NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1346 7.9133 120.6520 62.9516 33.1145 174.8853 2 C 5.3139 8.7492 124.0841 53.4138 42.2815 171.8422 3 S 4.8313 9.5468 116.9863 56.8911 66.9940 172.1647 4 C 5.1816 8.9802 120.1757 56.8824 39.9769 172.9897 5 R 4.9290 9.3213 124.0334 54.3016 31.8385 177.9562 6 L 3.6794 8.8700 123.0267 56.6192 43.3233 177.9222 7 V 3.8175 7.9568 112.5219 62.5483 31.9509 176.2155 8 F 5.1600 8.4863 111.6836 55.7197 41.7089 176.5072 9 C 4.5765 8.6301 120.3567 56.7919 42.0381 174.2192 10 R 4.3035 8.8702 121.6015 56.0623 30.2624 178.4533 11 R 3.9263 8.5409 118.9848 59.2549 30.1415 177.9243 12 T 4.3718 7.8226 105.4962 61.3313 69.1633 173.8601 13 E 4.8628 7.9148 121.1357 54.7708 32.4992 174.8785 14 L 4.7737 8.4365 120.5849 52.7244 44.6396 176.0472 15 R 4.3533 8.6909 124.2892 56.7653 29.8567 175.7633 16 V 4.1380 8.7612 127.1741 63.3962 33.3738 176.4601 17 G 4.1921 7.2712 109.1380 46.0807 0.0000 171.2839 18 N 5.6618 8.9026 119.8367 51.7350 42.6270 174.6303 19 C 5.1078 9.1037 117.2199 55.0869 44.6593 173.0942 20 L 5.3085 8.4837 122.5444 53.5692 44.3205 175.8275 21 I 4.4535 8.7535 127.3740 60.3545 39.9381 176.0100 22 G 4.0887 9.8342 115.2062 46.6492 0.0000 174.4210 23 G 3.9402 8.5034 106.8277 45.0331 0.0000 174.3054 24 V 4.1692 7.6794 120.3310 61.4534 32.8363 174.5878 25 S 5.3053 8.2992 122.5553 57.8449 64.1541 173.3968 26 F 4.9741 9.3848 121.6764 56.0215 43.6142 173.8154 27 T 4.7978 8.9091 117.8523 62.6021 70.5300 173.4820 28 Y 5.1441 9.1884 128.6595 57.0980 40.0572 173.3111 29 C 5.4835 9.0606 124.9454 55.3100 42.0811 172.6748 30 C 5.5188 8.9784 120.2019 54.9225 44.2007 174.3363 31 T 4.1326 8.5296 111.6245 62.0587 68.1473 174.3320 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 V 7.91 4.13 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 1.02 0.00 0.00 0.92 0.00 0.00 2 C 8.75 5.31 0.00 2.83 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 0.00 0.00 0.00 0.00 3 S 9.55 4.83 0.00 3.81 3.88 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 0.00 0.00 0.00 4 C 8.98 5.18 0.00 2.64 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 R 9.32 4.93 0.00 1.78 1.87 0.00 3.33 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 6 L 8.87 3.68 0.00 1.55 1.53 0.92 0.28 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 7 V 7.96 3.82 1.67 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 -0.16 0.00 0.00 0.70 0.00 0.00 8 F 8.49 5.16 0.00 3.11 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.63 4.58 0.00 3.01 3.04 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 0.00 10 R 8.87 4.30 0.00 1.96 1.86 0.00 3.14 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 11 R 8.54 3.93 0.00 1.79 1.99 0.00 3.18 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 12 T 7.82 4.37 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 13 E 7.91 4.86 0.00 2.12 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 14 L 8.44 4.77 0.00 1.51 1.53 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.69 4.35 0.00 1.86 1.88 0.00 3.26 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 16 V 8.76 4.14 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 0.97 0.00 0.00 0.96 0.00 0.00 17 G 7.27 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.90 5.66 0.00 2.60 2.75 0.00 0.00 6.52 7.66 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 19 C 9.10 5.11 0.00 2.79 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.48 5.31 0.00 1.62 1.54 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.75 4.45 1.89 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.31 0.88 0.00 0.00 22 G 9.83 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.50 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.68 4.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.92 0.00 0.00 25 S 8.30 5.31 0.00 3.75 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.38 4.97 0.00 2.96 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.80 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 28 Y 9.19 5.14 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 9.06 5.48 0.00 2.79 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.98 5.52 0.00 2.70 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.53 4.13 4.22 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 0.00 0.00 0.00 1.19 0.00 0.00