NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1H T 4.2259 8.1593 117.3676 63.7789 68.6962 172.9581 1G F 4.4675 7.5377 123.0431 54.1828 38.1597 176.0131 1F G 3.6734 8.4327 123.2186 47.8270 0.0000 175.9130 1E S 3.9009 7.5552 108.6483 55.8329 66.9457 177.9412 1D G 4.1268 8.1530 100.4910 45.6072 0.0000 173.5967 1C E 3.5712 7.8756 123.0006 59.1664 30.0162 178.5809 1B A 3.9799 7.3206 119.2385 54.6647 18.7515 177.5271 1A D 4.8993 8.6366 114.1178 53.7758 41.9167 175.2522 1 C 4.3287 7.8529 112.4084 59.0839 29.9730 174.3775 2 G 3.8483 8.8393 109.1007 45.5874 0.0000 173.4979 3 L 4.5394 7.0557 118.7238 52.4737 42.0681 176.2210 4 R 4.1200 9.2092 124.5476 55.3974 30.8550 176.5038 5 P 4.2300 0.0000 0.0000 65.6016 31.4661 177.6023 6 L 4.4203 7.7888 114.4964 54.3445 42.3844 176.5038 7 F 4.7637 7.6284 115.3903 57.9064 41.0089 176.0839 8 E 4.0212 9.4408 125.7820 60.1717 30.4206 179.9700 9 K 4.0543 8.2104 117.2992 58.8707 32.1980 177.9579 10 K 4.3724 7.3283 113.3338 55.5931 31.9063 176.3693 11 S 3.8015 7.3896 112.0434 59.5180 60.9122 171.9165 12 L 4.6878 8.0132 119.3600 52.9832 43.1843 175.7551 13 E 4.7688 8.6224 123.9197 54.3997 30.7046 175.4553 14 D 4.7187 8.9992 125.9214 52.5101 40.3692 177.1665 14A K 3.7461 8.6684 119.7942 59.5652 32.1455 177.8732 14B T 4.6239 7.6888 105.2632 60.4260 69.6996 175.4402 14C E 3.9808 8.8388 123.5620 59.5966 29.3085 178.9935 14D R 3.8909 7.9321 119.6269 59.2056 29.9396 177.7743 14E E 4.0291 7.7616 118.2759 59.0071 29.9397 178.6978 14F L 3.9070 7.5527 118.6804 57.5752 42.0225 178.8227 14G L 3.9713 7.6963 120.2185 58.3103 41.7862 178.9119 14H E 4.0383 8.2229 118.0284 58.9892 29.4476 178.7461 14I S 4.3375 7.2308 111.7964 58.6225 63.2512 173.6758 14J Y 4.6413 6.9274 121.4914 57.7888 38.1107 175.5823 14K I 4.1618 8.2577 124.8588 61.8096 38.2694 174.6603 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 1H T 8.16 4.23 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 1.16 0.00 0.00 1G F 7.54 4.47 0.00 3.12 3.07 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 0.00 0.00 0.00 1F G 8.43 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 0.00 0.00 0.00 1E S 7.56 3.90 0.00 3.69 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D G 8.15 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C E 7.88 3.57 0.00 1.85 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 2.22 1.77 0.00 1B A 7.32 3.98 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 1A D 8.64 4.90 0.00 2.65 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.85 4.33 0.00 3.10 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 2 G 8.84 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 0.00 0.00 0.00 3 L 7.06 4.54 0.00 1.74 1.65 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.21 4.12 0.00 2.22 2.12 0.00 3.20 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 5 P 0.00 4.23 0.00 2.17 2.11 0.00 3.63 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 6 L 7.79 4.42 0.00 1.28 1.14 0.86 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.63 4.76 0.00 3.05 2.91 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 8 E 9.44 4.02 0.00 2.13 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 2.45 2.48 0.00 9 K 8.21 4.05 0.00 1.99 1.86 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.63 1.56 7.81 10 K 7.33 4.37 0.00 1.71 1.75 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.40 7.81 11 S 7.39 3.80 0.00 4.04 3.94 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 L 8.01 4.69 0.00 1.53 1.62 0.78 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.62 4.77 0.00 1.97 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 2.42 0.00 14 D 9.00 4.72 0.00 2.58 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 0.00 0.00 0.00 14A K 8.67 3.75 0.00 1.75 1.95 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.51 7.81 14B T 7.69 4.62 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 14C E 8.84 3.98 0.00 2.16 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.30 0.00 14D R 7.93 3.89 0.00 2.16 1.95 0.00 3.19 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 14E E 7.76 4.03 0.00 1.93 2.13 0.00 0.00 0.00 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 14F L 7.55 3.91 0.00 1.96 1.57 0.85 0.52 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 14G L 7.70 3.97 0.00 1.74 1.85 0.97 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 14H E 8.22 4.04 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 14I S 7.23 4.34 0.00 3.92 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14J Y 6.93 4.64 0.00 3.17 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 14K I 8.26 4.16 1.90 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 0.39 0.93 0.00 0.00