NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.2414 8.2393 119.7055 56.3175 30.4201 174.7135 4 S 4.4781 7.6444 121.0294 55.8304 65.1240 173.9347 5 L 3.9789 8.2881 120.0393 57.7417 42.2135 180.1511 6 S 4.2624 7.9669 111.2198 58.9527 63.5920 175.1038 7 G 3.9445 7.7983 109.4532 45.0094 0.0000 173.6030 8 L 4.5141 7.5898 119.6873 54.2385 42.8960 176.1254 9 T 4.5756 8.8097 111.9232 60.5363 71.7788 175.5181 10 E 3.8723 8.7133 122.3954 59.7698 29.4584 179.1917 11 E 4.0341 8.0919 118.1518 59.1812 29.5382 178.8840 12 E 3.9560 8.1535 118.5580 59.1057 29.4442 178.9435 13 A 3.9821 8.2568 121.1899 55.5546 18.6016 179.8031 14 I 3.6354 7.8049 117.8318 64.3333 36.9962 178.7043 15 A 4.0018 7.9709 121.7401 55.0339 18.2265 179.7701 16 V 3.5237 8.0561 117.0413 66.6367 31.7330 177.6868 17 H 4.0517 8.5323 118.0734 59.1658 29.4734 176.7772 18 D 4.3163 7.9618 119.5756 57.4781 41.1027 178.0659 19 Q 4.0619 7.9990 119.7325 58.7200 28.9407 177.8284 20 F 3.9284 8.4532 122.1199 61.3265 39.5534 177.0321 21 K 4.1765 8.3303 118.0615 60.0592 31.8386 179.4196 22 T 3.9021 7.7993 115.3567 67.0943 68.5239 177.0215 23 T 3.8856 8.2062 117.7645 66.5732 68.3810 176.5620 24 F 4.1833 8.6392 123.0477 61.5365 39.3999 177.4349 25 S 4.0577 8.3579 114.5269 61.3727 62.5768 176.5166 26 A 4.0004 7.9757 123.7011 54.8395 17.9870 179.4300 27 F 4.0883 8.2464 119.1634 61.6570 39.5570 177.3005 28 I 3.1530 7.6182 119.8550 64.2691 36.8565 178.5049 29 I 3.7125 7.6396 113.8133 63.8254 37.5394 178.3423 30 L 3.9494 7.8946 120.6060 57.3570 41.3912 179.2766 31 A 3.8351 7.9896 121.0436 54.8431 18.2249 179.5242 32 A 3.8557 7.9203 119.3499 55.2159 18.4721 179.9444 33 V 3.5277 7.8721 116.5133 66.1682 31.7140 178.0022 34 A 4.0522 8.0817 120.3871 55.7072 18.1640 179.3919 35 H 4.3306 8.5854 114.6730 58.8156 28.6568 178.3194 36 V 3.7251 7.9897 120.2237 66.0777 31.3080 177.9588 37 L 4.0859 8.1391 118.7742 57.9179 41.4874 179.8699 38 V 3.9339 7.9949 117.5574 65.9913 31.3956 177.7808 39 W 4.1065 8.6603 126.9028 60.6450 30.5301 177.7503 40 V 3.8494 8.3138 117.7079 65.5315 31.0162 177.4799 41 W 4.7387 7.9137 127.5736 59.0939 31.3375 176.1745 42 K 3.8353 8.1904 118.5387 54.3363 32.8629 172.3216 43 P 2.9700 0.0000 0.0000 61.8710 31.3250 176.8073 44 W 4.4948 7.0492 116.5013 56.2618 28.7990 176.1924 45 F 4.7693 6.8099 123.1808 58.1014 39.3956 174.4544 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 3 R 8.24 4.24 0.00 1.81 1.99 0.00 3.32 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 4 S 7.64 4.48 0.00 3.98 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 5 L 8.29 3.98 0.00 1.64 1.76 0.91 0.83 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 6 S 7.97 4.26 0.00 3.96 3.97 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 7 G 7.80 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 0.00 0.00 0.00 8 L 7.59 4.51 0.00 1.74 1.58 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.81 4.58 4.24 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 10 E 8.71 3.87 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 11 E 8.09 4.03 0.00 2.10 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 2.40 2.45 0.00 12 E 8.15 3.96 0.00 2.28 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 13 A 8.26 3.98 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 14 I 7.80 3.64 2.01 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 1.45 1.03 0.93 0.00 0.00 15 A 7.97 4.00 1.41 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 0.00 0.00 0.00 0.00 0.00 16 V 8.06 3.52 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 1.07 0.00 0.00 0.96 0.00 0.00 17 H 8.53 4.05 0.00 3.32 3.31 0.00 5.83 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.96 4.32 0.00 3.12 2.80 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 19 Q 8.00 4.06 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 20 F 8.45 3.93 0.00 3.23 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.33 4.18 0.00 2.07 1.96 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 22 T 7.80 3.90 4.44 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 1.24 0.00 0.00 23 T 8.21 3.89 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 1.15 0.00 0.00 24 F 8.64 4.18 0.00 2.86 3.23 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 0.00 25 S 8.36 4.06 0.00 4.22 3.93 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 26 A 7.98 4.00 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 27 F 8.25 4.09 0.00 2.99 3.08 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 0.00 0.00 0.00 0.00 28 I 7.62 3.15 1.59 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.36 0.74 0.00 0.00 29 I 7.64 3.71 1.82 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 1.49 0.82 0.95 0.00 0.00 30 L 7.89 3.95 0.00 1.79 1.71 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.99 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.92 3.86 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 33 V 7.87 3.53 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 1.01 0.00 0.00 0.97 0.00 0.00 34 A 8.08 4.05 1.41 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 0.00 0.00 0.00 0.00 0.00 35 H 8.59 4.33 0.00 3.51 3.70 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 7.99 3.73 2.31 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 1.20 0.00 0.00 1.01 0.00 0.00 37 L 8.14 4.09 0.00 1.98 1.78 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.99 3.93 2.40 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 1.21 0.00 0.00 1.10 0.00 0.00 39 W 8.66 4.11 0.00 3.51 3.31 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 40 V 8.31 3.85 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.07 0.00 0.00 41 W 7.91 4.74 0.00 3.22 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.19 3.84 0.00 0.79 0.74 0.00 1.32 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.90 0.81 7.81 43 P 0.00 2.97 0.00 1.10 0.49 0.00 3.35 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.38 0.00 44 W 7.05 4.49 0.00 3.04 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.81 4.77 0.00 3.35 2.99 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