NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0415 8.3544 109.7427 44.3686 0.0000 174.0649 2 I 3.9028 7.5929 115.5699 60.3233 41.1557 172.4778 3 V 3.4702 7.8328 119.4180 66.0528 32.2080 177.0297 4 E 4.1617 8.0569 117.3326 58.4736 29.5606 177.7183 5 Q 4.2154 7.7980 118.1912 58.3923 29.7911 177.1304 6 C 4.6749 8.5768 116.4451 57.2510 40.6880 174.2079 7 C 4.6868 8.3434 120.5765 59.3429 31.3316 173.7133 8 T 4.4928 7.9342 108.6074 62.6956 69.9326 176.1772 9 S 4.4800 7.7481 115.3617 57.5892 64.5197 169.9253 10 I 3.4615 7.8321 127.8039 60.3011 37.0058 174.6860 11 C 4.6730 8.5181 121.6867 56.3025 39.0000 173.6118 12 S 4.7534 8.4731 116.7030 57.3745 64.7622 175.3602 13 L 3.8932 8.4679 124.8507 58.9259 41.7358 178.6945 14 Y 4.1262 8.0419 115.9532 61.0646 37.3725 178.1504 15 Q 4.2291 8.1809 118.6753 58.9825 28.8897 178.6331 16 L 4.3776 8.1603 120.1983 57.7943 41.5461 179.1791 17 E 4.0278 8.0294 118.4778 59.5184 29.1308 178.9641 18 N 4.1355 7.6453 114.7273 56.2593 38.6574 175.5624 19 Y 4.2949 7.6671 113.6065 58.7818 38.5737 175.5549 20 C 4.1964 7.9218 120.4545 59.5014 32.2375 172.8816 21 N 4.5171 8.5682 120.9043 53.8329 38.5747 174.7989 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 G 8.35 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.59 3.90 1.37 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.48 0.77 0.00 0.00 3 V 7.83 3.47 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 1.03 0.00 0.00 0.88 0.00 0.00 4 E 8.06 4.16 0.00 1.99 1.97 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 2.29 2.36 0.00 5 Q 7.80 4.22 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 6 C 8.58 4.67 0.00 2.92 3.04 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 0.00 0.00 0.00 7 C 8.34 4.69 0.00 2.83 2.94 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 8 T 7.93 4.49 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 1.24 0.00 0.00 9 S 7.75 4.48 0.00 3.84 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 10 I 7.83 3.46 1.88 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 1.43 1.16 0.92 0.00 0.00 11 C 8.52 4.67 0.00 2.98 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 12 S 8.47 4.75 0.00 4.13 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 13 L 8.47 3.89 0.00 1.54 1.39 0.79 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.04 4.13 0.00 3.19 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 15 Q 8.18 4.23 0.00 2.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 16 L 8.16 4.38 0.00 1.89 1.78 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.03 4.03 0.00 2.23 2.02 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 2.31 2.29 0.00 18 N 7.65 4.14 0.00 2.24 2.46 0.00 0.00 6.89 7.29 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 19 Y 7.67 4.29 0.00 3.17 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 20 C 7.92 4.20 0.00 2.98 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 21 N 8.57 4.52 0.00 2.74 2.68 0.00 0.00 6.88 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00