NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.3106 8.1814 116.7954 59.5381 64.1288 174.6509 9 G 3.8101 8.9217 112.5298 45.2360 0.0000 172.4034 10 K 4.1707 8.1561 120.8820 55.9467 33.6188 175.0554 11 L 4.1889 8.2440 122.4355 54.3149 42.6641 176.2352 12 L 4.5184 7.9607 122.6398 52.9842 44.3940 174.9522 13 Y 5.1117 8.0230 119.2933 55.9081 41.6345 174.9487 14 C 4.5181 9.2704 123.7735 59.6660 32.2157 174.8367 15 S 4.3846 9.5581 122.9382 60.5775 62.8933 175.2729 16 F 4.4304 8.5808 118.4628 58.7841 39.5227 176.3028 17 C 4.6111 8.4268 111.8765 57.4505 30.9756 174.7588 18 G 4.0040 8.3189 108.5483 45.1090 0.0000 173.9589 19 K 4.4103 7.7539 119.5975 56.0648 33.0155 176.9460 20 S 4.5983 9.4189 117.8518 57.0790 64.0781 175.1989 21 Q 3.9757 7.8266 118.3028 58.6109 28.2055 176.9480 22 H 4.5886 7.4209 113.5754 56.5968 29.1100 175.4686 23 E 4.5063 7.9732 117.8354 56.1433 30.1247 175.5719 24 V 4.6085 7.1778 110.7762 59.1852 35.7849 176.0096 25 R 4.0937 8.7470 119.7258 58.9549 30.3908 177.3519 26 K 4.6523 8.6412 117.8535 54.6447 36.2481 174.6687 27 L 4.8961 8.4788 127.6483 53.4167 44.4210 175.3799 28 I 4.3731 9.0501 128.5023 60.4452 38.6618 174.8119 29 A 4.9280 8.7754 128.7772 50.5688 20.7185 176.3772 30 G 4.1404 8.4127 111.5412 43.0695 0.0000 170.9130 31 P 4.2315 0.0000 0.0000 62.9556 30.2794 176.2480 32 S 3.7132 8.4350 121.9283 58.4980 60.5028 172.7539 33 V 4.4106 6.5825 115.9013 60.9576 34.0278 171.8080 34 Y 5.4282 8.8334 117.9858 56.8387 42.9677 173.9988 35 I 5.1694 8.9186 121.5880 59.7994 42.0060 174.3720 36 C 5.5554 8.9775 123.8635 56.3040 31.8821 174.1943 37 D 4.3813 8.6866 118.9911 56.6614 38.7957 178.5306 38 E 4.1179 8.0771 119.5566 59.5372 29.4996 178.8789 39 C 4.1948 7.9879 116.2560 62.4553 28.2397 176.1476 40 V 3.4669 7.7511 120.2294 65.9151 30.9505 177.7443 41 D 4.3406 8.1457 118.7094 57.3036 40.6801 178.6000 42 L 3.9462 7.7675 120.6473 58.3606 42.0454 178.7207 43 C 4.1016 8.2468 116.9875 62.9043 27.9162 175.8787 44 N 4.3306 8.1791 118.0342 56.4649 38.1361 177.2056 45 D 4.3555 7.8463 120.2073 57.2960 40.6398 178.9500 46 I 3.7346 7.5354 119.5344 64.4193 37.1982 178.3114 47 I 3.8873 7.8772 119.8802 64.4165 37.1098 178.3763 48 R 4.0397 8.2593 117.0330 56.2266 30.9270 176.1231 49 E 3.8421 8.0459 117.7945 56.7036 27.3132 173.1211 50 E 4.7692 7.6364 113.4644 55.1299 33.2997 175.5435 51 I 4.1358 8.0823 118.8787 61.5866 37.9794 175.6905 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 8 S 8.18 4.31 0.00 3.90 3.86 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 9 G 8.92 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.16 4.17 0.00 2.01 1.74 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.47 1.28 7.81 11 L 8.24 4.19 0.00 1.52 0.99 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.96 4.52 0.00 1.13 0.69 0.76 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 8.02 5.11 0.00 2.76 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.27 4.52 0.00 3.07 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.56 4.38 0.00 3.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.58 4.43 0.00 3.03 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.43 4.61 0.00 3.11 3.11 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 0.00 0.00 0.00 18 G 8.32 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.75 4.41 0.00 1.89 1.78 0.00 1.70 0.00 0.00 1.90 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.48 7.81 20 S 9.42 4.60 0.00 3.50 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 21 Q 7.83 3.98 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.89 0.00 0.00 0.00 0.00 0.00 1.92 2.25 0.00 22 H 7.42 4.59 0.00 3.17 3.32 0.00 5.63 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 7.97 4.51 0.00 2.08 1.99 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 2.28 2.26 0.00 24 V 7.18 4.61 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.99 0.00 0.00 25 R 8.75 4.09 0.00 2.10 1.98 0.00 3.34 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 26 K 8.64 4.65 0.00 1.77 1.57 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.39 7.81 27 L 8.48 4.90 0.00 1.60 1.50 0.98 0.75 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 28 I 9.05 4.37 1.99 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 1.18 0.59 0.93 0.00 0.00 29 A 8.78 4.93 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.41 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.23 0.00 2.01 2.02 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 32 S 8.43 3.71 0.00 3.96 3.92 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 33 V 6.58 4.41 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 0.64 0.00 0.00 0.96 0.00 0.00 34 Y 8.83 5.43 0.00 3.12 2.88 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 35 I 8.92 5.17 1.90 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.06 0.89 0.00 0.00 36 C 8.98 5.56 0.00 3.14 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 37 D 8.69 4.38 0.00 2.88 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.08 4.12 0.00 2.04 2.04 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 2.40 2.40 0.00 39 C 7.99 4.19 0.00 3.02 2.78 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 40 V 7.75 3.47 2.20 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 0.99 0.00 0.00 0.93 0.00 0.00 41 D 8.15 4.34 0.00 2.93 2.69 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 42 L 7.77 3.95 0.00 1.78 1.82 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 43 C 8.25 4.10 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.18 4.33 0.00 2.93 2.85 0.00 0.00 7.01 7.61 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 45 D 7.85 4.36 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.54 3.73 2.01 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 1.52 0.65 0.91 0.00 0.00 47 I 7.88 3.89 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 1.51 0.61 0.90 0.00 0.00 48 R 8.26 4.04 0.00 1.81 2.12 0.00 3.39 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 49 E 8.05 3.84 0.00 2.11 1.99 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 2.40 2.40 0.00 50 E 7.64 4.77 0.00 2.01 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 2.17 2.32 0.00 51 I 8.08 4.14 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 1.27 0.68 0.91 0.00 0.00