NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8251 8.3249 122.8228 58.4009 40.6292 173.9914 2 V 3.9604 6.2064 116.5882 59.3235 32.3781 176.8528 3 N 4.3111 8.3441 120.5538 56.7859 37.6732 175.4715 4 Q 4.0269 8.0689 121.3310 58.6408 28.7381 177.2201 5 Y 4.0095 7.9428 120.2779 60.6831 38.5259 177.7896 6 L 3.9535 7.9922 120.0251 57.7016 41.6222 178.9826 7 C 4.2375 8.3012 118.9380 62.3749 31.6062 175.7302 8 G 3.6450 8.0484 107.5955 47.9852 0.0000 175.7834 9 S 3.9543 7.4413 115.3147 61.0254 62.9791 176.3342 10 H 4.2092 7.7142 119.6830 58.5759 28.4589 177.5271 11 L 3.9389 8.0680 121.0348 57.8452 41.5561 179.8003 12 V 3.3733 7.4656 117.8633 65.8297 31.2467 177.9972 13 E 3.9653 7.7853 116.8723 59.0095 29.2501 179.0579 14 A 3.9522 7.9491 120.9367 55.1708 18.4007 179.7098 15 L 3.6518 8.0717 117.9163 57.7846 41.3506 179.0098 16 Y 4.1761 7.5303 119.2169 60.6606 38.4648 178.3996 17 L 3.9248 7.5402 118.6071 57.7356 41.8955 179.2850 18 V 3.6834 7.5698 116.7148 66.4293 31.6153 177.6242 19 C 4.2925 8.3651 115.1877 60.1191 28.8019 176.0336 20 G 3.5679 8.2683 109.5279 46.0565 0.0000 175.4929 21 E 3.9347 9.1018 121.1315 59.4193 29.3354 178.4925 22 R 3.8604 7.9557 116.2023 57.2390 30.2503 177.8227 23 G 4.0033 8.8935 103.6148 45.2367 0.0000 171.4373 24 F 5.0352 7.5422 112.7183 55.4150 40.8480 173.2472 25 F 4.9967 8.1628 114.8219 54.9854 40.0689 173.7981 26 Y 4.5919 8.7863 123.6028 56.1145 40.7704 174.8430 27 T 4.4111 7.8294 123.3215 61.2901 70.8199 171.7834 28 P 4.3069 0.0000 0.0000 62.6779 31.7292 176.9046 29 K 3.8471 7.7985 118.4853 58.3581 32.5749 176.8018 30 T 3.7386 8.4520 117.0288 64.2956 68.3902 172.0378 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 4.83 0.00 2.98 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 2 V 6.21 3.96 1.94 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 0.47 0.00 0.00 0.34 0.00 0.00 3 N 8.34 4.31 0.00 3.17 3.62 0.00 0.00 5.77 7.34 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 4 Q 8.07 4.03 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 5 Y 7.94 4.01 0.00 3.08 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 6 L 7.99 3.95 0.00 1.91 1.74 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.30 4.24 0.00 3.13 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 8.05 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 9 S 7.44 3.95 0.00 3.88 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 10 H 7.71 4.21 0.00 3.34 3.34 0.00 5.62 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 8.07 3.94 0.00 1.84 1.71 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.47 3.37 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.48 0.00 0.00 13 E 7.79 3.97 0.00 2.07 1.93 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 2.27 2.51 0.00 14 A 7.95 3.95 1.30 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 15 L 8.07 3.65 0.00 0.56 0.63 0.63 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.53 4.18 0.00 3.28 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 17 L 7.54 3.92 0.00 1.81 1.69 1.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.57 3.68 1.99 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 0.79 0.00 0.00 0.95 0.00 0.00 19 C 8.37 4.29 0.00 3.13 3.16 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 0.00 0.00 0.00 0.00 20 G 8.27 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.10 3.93 0.00 1.95 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 2.30 2.33 0.00 22 R 7.96 3.86 0.00 1.82 2.05 0.00 3.31 0.00 0.00 3.47 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 23 G 8.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 5.04 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 5.00 0.00 3.21 3.03 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 0.00 0.00 0.00 26 Y 8.79 4.59 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 4.41 4.27 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 1.20 0.00 0.00 28 P 0.00 4.31 0.00 2.22 2.19 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 29 K 7.80 3.85 0.00 1.75 1.80 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.42 7.81 30 T 8.45 3.74 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 1.21 0.00 0.00