NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.2776 0.0000 0.0000 62.3610 33.0660 174.7778 2 V 4.5329 8.2766 123.7144 60.6547 35.2840 172.8809 3 L 4.7041 9.6639 127.3951 53.1621 45.0953 174.9335 4 I 4.6539 8.3954 125.3187 59.7810 38.6479 175.5223 5 V 4.5335 9.1178 127.8825 61.2250 34.2284 173.7441 6 Y 5.0817 9.8763 124.4011 55.2895 40.7878 175.4650 7 G 4.2491 8.2246 112.1990 44.1754 0.0000 169.9478 8 P 4.4971 0.0000 0.0000 62.0169 31.9073 176.3927 9 K 4.4775 8.3992 118.9650 56.4567 32.5873 176.7761 10 L 4.6955 9.3131 126.1829 53.0272 43.9992 177.5051 11 D 4.5297 8.8701 127.0423 56.6015 41.1876 176.7039 12 V 3.9233 8.6124 123.9704 65.7713 31.5712 177.7410 13 G 3.7911 8.0309 105.5976 47.6699 0.0000 175.5127 14 K 3.8793 8.1844 122.5152 58.5474 31.9270 178.4176 15 K 4.1123 7.8209 118.4941 59.2770 32.4314 178.9073 16 R 4.0993 7.8558 121.2566 60.0803 29.7433 178.7446 17 E 4.1653 8.3927 117.5952 60.0144 29.6108 181.3987 18 F 4.8662 7.7082 118.3777 60.7286 39.6491 177.5932 19 V 3.6496 8.6197 120.6974 65.7335 31.3092 178.5274 20 E 3.9782 8.3131 118.2386 61.1879 29.5019 182.1567 21 R 4.1717 7.5781 119.0912 59.0883 30.1860 179.3002 22 L 4.0485 7.7865 121.2335 58.6285 41.5598 180.2827 23 T 3.9342 8.1002 114.5877 66.6484 68.3186 177.9456 24 S 4.3241 8.0250 117.8516 60.7370 62.7192 176.4940 25 V 3.5310 7.9324 120.3470 66.5486 31.6088 178.3654 26 A 4.0707 8.0936 119.8008 55.6076 18.1631 179.1552 27 A 4.3017 8.1025 123.0657 55.2921 18.3454 179.6801 28 E 4.2948 8.8205 116.0081 60.3314 29.7419 179.6273 29 I 4.5235 7.6240 113.9554 61.9243 39.0291 180.9231 30 Y 4.2014 8.1221 121.0367 61.0952 38.1873 176.5339 31 G 3.7744 8.0899 110.7171 45.7881 0.0000 175.0370 32 M 4.1318 7.9588 117.4689 54.9105 31.3711 173.8498 33 D 5.0880 8.1152 117.5769 52.5906 43.5633 177.2335 34 R 4.0151 8.7124 120.3075 59.0064 30.6512 178.3416 35 S 4.0370 8.3581 116.3264 59.9305 61.5565 181.3900 36 A 4.3184 8.6125 117.9387 52.8138 18.3817 177.8425 37 I 4.9678 8.7707 120.4606 60.0547 40.3098 175.4042 38 T 4.6826 8.3150 115.6731 60.1751 72.3372 173.3492 39 I 4.7546 8.1424 124.3057 60.5657 39.9303 175.5317 40 L 4.1423 8.3033 122.1062 54.6195 45.2600 174.4677 41 I 4.7929 8.2136 125.1317 59.8510 39.4688 175.0908 42 H 4.8844 9.3134 123.0723 53.3958 31.7168 174.0456 43 E 5.3916 8.3998 117.9841 53.1387 29.8580 174.9145 44 P 4.3305 0.0000 0.0000 62.0417 32.3208 175.3497 45 P 4.3169 0.0000 0.0000 62.5265 31.5532 176.9713 46 A 3.8715 8.6185 122.5399 54.3977 18.3582 178.1502 47 E 4.3458 8.0043 113.6748 57.0040 30.2841 176.5394 48 N 4.8085 8.8502 116.2473 52.5826 39.0544 174.6208 49 V 4.3374 7.5942 118.8549 60.8805 34.0780 174.2865 50 G 4.4037 8.6519 115.6578 43.5502 0.0000 172.3005 51 V 4.1397 8.3867 122.4550 61.7866 33.5581 176.4931 52 G 3.8844 9.2787 114.9930 45.5206 0.0000 173.5332 53 G 4.0434 8.4657 108.7523 45.5065 0.0000 174.4348 54 K 4.6203 7.9485 121.3535 52.0311 34.6229 181.2397 55 L 4.6610 8.2926 123.3293 53.9074 42.1660 178.3657 56 I 3.5286 8.1243 121.5922 63.6085 36.9816 177.7241 57 A 4.0693 7.2295 123.5510 54.1951 18.6651 177.1965 58 D 4.5330 7.8168 118.7388 54.3073 41.1360 176.7851 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 P 0.00 4.28 0.00 1.92 1.66 0.00 3.36 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.42 0.00 2 V 8.28 4.53 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 0.75 0.00 0.00 0.89 0.00 0.00 3 L 9.66 4.70 0.00 1.57 1.48 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.40 4.65 1.91 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 1.24 0.36 0.80 0.00 0.00 5 V 9.12 4.53 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 1.13 0.00 0.00 0.79 0.00 0.00 6 Y 9.88 5.08 0.00 2.87 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 7 G 8.22 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.04 2.06 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 9 K 8.40 4.48 0.00 1.76 1.76 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.65 1.48 7.81 10 L 9.31 4.70 0.00 1.59 1.55 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.87 4.53 0.00 2.68 2.57 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 12 V 8.61 3.92 2.08 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 0.77 0.00 0.00 0.93 0.00 0.00 13 G 8.03 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.18 3.88 0.00 1.82 1.91 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 15 K 7.82 4.11 0.00 2.02 1.90 0.00 2.06 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.51 7.81 16 R 7.86 4.10 0.00 1.87 1.96 0.00 3.10 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 17 E 8.39 4.17 0.00 2.04 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 0.00 2.24 2.18 0.00 18 F 7.71 4.87 0.00 3.15 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.62 3.65 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 0.89 0.00 0.00 0.89 0.00 0.00 20 E 8.31 3.98 0.00 2.02 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 0.00 2.24 2.22 0.00 21 R 7.58 4.17 0.00 2.06 2.07 0.00 3.14 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.01 0.00 22 L 7.79 4.05 0.00 1.48 1.58 0.12 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.10 3.93 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 24 S 8.03 4.32 0.00 4.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.93 3.53 2.08 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 0.99 0.00 0.00 1.00 0.00 0.00 26 A 8.09 4.07 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.10 4.30 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.82 4.29 0.00 2.04 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 2.26 2.19 0.00 29 I 7.62 4.52 1.87 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 1.30 1.23 0.91 0.00 0.00 30 Y 8.12 4.20 0.00 3.31 3.02 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 0.00 0.00 0.00 31 G 8.09 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.96 4.13 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 33 D 8.12 5.09 0.00 2.70 2.64 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 34 R 8.71 4.02 0.00 1.79 1.99 0.00 3.36 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 35 S 8.36 4.04 0.00 3.64 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 36 A 8.61 4.32 1.24 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 0.00 0.00 0.00 37 I 8.77 4.97 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.98 0.90 0.00 0.00 38 T 8.32 4.68 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 39 I 8.14 4.75 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.34 0.77 0.00 0.00 40 L 8.30 4.14 0.00 1.47 1.38 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.21 4.79 1.84 0.00 0.00 0.96 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 0.45 0.96 0.00 0.00 42 H 9.31 4.88 0.00 2.72 3.08 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.40 5.39 0.00 1.93 1.89 0.00 0.00 0.00 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 2.23 0.00 44 P 0.00 4.33 0.00 2.24 2.19 0.00 4.16 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 45 P 0.00 4.32 0.00 2.61 2.25 0.00 3.75 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 2.32 1.99 0.00 46 A 8.62 3.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.35 0.00 1.95 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 2.26 2.38 0.00 48 N 8.85 4.81 0.00 2.73 2.84 0.00 0.00 6.65 7.56 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 49 V 7.59 4.34 2.09 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 1.01 0.00 0.00 1.02 0.00 0.00 50 G 8.65 4.40 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 0.00 51 V 8.39 4.14 2.08 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 0.97 0.00 0.00 0.93 0.00 0.00 52 G 9.28 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 53 G 8.47 4.04 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 0.00 0.00 0.00 54 K 7.95 4.62 0.00 1.69 1.64 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.25 1.23 7.81 55 L 8.29 4.66 0.00 1.70 1.85 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.12 3.53 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.47 0.92 0.00 0.00 57 A 7.23 4.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.82 4.53 0.00 2.67 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00