NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7969 8.1827 119.4008 57.2100 40.4337 175.4463 2 V 3.5515 8.5445 125.6764 63.9962 31.4248 176.1496 3 N 4.3218 8.5112 116.8177 56.2022 37.3706 176.2903 4 Q 4.0011 8.1964 121.7018 58.8816 29.1932 177.3853 5 H 4.1807 8.3510 119.1959 59.5611 29.3934 177.2526 6 L 4.0087 8.2795 120.8664 57.6978 41.3386 179.0331 7 C 4.2274 8.3157 118.8608 62.5200 31.5488 175.7219 8 G 3.6702 8.4061 107.6519 47.9819 0.0000 175.3687 9 S 3.9270 7.7887 114.7991 61.5561 62.3644 176.1142 10 H 4.1296 7.8947 118.0707 58.4699 28.3520 177.6357 11 L 3.9240 8.0635 121.2318 58.0989 41.4301 180.1367 12 V 3.0934 7.5797 112.1153 63.9356 31.3488 178.3165 13 E 3.8828 7.7749 118.4417 59.1587 29.4129 178.6694 14 A 3.9756 7.9720 120.7607 55.1667 18.3979 179.6296 15 L 3.7188 7.8622 117.6457 57.8347 41.0598 178.7768 16 Y 4.4327 7.8446 119.7696 61.0814 38.4296 178.5877 17 L 3.8825 7.7785 118.2933 57.7232 41.8617 179.5792 18 V 3.7749 7.8014 118.2332 64.9552 31.7050 177.9737 19 C 4.3118 8.7939 117.7929 60.2397 28.4781 175.0073 20 G 3.6549 8.2160 108.9146 46.4909 0.0000 176.8566 21 E 4.1053 8.8235 122.5392 58.5844 29.5843 178.2299 22 R 3.9034 7.7203 117.9180 57.1656 30.4007 178.1865 23 G 3.9246 8.5160 105.8107 45.4914 0.0000 172.0842 24 F 4.8471 7.6630 111.3214 56.0307 40.1518 173.0756 25 F 4.9980 9.0749 123.8075 56.7953 40.1857 174.2734 26 Y 4.5419 8.9755 130.7218 56.4976 38.4380 175.2083 27 T 4.0301 7.2443 117.8238 58.5471 69.1206 171.7153 28 P 3.9986 0.0000 0.0000 64.9895 31.9428 177.2285 29 K 4.1129 7.6469 122.0990 56.3073 32.2116 175.9562 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 8.18 4.80 0.00 3.15 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 2 V 8.54 3.55 2.14 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 1.20 0.00 0.00 0.95 0.00 0.00 3 N 8.51 4.32 0.00 2.97 3.10 0.00 0.00 5.90 7.36 0.00 0.00 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 8.20 4.00 0.00 2.22 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.91 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 5 H 8.35 4.18 0.00 3.45 3.53 0.00 5.83 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 8.28 4.01 0.00 1.75 1.74 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.32 4.23 0.00 3.02 3.08 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 0.00 0.00 0.00 0.00 8 G 8.41 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 7.79 3.93 0.00 3.74 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 7.89 4.13 0.00 3.34 3.30 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 8.06 3.92 0.00 1.74 1.66 1.02 0.99 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 7.58 3.09 1.97 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 0.11 0.00 0.00 0.81 0.00 0.00 13 E 7.77 3.88 0.00 2.01 2.01 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 2.28 2.39 0.00 14 A 7.97 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.86 3.72 0.00 0.66 0.78 0.70 0.97 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 7.84 4.43 0.00 3.25 3.23 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 0.00 17 L 7.78 3.88 0.00 1.80 1.70 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.80 3.77 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.92 0.00 0.00 19 C 8.79 4.31 0.00 3.24 3.33 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 20 G 8.22 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 8.82 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 2.31 0.00 22 R 7.72 3.90 0.00 1.96 2.04 0.00 3.29 0.00 0.00 3.24 7.33 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 8.52 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.66 4.85 0.00 3.25 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 5.00 0.00 2.87 3.08 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 0.00 0.00 0.00 0.00 26 Y 8.98 4.54 0.00 3.20 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 27 T 7.24 4.03 3.81 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 -0.38 0.00 0.00 28 P 0.00 4.00 0.00 2.11 1.98 0.00 3.38 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 29 K 7.65 4.11 0.00 1.96 1.71 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 0.98 7.81