NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8011 8.3249 122.8242 58.1761 40.8004 175.1149 2 V 3.6819 6.8097 119.7591 61.4889 31.9248 177.3006 3 N 4.1908 8.7649 118.3961 57.1930 39.1469 176.1895 4 Q 3.9937 7.9790 118.4167 59.1326 28.8433 177.9803 5 H 4.1043 8.2131 118.8188 59.4325 29.6844 177.1469 6 L 3.9150 7.8773 120.5491 57.7269 41.3955 178.7272 7 C 4.1845 8.3927 119.0934 62.6914 31.4957 175.6509 8 G 3.7963 8.5162 107.4478 48.1384 0.0000 175.2066 9 S 3.9424 7.7028 115.1977 61.5698 62.3710 176.1411 10 H 4.1495 7.9269 118.7850 58.5412 28.3576 177.6638 11 L 3.9433 8.1539 121.1926 58.0608 41.4749 180.0891 12 V 3.1952 7.5734 112.1305 64.1089 31.3881 178.2654 13 E 3.8961 7.8672 119.0902 59.2050 29.4808 178.8074 14 A 4.0082 8.0680 120.8648 54.9232 18.4169 179.6161 15 L 3.7210 7.8302 117.7423 57.8416 41.2814 178.9300 16 Y 4.3414 7.7241 119.4341 60.8517 38.5110 178.4122 17 L 3.8790 7.6651 118.3012 57.7405 41.8600 179.4077 18 V 3.6992 7.9823 117.1073 66.3214 31.8568 177.7032 19 C 4.3238 8.7648 116.8574 59.9241 28.4575 175.5311 20 G 3.6478 8.1801 107.6631 46.4265 0.0000 177.3094 21 E 4.0654 8.8792 123.4960 58.6663 29.3867 178.1780 22 R 3.8757 8.0269 117.7042 56.9523 30.3197 178.2255 23 G 3.9847 7.9428 106.4110 45.4162 0.0000 171.7696 24 F 4.8821 7.6670 111.8583 56.0406 40.3555 172.7253 25 F 4.8858 9.0438 122.8519 56.5715 40.9012 173.5820 26 Y 4.8462 9.2380 129.8289 56.4961 38.7372 174.8798 27 T 4.2596 7.4988 118.5238 58.6661 68.4506 172.6405 28 P 4.0257 0.0000 0.0000 64.9042 32.2337 177.5803 29 K 4.1029 7.1279 123.4332 56.4332 32.4012 175.6467 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 4.80 0.00 2.98 3.09 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 2 V 6.81 3.68 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.48 0.00 0.00 3 N 8.76 4.19 0.00 2.88 2.95 0.00 0.00 7.00 8.18 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 4 Q 7.98 3.99 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 5 H 8.21 4.10 0.00 3.19 3.40 0.00 5.86 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 7.88 3.92 0.00 1.90 1.74 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.39 4.18 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 8.52 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 9 S 7.70 3.94 0.00 3.69 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 10 H 7.93 4.15 0.00 3.30 3.31 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 8.15 3.94 0.00 1.77 1.69 1.04 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.57 3.20 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 0.07 0.00 0.00 0.83 0.00 0.00 13 E 7.87 3.90 0.00 1.95 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 2.39 0.00 14 A 8.07 4.01 1.34 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 0.00 0.00 0.00 15 L 7.83 3.72 0.00 0.63 0.68 0.79 0.66 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 7.72 4.34 0.00 3.23 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 7.67 3.88 0.00 1.80 1.69 0.96 1.01 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 18 V 7.98 3.70 2.12 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 0.82 0.00 0.00 0.92 0.00 0.00 19 C 8.76 4.32 0.00 3.22 3.26 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.88 4.07 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 2.29 2.31 0.00 22 R 8.03 3.88 0.00 2.01 2.03 0.00 3.33 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 23 G 7.94 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 7.67 4.88 0.00 3.24 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 9.04 4.89 0.00 3.02 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 9.24 4.85 0.00 3.33 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 27 T 7.50 4.26 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 0.36 0.00 0.00 28 P 0.00 4.03 0.00 2.09 1.85 0.00 3.38 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.84 0.00 29 K 7.13 4.10 0.00 1.70 1.65 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.45 7.81