NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9160 8.3549 109.7383 44.8753 0.0000 173.1934 2 P 4.1058 0.0000 0.0000 64.4834 31.8460 175.7229 3 L 4.3509 7.7238 119.8492 53.8527 42.3184 177.3457 4 G 4.1222 7.7124 114.5676 46.8316 0.0000 173.2401 5 S 4.4073 8.7459 117.3962 57.5244 63.9572 174.1412 6 D 4.7513 7.8083 124.3561 55.6793 41.4263 174.1733 7 H 4.3359 7.7765 117.8439 53.4691 28.3295 174.9509 8 H 4.5732 7.4981 113.2072 56.2425 30.7928 172.6080 9 M 4.5644 8.4219 124.6014 54.1529 33.8960 174.7771 10 E 4.3320 8.7461 120.0233 55.9534 30.2575 175.3280 11 F 4.8524 7.0605 113.0079 56.1923 40.6342 173.1221 12 C 4.8575 8.6085 117.8825 59.0890 28.4528 175.2041 13 R 3.6793 8.1938 123.9122 59.0213 29.9856 177.7744 14 V 4.0880 7.8800 115.2400 64.8552 32.2422 176.4878 15 C 4.4736 8.0095 111.6179 58.5774 30.2895 174.5407 16 K 4.3156 7.5510 115.1104 58.7638 29.0321 173.5435 17 D 4.7656 7.8721 120.9798 54.8428 43.2283 174.7605 18 G 4.2081 8.3681 107.5951 46.5926 0.0000 174.6864 19 G 3.4785 8.4695 107.5690 46.3671 0.0000 174.9846 20 E 4.1054 9.0906 116.8756 56.1760 30.8298 176.3395 21 L 4.8527 8.1805 122.5553 52.8826 46.2009 175.3670 22 L 4.5605 9.1010 125.0595 53.6248 44.1681 175.0899 23 C 5.7332 8.8881 123.1667 57.1027 31.5773 173.5525 24 C 4.6692 8.8289 115.6054 57.8896 31.0317 173.0359 25 D 5.0108 8.6225 116.9862 54.3414 41.1819 175.8378 26 T 4.4345 8.0515 105.8047 62.3815 70.3460 173.4792 27 C 4.8089 7.9007 115.3731 55.0256 32.8595 171.7236 28 P 4.7886 0.0000 0.0000 62.6590 29.4286 175.0155 29 S 5.0719 7.7899 115.6555 57.4560 67.5499 175.0677 30 S 4.9437 7.6544 114.8944 57.2463 66.6598 172.9286 31 Y 5.0107 9.0703 119.8525 55.8059 42.8911 175.3998 32 H 5.1019 9.0565 125.0719 55.9124 27.2133 176.5842 33 I 4.4591 8.5775 122.7397 61.4727 38.1941 176.1070 34 H 5.0599 7.8892 113.8154 56.7438 28.9293 174.3486 35 C 4.2473 8.3714 119.8253 62.1053 28.2763 173.5857 36 L 4.5596 7.4658 118.9825 53.5477 42.3247 176.6180 37 R 3.9949 8.5111 118.5048 59.2595 30.3538 176.0064 38 P 4.5775 0.0000 0.0000 62.0552 29.1375 175.8344 39 A 4.4595 7.5991 122.1916 51.5857 19.9315 177.2174 40 L 4.9556 8.8838 120.6006 53.4264 44.4979 176.5807 41 Y 4.7392 8.7815 117.9446 57.7994 39.1107 175.8022 42 E 4.6731 7.9333 117.4514 54.2952 31.8818 175.8214 43 V 3.8230 8.1276 114.6015 59.7333 31.9167 174.7426 44 P 4.4788 0.0000 0.0000 62.5225 30.0447 175.8822 45 D 4.5180 8.6458 124.9544 55.1268 41.1017 177.7048 46 G 3.5665 8.4308 108.0156 45.7363 0.0000 174.4623 47 E 4.8005 8.5377 116.4352 54.2634 33.3519 175.1234 48 W 4.4358 8.0058 125.5744 57.0767 33.2970 173.0835 49 Q 4.0220 7.3164 124.8969 53.7060 31.8841 173.8555 50 C 3.7651 7.6910 116.1987 56.6981 30.6714 172.2409 51 P 4.1904 0.0000 0.0000 65.7102 30.9776 178.4704 52 R 4.4232 8.0003 113.9074 55.7780 31.3578 173.4249 53 C 4.4242 8.1894 110.8052 58.7568 26.1345 172.4773 54 T 4.3255 7.4331 112.8075 61.7119 69.4815 171.1441 55 C 4.1073 8.8511 116.4865 58.4997 29.8023 172.3420 56 P 4.5270 0.0000 0.0000 62.4782 30.8245 176.6003 57 A 4.3272 7.7434 120.7751 53.9592 20.0811 177.9996 58 L 4.3099 7.5361 115.2222 53.3179 43.0324 175.9855 59 K 4.1897 8.3621 121.2778 55.8180 31.9189 176.3615 60 G 3.9069 8.5901 116.2063 46.8902 0.0000 173.0732 61 K 4.1183 7.6724 122.8105 56.4287 33.0930 175.8835 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 G 8.35 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 2 P 0.00 4.11 0.00 2.15 2.01 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.17 0.00 3 L 7.72 4.35 0.00 1.78 1.65 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.71 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.75 4.41 0.00 4.01 3.99 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 6 D 7.81 4.75 0.00 2.87 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 H 7.78 4.34 0.00 3.15 3.23 0.00 6.02 0.00 0.00 0.00 0.00 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 7.50 4.57 0.00 3.09 3.16 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 8.42 4.56 0.00 1.65 0.72 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.02 0.00 10 E 8.75 4.33 0.00 2.12 2.07 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 2.40 2.29 0.00 11 F 7.06 4.85 0.00 3.21 2.94 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 12 C 8.61 4.86 0.00 3.19 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 13 R 8.19 3.68 0.00 1.81 2.02 0.00 3.15 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.28 0.00 14 V 7.88 4.09 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 0.89 0.00 0.00 1.08 0.00 0.00 15 C 8.01 4.47 0.00 3.25 3.05 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 0.00 0.00 0.00 0.00 16 K 7.55 4.32 0.00 1.90 1.97 0.00 1.68 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.53 1.59 7.81 17 D 7.87 4.77 0.00 2.79 2.65 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 18 G 8.37 4.21 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 0.00 0.00 0.00 19 G 8.47 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.09 4.11 0.00 1.92 1.86 0.00 0.00 0.00 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 2.24 0.00 21 L 8.18 4.85 0.00 1.43 1.45 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 22 L 9.10 4.56 0.00 1.41 1.43 0.78 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 23 C 8.89 5.73 0.00 2.96 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 24 C 8.83 4.67 0.00 3.12 2.98 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 25 D 8.62 5.01 0.00 2.66 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.05 4.43 4.23 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 1.20 0.00 0.00 27 C 7.90 4.81 0.00 3.17 2.94 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 28 P 0.00 4.79 0.00 2.21 2.33 0.00 3.73 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.05 0.00 29 S 7.79 5.07 0.00 3.79 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.65 4.94 0.00 3.56 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 9.07 5.01 0.00 2.77 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 9.06 5.10 0.00 3.01 2.35 0.00 5.84 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 8.58 4.46 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.35 0.75 0.00 0.00 34 H 7.89 5.06 0.00 3.35 3.71 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 C 8.37 4.25 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 36 L 7.47 4.56 0.00 1.68 1.53 0.91 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.51 3.99 0.00 1.87 1.98 0.00 3.24 0.00 0.00 3.48 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 38 P 0.00 4.58 0.00 2.05 1.98 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 39 A 7.60 4.46 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.88 4.96 0.00 1.80 1.89 1.35 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 8.78 4.74 0.00 2.81 2.94 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 42 E 7.93 4.67 0.00 2.09 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 0.00 2.25 2.29 0.00 43 V 8.13 3.82 2.06 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 0.78 0.00 0.00 0.92 0.00 0.00 44 P 0.00 4.48 0.00 2.46 2.26 0.00 3.63 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.80 0.00 45 D 8.65 4.52 0.00 2.82 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.43 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 47 E 8.54 4.80 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 48 W 8.01 4.44 0.00 3.19 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 49 Q 7.32 4.02 0.00 1.74 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.73 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 50 C 7.69 3.77 0.00 3.06 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.19 0.00 2.16 2.23 0.00 3.43 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 1.96 1.81 0.00 52 R 8.00 4.42 0.00 1.68 1.85 0.00 3.40 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.61 0.00 53 C 8.19 4.42 0.00 3.21 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 54 T 7.43 4.33 4.29 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 1.26 0.00 0.00 55 C 8.85 4.11 0.00 3.12 2.98 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 56 P 0.00 4.53 0.00 2.18 2.13 0.00 3.76 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 57 A 7.74 4.33 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 58 L 7.54 4.31 0.00 1.62 1.61 0.91 0.86 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 59 K 8.36 4.19 0.00 1.69 1.71 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.40 7.81 60 G 8.59 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.67 4.12 0.00 1.64 1.61 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.31 7.81