NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1R S 4.3675 8.3344 115.2969 57.8440 62.9992 172.9132 1Q E 4.0577 8.7898 129.9725 54.9898 29.8572 173.8927 1P Y 4.6186 8.5816 126.7315 55.8508 42.7652 173.0750 1O Q 4.3100 7.7669 128.0021 54.1784 30.0478 175.1945 1N T 4.2198 8.3804 122.3786 64.0642 69.0897 173.6704 1M F 4.3930 9.6544 126.0356 58.0942 41.4613 175.3298 1L F 4.4890 8.0885 117.9572 55.6419 40.7647 174.3414 1K N 4.8222 8.4497 120.4781 51.2645 39.1892 173.6830 1J P 5.0410 0.0000 0.0000 64.1437 31.5151 178.1058 1I R 4.0948 8.2407 119.3242 58.5483 30.3163 176.6960 1H T 4.4892 7.8866 105.5411 61.8820 70.6251 174.9140 1G F 4.2595 8.6200 123.8643 58.4075 40.2084 175.8875 1F G 3.7238 7.9793 106.4697 44.3637 0.0000 172.2303 1E S 4.9961 8.0669 112.7104 56.9885 64.9426 173.0028 1D G 3.9920 9.0507 109.9859 46.3563 0.0000 176.0529 1C E 4.0480 9.0310 120.6949 59.3261 29.9058 178.2812 1B A 4.1434 8.3277 119.8221 55.1036 18.2713 177.6539 1A D 4.8414 7.7872 113.0714 53.8178 41.4424 175.7112 1 C 4.2399 7.7225 112.6604 59.0310 29.8189 174.4355 2 G 3.8396 8.7235 108.7261 45.5522 0.0000 173.1979 3 L 4.5563 7.1150 119.6565 52.7954 42.8186 176.3315 4 R 4.2978 8.9811 124.3445 54.8798 30.7952 175.8808 5 P 4.2113 0.0000 0.0000 65.6454 31.4035 177.1311 6 L 4.2995 7.8424 114.2427 54.5407 41.5350 176.7105 7 F 4.6743 7.1288 115.5417 58.2806 42.4035 176.4595 8 E 4.0414 8.8147 120.8250 59.9788 30.0506 179.8922 9 K 4.1601 8.1922 116.1771 58.3856 32.1320 177.8450 10 K 4.5020 7.6246 116.2587 55.3707 32.8636 175.7651 11 S 3.8245 7.9655 113.1187 59.8080 60.8475 172.1581 12 L 4.8840 8.2556 118.3697 52.9549 44.4400 176.1702 13 E 4.9698 8.5692 121.0962 54.4618 31.8193 175.7870 14 D 4.8358 9.1037 122.3755 52.3983 40.3980 177.5593 14A K 3.9305 8.5469 118.7479 59.1040 32.2307 178.0595 14B T 4.6387 7.8424 105.7509 59.8702 70.6175 175.3838 14C E 3.9413 8.9455 123.0375 59.6459 29.2893 179.0356 14D R 3.8254 7.9095 119.4963 59.2295 29.9282 177.6590 14E E 3.8749 7.8628 118.3404 59.2617 29.6957 178.7747 14F L 3.8598 7.5131 118.3381 57.7093 42.0399 178.9790 14G L 3.3588 7.3646 118.1347 57.8618 41.6961 179.3531 14H E 4.1413 7.8816 115.7115 57.7654 29.4254 177.6538 14I S 4.3930 7.5062 113.0858 59.3146 64.3170 174.6065 14J Y 4.7378 6.9617 121.6531 56.9181 36.1294 175.3302 14K I 4.0617 7.5985 114.0352 61.0145 40.0613 178.4021 14L D 4.1422 8.3404 119.4876 54.1083 38.4639 173.3814 14M G 3.6043 8.4459 101.9291 43.6204 0.0000 173.0446 15 R 4.1847 8.3226 122.9885 56.2501 30.3010 176.3105 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 1R S 8.33 4.37 0.00 3.88 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 1Q E 8.79 4.06 0.00 2.08 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 2.30 2.38 0.00 1P Y 8.58 4.62 0.00 2.91 2.82 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 1O Q 7.77 4.31 0.00 1.90 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.13 2.27 0.00 1N T 8.38 4.22 4.26 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 1.32 0.00 0.00 1M F 9.65 4.39 0.00 2.54 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 1L F 8.09 4.49 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1K N 8.45 4.82 0.00 2.79 2.74 0.00 0.00 6.60 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 1J P 0.00 5.04 0.00 2.33 2.42 0.00 3.97 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 1I R 8.24 4.09 0.00 1.83 2.03 0.00 3.21 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 1.63 0.00 1H T 7.89 4.49 4.31 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 1.25 0.00 0.00 1G F 8.62 4.26 0.00 2.96 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E S 8.07 5.00 0.00 4.01 3.89 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 0.00 0.00 0.00 1D G 9.05 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 0.00 0.00 0.00 1C E 9.03 4.05 0.00 2.55 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.68 0.00 1B A 8.33 4.14 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.84 0.00 2.75 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 4.24 0.00 3.02 2.92 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 2 G 8.72 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 0.00 0.00 0.00 3 L 7.12 4.56 0.00 1.72 1.63 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 4 R 8.98 4.30 0.00 2.19 2.06 0.00 3.13 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 5 P 0.00 4.21 0.00 2.05 2.13 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 6 L 7.84 4.30 0.00 1.46 1.24 0.89 0.65 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 7 F 7.13 4.67 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.81 4.04 0.00 2.13 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 0.00 2.44 2.46 0.00 9 K 8.19 4.16 0.00 1.95 1.88 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.60 1.57 7.81 10 K 7.62 4.50 0.00 1.61 1.71 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.61 7.81 11 S 7.97 3.82 0.00 4.03 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.88 0.00 1.51 1.55 0.78 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.57 4.97 0.00 1.98 1.98 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 2.27 2.30 0.00 14 D 9.10 4.84 0.00 2.60 1.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 3.93 0.00 1.76 1.93 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.41 7.81 14B T 7.84 4.64 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 1.19 0.00 0.00 14C E 8.95 3.94 0.00 2.12 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 2.52 2.29 0.00 14D R 7.91 3.83 0.00 1.91 1.93 0.00 3.21 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 14E E 7.86 3.87 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 14F L 7.51 3.86 0.00 1.86 1.48 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 14G L 7.36 3.36 0.00 1.57 1.63 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14H E 7.88 4.14 0.00 1.88 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 2.28 2.43 0.00 14I S 7.51 4.39 0.00 3.96 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 14J Y 6.96 4.74 0.00 3.01 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 14K I 7.60 4.06 1.89 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 1.51 0.57 0.96 0.00 0.00 14L D 8.34 4.14 0.00 2.96 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14M G 8.45 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.32 4.18 0.00 1.81 1.84 0.00 3.25 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00