NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 39 D 4.4788 8.3649 120.3170 54.0566 41.4503 175.4283 40 R 3.7316 8.1435 114.5994 57.4721 27.1985 175.2072 41 P 4.2648 0.0000 0.0000 64.5324 32.7648 176.8587 42 Y 4.6439 7.7559 116.4326 55.7357 38.1753 173.7775 43 S 4.9438 7.8525 118.0483 55.2318 61.9886 172.6406 44 C 4.0399 8.2575 122.7200 59.7107 32.4531 172.7844 45 D 4.9391 8.2758 121.9651 53.6881 41.3947 175.0815 46 H 4.5114 8.0097 119.0795 54.1571 31.2108 172.1059 47 P 4.2828 0.0000 0.0000 64.6887 31.1376 176.3739 48 G 3.8841 9.0843 110.7154 45.5305 0.0000 172.4217 49 C 4.7190 7.5835 119.4758 58.5693 32.7692 172.7203 50 D 4.5197 7.9664 117.6051 52.0047 39.0982 176.8766 51 K 4.0606 8.1066 119.5068 55.6888 34.4242 176.4502 52 A 4.1842 7.9162 126.7700 51.7497 19.2908 175.8738 53 F 4.9335 8.0428 115.8457 56.5544 43.2105 174.9524 54 V 4.3757 8.5296 120.3352 63.6292 33.4795 176.0015 55 R 4.3662 7.8443 117.5859 55.1519 31.6839 175.2253 56 N 3.1400 7.9690 115.9670 55.5974 39.8276 176.2547 57 H 3.9155 8.0555 113.7765 59.0746 28.1441 176.4017 58 D 3.8070 7.7532 120.6728 57.1057 40.6678 178.6967 59 L 3.6663 7.3455 120.1648 57.8761 41.8097 179.1944 60 I 3.6711 7.1685 119.4350 64.3661 37.0180 178.3064 61 R 3.9147 8.0711 117.5762 58.6152 30.1553 177.9865 62 H 4.2874 8.2623 118.6989 58.4062 30.0687 177.0611 63 K 3.9823 8.3194 121.8647 59.4176 30.6744 178.7101 64 K 4.1362 7.7362 117.8992 58.4079 31.9612 179.0069 65 S 4.3656 7.8081 114.4808 61.2549 62.1674 175.0909 66 H 4.2508 7.6912 116.6472 58.0193 28.3521 176.3756 67 Q 4.0836 7.9060 121.4303 54.2690 29.3603 173.6421 68 E 3.6439 7.1969 124.5870 55.7775 30.1539 175.6283 69 K 4.2429 8.2542 118.6323 56.8950 34.5310 177.1702 70 A 4.0884 8.5998 122.4101 53.6275 18.6412 177.2807 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 39 D 8.36 4.48 0.00 2.79 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.14 3.73 0.00 2.10 1.99 0.00 3.13 0.00 0.00 3.32 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 41 P 0.00 4.26 0.00 1.50 1.91 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 42 Y 7.76 4.64 0.00 3.05 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 7.85 4.94 0.00 3.83 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 44 C 8.26 4.04 0.00 3.12 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 45 D 8.28 4.94 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.01 4.51 0.00 3.09 2.80 0.00 5.93 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.28 0.00 2.11 2.00 0.00 3.32 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.87 0.00 48 G 9.08 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 0.00 0.00 0.00 49 C 7.58 4.72 0.00 3.23 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 50 D 7.97 4.52 0.00 2.76 2.68 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 51 K 8.11 4.06 0.00 1.75 1.51 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.44 0.00 0.00 0.00 0.00 1.32 1.50 7.81 52 A 7.92 4.18 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.04 4.93 0.00 3.36 2.88 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 54 V 8.53 4.38 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.98 0.00 0.00 55 R 7.84 4.37 0.00 1.98 1.82 0.00 3.30 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 56 N 7.97 3.14 0.00 2.60 2.58 0.00 0.00 6.57 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.06 3.92 0.00 3.29 3.47 0.00 5.53 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 58 D 7.75 3.81 0.00 2.47 2.26 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 59 L 7.35 3.67 0.00 1.48 1.57 0.97 1.19 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 60 I 7.17 3.67 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.62 0.86 0.00 0.00 61 R 8.07 3.91 0.00 1.52 1.89 0.00 3.27 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 62 H 8.26 4.29 0.00 2.68 2.79 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.32 3.98 0.00 1.88 1.78 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.52 7.81 64 K 7.74 4.14 0.00 1.74 1.80 0.00 1.69 0.00 0.00 1.55 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.60 7.81 65 S 7.81 4.37 0.00 3.75 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 66 H 7.69 4.25 0.00 3.23 2.98 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 7.91 4.08 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.04 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 68 E 7.20 3.64 0.00 2.23 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 69 K 8.25 4.24 0.00 1.74 1.78 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.42 7.81 70 A 8.60 4.09 1.29 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 0.00 0.00