NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8777 8.3249 122.8241 58.1350 40.6807 175.7307 2 V 3.6362 6.9991 121.1864 60.4084 31.9206 177.2441 3 N 4.1874 8.7913 119.0016 56.9884 38.9392 176.3173 4 Q 3.9942 7.9403 118.4472 59.1313 28.5127 178.0582 5 H 4.1026 8.0932 118.8429 59.2085 29.4234 177.2192 6 L 3.9376 8.0114 120.9008 57.7330 41.3908 178.9195 7 C 4.2114 8.4814 119.2008 62.5742 31.5360 175.7631 8 G 3.6785 8.3656 107.5470 47.9658 0.0000 175.4275 9 S 3.9356 7.6535 114.7605 61.5613 62.3608 176.0910 10 H 4.1480 7.9000 117.9948 58.4412 28.3416 177.4704 11 L 3.9237 8.0249 121.1026 58.2680 41.4907 180.2350 12 V 3.2062 7.4795 111.8292 64.0266 31.3363 178.3479 13 E 3.9324 7.8415 118.7517 59.1117 29.3839 178.7536 14 A 3.9796 8.0940 120.9257 54.9861 18.3504 179.5572 15 L 3.6613 7.8695 117.7800 57.8596 41.0109 178.8915 16 Y 4.2844 7.9721 119.7948 60.7528 38.4820 178.0987 17 L 3.8561 7.7094 119.7076 58.2854 42.3801 179.0845 18 V 3.7639 7.7563 117.7915 64.7734 31.6539 177.6777 19 C 4.3074 8.5877 117.5691 59.7226 28.5383 175.1273 20 G 3.6816 8.1572 108.1795 46.6900 0.0000 177.2721 21 E 4.1069 8.8452 123.3527 58.4942 29.5116 178.1343 22 R 3.9132 7.7693 117.7526 56.9828 30.4552 178.2416 23 G 3.9701 7.9043 106.1991 45.9914 0.0000 171.7219 24 F 4.8319 7.7018 112.2309 56.3172 40.2569 172.5231 25 F 5.1559 9.0854 122.8588 56.5386 40.9496 173.3199 26 Y 4.5964 9.1233 129.1749 55.7943 40.0569 174.4641 27 T 4.0731 7.0780 116.6830 58.8050 70.4042 173.0193 28 P 3.7976 0.0000 0.0000 64.3765 31.7195 176.6252 29 K 4.0970 7.1333 122.0044 56.5627 31.8437 176.6458 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 4.88 0.00 2.93 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 2 V 7.00 3.64 1.88 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 0.59 0.00 0.00 0.42 0.00 0.00 3 N 8.79 4.19 0.00 2.84 2.97 0.00 0.00 7.01 7.74 0.00 0.00 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 7.94 3.99 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 5 H 8.09 4.10 0.00 3.21 3.37 0.00 5.87 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 6 L 8.01 3.94 0.00 1.83 1.72 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.48 4.21 0.00 3.05 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 8.37 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 3.94 0.00 3.74 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 10 H 7.90 4.15 0.00 3.37 3.30 0.00 5.69 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 8.02 3.92 0.00 1.82 1.72 1.02 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.48 3.21 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 0.05 0.00 0.00 0.79 0.00 0.00 13 E 7.84 3.93 0.00 2.01 2.00 0.00 0.00 0.00 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 8.09 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 3.66 0.00 0.64 0.49 0.74 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.97 4.28 0.00 3.25 3.22 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 0.00 17 L 7.71 3.86 0.00 1.73 1.84 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.76 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 8.59 4.31 0.00 3.23 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 8.16 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.85 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 2.30 2.30 0.00 22 R 7.77 3.91 0.00 1.92 2.04 0.00 3.34 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 7.90 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 7.70 4.83 0.00 3.23 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 25 F 9.09 5.16 0.00 2.89 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 9.12 4.60 0.00 3.25 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 7.08 4.07 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 -0.07 0.00 0.00 28 P 0.00 3.80 0.00 2.01 2.16 0.00 3.53 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.27 0.00 29 K 7.13 4.10 0.00 1.68 1.67 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.50 7.81