NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6259 8.1633 120.3355 55.3755 34.6372 177.5864 2 K 3.8468 7.9897 118.2074 59.1773 32.0499 177.6415 3 H 4.3016 8.2217 116.1599 59.0629 29.3187 177.1516 4 F 4.3914 8.4310 121.8728 61.4209 38.9189 176.8509 5 L 4.0900 7.9974 117.8059 57.6320 41.8901 179.0906 6 T 4.0593 7.8628 115.9640 66.3151 68.3438 176.3073 7 Y 4.1159 8.3499 122.0959 60.6902 38.7347 177.7957 8 L 3.6047 7.2566 117.0798 56.2794 41.7248 178.4363 9 S 4.3974 7.2919 113.9381 57.9445 63.9055 174.5003 10 T 3.9046 7.4209 113.6383 61.3213 69.5528 175.2640 11 A 3.8767 8.6773 127.7387 54.8965 18.5586 178.2928 12 P 4.2022 0.0000 0.0000 65.9273 31.3521 178.8015 13 V 3.4619 7.6167 117.9502 65.7649 31.4492 178.1213 14 L 3.9622 7.7668 118.0332 57.5709 41.4843 179.2386 15 A 4.0818 8.1415 120.7654 54.8745 18.2369 179.4656 16 A 3.9294 8.1577 119.3181 55.4093 18.6082 179.7421 17 I 3.6650 7.8720 118.1344 64.4548 37.2156 178.5468 18 W 4.4879 8.7874 129.3269 60.8409 30.4616 177.7069 19 M 3.9203 8.3180 118.2088 58.8310 31.6295 178.3462 20 T 3.8317 8.1892 116.2319 66.5363 68.5788 176.8097 21 I 3.6325 7.5987 121.6092 64.5855 37.1239 178.5960 22 T 3.5323 7.6352 116.4409 66.2858 68.1794 176.5617 23 A 3.9628 8.1790 123.0266 55.1372 18.4866 179.7224 24 G 3.6109 8.0698 104.2524 48.0832 0.0000 175.7841 25 I 3.7022 7.6688 122.0761 64.2082 37.2845 178.5870 26 L 4.0182 7.7957 119.7051 57.6975 41.1660 179.7306 27 I 3.6695 8.1233 119.0768 64.4454 37.4201 177.9083 28 E 3.8080 8.5572 119.6549 59.4234 29.3320 179.1913 29 F 4.0226 8.6029 120.9262 61.4837 39.2290 176.6353 30 N 4.6901 8.0692 113.7482 55.2252 38.4975 177.0780 31 R 3.9232 7.4417 120.2472 59.0534 30.2453 177.7559 32 F 4.6285 7.5535 115.4446 58.5410 40.5703 175.4645 33 Y 4.6893 7.5388 114.4738 55.7536 38.1007 172.7033 34 P 4.4752 0.0000 0.0000 62.9763 32.6566 175.7993 35 D 4.2740 8.4548 115.7732 55.3618 38.2836 175.3402 36 L 4.1205 7.8538 119.2011 53.8843 40.7524 176.5108 37 L 4.2072 7.8258 126.4225 56.4638 42.6296 176.1115 38 F 4.8685 6.6725 110.8506 55.5266 40.3856 172.7477 39 H 4.5612 9.1731 120.8436 55.4493 29.9818 174.1416 40 P 4.3592 0.0000 0.0000 65.2010 31.5529 176.0465 41 L 4.0827 7.3767 121.6689 55.3253 42.2015 174.3318 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 M 8.16 4.63 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 2 K 7.99 3.85 0.00 1.73 1.83 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.50 7.81 3 H 8.22 4.30 0.00 3.27 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 F 8.43 4.39 0.00 3.18 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 5 L 8.00 4.09 0.00 1.97 1.73 0.99 1.05 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 6 T 7.86 4.06 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 7 Y 8.35 4.12 0.00 2.91 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 8 L 7.26 3.60 0.00 1.47 1.48 0.86 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.29 4.40 0.00 3.99 3.83 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 10 T 7.42 3.90 4.19 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 11 A 8.68 3.88 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 12 P 0.00 4.20 0.00 2.26 2.31 0.00 3.61 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 2.01 2.01 0.00 13 V 7.62 3.46 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 0.78 0.00 0.00 0.47 0.00 0.00 14 L 7.77 3.96 0.00 1.66 1.63 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.14 4.08 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.16 3.93 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 17 I 7.87 3.66 2.12 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 1.43 1.11 1.03 0.00 0.00 18 W 8.79 4.49 0.00 3.40 3.09 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 0.00 0.00 0.00 0.00 19 M 8.32 3.92 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 20 T 8.19 3.83 4.38 0.00 0.00 0.00 0.00 0.00 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 21 I 7.60 3.63 1.70 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.89 0.68 0.00 0.00 22 T 7.64 3.53 4.10 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 1.02 0.00 0.00 23 A 8.18 3.96 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 24 G 8.07 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.67 3.70 1.94 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.74 0.89 0.00 0.00 26 L 7.80 4.02 0.00 1.87 1.68 0.84 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.12 3.67 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.65 0.85 0.00 0.00 28 E 8.56 3.81 0.00 1.95 1.85 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 2.43 2.42 0.00 29 F 8.60 4.02 0.00 3.32 3.09 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 0.00 0.00 0.00 0.00 30 N 8.07 4.69 0.00 3.09 2.89 0.00 0.00 7.02 7.09 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 31 R 7.44 3.92 0.00 1.56 1.48 0.00 3.11 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.50 0.00 32 F 7.55 4.63 0.00 2.70 2.21 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 33 Y 7.54 4.69 0.00 2.62 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 34 P 0.00 4.48 0.00 2.03 1.99 0.00 3.79 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 2.00 2.41 0.00 35 D 8.45 4.27 0.00 2.74 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 36 L 7.85 4.12 0.00 1.67 1.63 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.83 4.21 0.00 1.49 1.46 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 38 F 6.67 4.87 0.00 3.12 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 39 H 9.17 4.56 0.00 3.26 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.36 0.00 2.06 2.15 0.00 3.56 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.14 0.00 41 L 7.38 4.08 0.00 2.01 1.68 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00