.9726 59.6190 29.3733 178.9145 14 A 4.0060 8.1812 120.4848 54.9793 18.3798 179.6301 15 L 3.6507 7.9948 117.9121 57.8719 41.3836 178.7086 16 Y 4.3757 7.8476 119.7179 60.8726 38.4214 178.2231 17 L 3.9009 7.8329 119.5825 58.2774 42.3989 179.0813 18 V 3.7601 7.7991 117.8937 64.7300 31.5925 177.6539 19 C 4.3029 8.7425 117.5974 60.4483 28.6192 174.8964 20 G 3.7963 8.0316 108.5766 46.6236 0.0000 176.6361 21 E 4.1068 8.7891 121.6912 58.6098 29.6920 178.2490 22 R 3.9017 7.6930 117.8484 57.0274 30.3703 178.2676 23 G 3.9739 7.9090 106.1571 45.7478 0.0000 171.9093 24 F 4.9020 7.6596 111.4447 56.2839 40.1926 172.8523 25 F 4.4893 9.0680 120.0084 55.8068 40.4715 174.7586 26 Y 4.7034 8.7838 127.2274 56.2107 39.0635 175.2088 27 T 4.3829 7.8224 117.8979 58.0027 69.2090 171.2804 28 P 4.0290 0.0000 0.0000 63.9458 31.7753 177.0463 29 K 4.0390 8.7734 118.0213 56.2621 32.1181 175.2562 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 8.32 4.98 0.00 3.10 3.02 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 2 V 8.13 4.34 2.16 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 0.89 0.00 0.00 1.00 0.00 0.00 3 N 9.29 4.38 0.00 2.81 2.91 0.00 0.00 7.04 8.16 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 4 Q 8.11 4.03 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 5 H 8.26 4.15 0.00 3.30 3.54 0.00 5.87 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 8.14 4.00 0.00 1.77 1.74 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.45 4.19 0.00 3.07 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 8 G 8.35 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 3.97 0.00 3.74 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 10 H 7.99 4.11 0.00 3.27 3.32 0.00 5.68 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 11 L 8.11 3.96 0.00 1.84 1.75 1.04 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.63 3.30 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 0.16 0.00 0.00 0.87 0.00 0.00 13 E 7.83 3.89 0.00 2.11 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 2.28 2.39 0.00 14 A 8.18 4.01 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 15 L 7.99 3.65 0.00 0.65 0.52 0.77 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.85 4.38 0.00 3.29 3.27 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 17 L 7.83 3.90 0.00 1.71 1.88 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.80 3.76 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.91 0.00 0.00 19 C 8.74 4.30 0.00 3.20 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 20 G 8.03 3.80 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 21 E 8.79 4.11 0.00 1.96 2.02 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 2.31 2.31 0.00 22 R 7.69 3.90 0.00 2.00 2.05 0.00 3.34 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 7.91 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.66 4.90 0.00 3.23 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 25 F 9.07 4.49 0.00 3.09 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 8.78 4.70 0.00 3.26 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 27 T 7.82 4.38 4.24 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 1.42 0.00 0.00 28 P 0.00 4.03 0.00 2.18 2.09 0.00 3.56 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 29 K 8.77 4.04 0.00 2.09 1.97 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.24 0.76 7.81