NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 F 4.8022 8.3093 122.8212 58.1991 40.5830 173.9327 13 K 3.6311 6.7972 122.7150 55.4273 34.5039 173.4775 14 L 4.2344 8.6094 121.7246 52.8443 43.8351 176.2456 15 P 4.3281 0.0000 0.0000 63.1322 31.6367 176.2452 16 N 5.0140 8.6522 117.5641 52.4246 37.9727 174.0596 17 T 4.6975 7.5847 107.2539 60.2050 71.8840 173.2122 18 V 4.4317 8.2076 121.9512 61.1882 34.4763 174.7855 19 S 4.6611 8.5565 121.9012 56.6299 65.8247 173.2289 20 L 4.5211 8.4861 125.1560 53.5523 42.5126 176.3873 21 V 4.5426 7.9893 115.4207 59.8774 35.7782 174.4698 22 A 4.5502 7.9145 122.0931 51.6895 21.7110 175.6513 23 G 4.2796 8.0723 107.8867 45.4081 0.0000 172.5466 24 S 4.6186 8.7321 113.3965 57.1637 65.8230 173.2935 25 S 4.4639 7.9413 112.5063 57.9468 64.6252 175.1020 26 E 4.4053 8.6165 124.8349 55.7485 30.6936 175.8159 27 G 4.1793 7.7999 106.2013 44.8965 0.0000 173.8864 28 E 4.1327 8.8444 120.9992 58.5321 30.0254 177.6546 29 T 4.7699 7.4413 107.7108 58.2792 73.3159 172.7854 30 P 4.2510 0.0000 0.0000 65.8796 31.2932 178.8028 31 L 4.0207 7.8838 118.5095 58.2063 41.9986 178.5801 32 N 4.3859 8.3577 116.4226 55.9788 38.3805 177.3428 33 A 4.1606 8.2816 122.5665 54.9501 18.4575 179.4448 34 F 4.0662 8.5426 119.4183 61.4508 39.4665 176.7633 35 D 4.3651 8.6182 118.0809 57.4288 40.9595 178.4781 36 G 3.6614 8.6001 107.3878 47.1391 0.0000 175.5179 37 A 3.9250 8.0408 123.1655 54.8640 18.3711 179.7476 38 L 3.7431 7.7108 117.5161 57.7911 41.7278 179.6845 39 L 3.9231 7.9599 119.0048 57.9206 41.3655 179.2035 40 N 4.3151 8.1933 115.5955 56.2960 38.9127 176.2598 41 A 4.6982 7.0945 122.5789 52.2196 18.8404 178.1853 42 G 4.0617 7.9123 104.2571 45.2785 0.0000 173.7836 43 I 4.5682 7.4265 112.9197 60.3776 37.8677 177.0960 44 G 3.6937 8.3200 111.0468 48.5289 0.0000 174.8232 45 N 4.9523 8.0123 116.2401 52.9374 39.0578 174.4499 46 V 4.5021 7.4577 109.9088 59.4602 35.4713 174.8395 47 N 4.6948 8.5370 118.9215 52.1770 38.8723 175.1073 48 L 4.2486 8.4853 124.1951 53.9772 42.4938 176.6543 49 I 4.2194 8.0710 125.1075 59.1031 37.0891 175.1696 50 R 3.9775 8.4957 126.4914 56.1602 30.3927 175.7580 51 I 4.4949 8.2296 118.9984 59.2043 39.6229 175.6721 52 S 4.2637 8.3961 116.3546 58.5997 63.0223 173.6805 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 12 F 8.31 4.80 0.00 2.97 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 13 K 6.80 3.63 0.00 1.71 1.51 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.10 1.35 7.81 14 L 8.61 4.23 0.00 1.56 1.57 0.93 1.06 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 15 P 0.00 4.33 0.00 2.01 1.96 0.00 3.58 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 16 N 8.65 5.01 0.00 2.73 2.81 0.00 0.00 5.85 7.71 0.00 0.00 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 T 7.58 4.70 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 1.19 0.00 0.00 18 V 8.21 4.43 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 0.86 0.00 0.00 0.92 0.00 0.00 19 S 8.56 4.66 0.00 3.83 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 4.52 0.00 1.62 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.99 4.54 2.22 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 0.71 0.00 0.00 0.91 0.00 0.00 22 A 7.91 4.55 1.20 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 0.00 0.00 23 G 8.07 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.73 4.62 0.00 3.92 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 25 S 7.94 4.46 0.00 3.86 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.62 4.41 0.00 2.00 1.87 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 2.28 2.24 0.00 27 G 7.80 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 4.13 0.00 1.98 2.03 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 2.32 2.30 0.00 29 T 7.44 4.77 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 1.22 0.00 0.00 30 P 0.00 4.25 0.00 2.17 2.15 0.00 3.60 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 31 L 7.88 4.02 0.00 1.75 1.69 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.36 4.39 0.00 2.95 2.87 0.00 0.00 6.86 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.28 4.16 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 34 F 8.54 4.07 0.00 3.20 3.26 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 35 D 8.62 4.37 0.00 3.02 2.85 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 36 G 8.60 3.66 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 0.00 0.00 0.00 37 A 8.04 3.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.71 3.74 0.00 1.65 1.57 0.78 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.96 3.92 0.00 1.84 1.69 0.90 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 40 N 8.19 4.32 0.00 2.77 2.97 0.00 0.00 7.25 8.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.09 4.70 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.91 4.06 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 0.00 0.00 0.00 43 I 7.43 4.57 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.71 0.89 0.00 0.00 44 G 8.32 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.01 4.95 0.00 2.69 2.81 0.00 0.00 6.71 7.68 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 46 V 7.46 4.50 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 0.74 0.00 0.00 0.98 0.00 0.00 47 N 8.54 4.69 0.00 2.72 2.78 0.00 0.00 6.95 7.85 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 48 L 8.49 4.25 0.00 1.71 1.66 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.07 4.22 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 0.93 0.00 0.00 50 R 8.50 3.98 0.00 1.80 1.87 0.00 3.24 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 51 I 8.23 4.49 1.88 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 1.48 0.80 0.92 0.00 0.00 52 S 8.40 4.26 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00