NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9837 8.2127 109.7414 45.3590 0.0000 173.5671 2 I 3.4574 8.2813 117.5293 63.1347 37.6076 173.4294 3 V 3.4775 8.3839 120.0333 66.1464 31.8119 177.3221 4 E 3.9941 8.0738 116.3659 59.4331 28.0366 178.9578 5 Q 4.1691 8.1826 118.0675 58.6670 28.7975 177.2225 6 C 4.5292 8.4694 115.4335 58.0410 40.7546 174.3751 7 C 4.2232 7.9716 117.4700 61.2119 28.8249 175.3878 8 T 4.0948 7.9970 109.4310 63.8496 68.7711 174.6092 9 S 4.6976 7.2373 112.5407 55.3579 66.2354 173.3494 10 I 3.7537 8.1964 121.6326 61.3030 38.2361 176.1828 11 C 4.7581 8.5964 125.4609 56.1877 38.7781 174.3812 12 S 4.4456 9.2419 119.8387 57.7947 64.5701 175.0385 13 L 3.8866 8.5854 123.9012 59.0625 41.1340 178.6638 14 Y 4.1919 8.1348 118.4112 60.7990 38.4976 177.9136 15 Q 3.8727 7.8393 117.6164 58.8796 29.0929 178.3963 16 L 4.2502 7.9230 119.8842 58.1609 41.6534 179.3266 17 E 3.9170 8.4373 118.3573 59.5159 29.1012 178.8548 18 N 3.8016 7.1568 115.2172 56.3628 38.9191 174.7236 19 Y 4.3200 7.7853 114.8872 57.8864 38.8673 175.8363 20 C 4.3591 7.9608 118.2602 59.7454 28.8888 173.2451 21 N 4.5145 8.5483 119.2417 53.7934 38.6100 174.5894 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 8.21 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.28 3.46 1.22 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.77 0.70 0.00 0.00 3 V 8.38 3.48 2.06 0.00 0.00 0.00 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 0.88 0.00 0.00 4 E 8.07 3.99 0.00 1.96 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 2.32 2.46 0.00 5 Q 8.18 4.17 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 6 C 8.47 4.53 0.00 2.93 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 7 C 7.97 4.22 0.00 3.14 2.96 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 0.00 0.00 0.00 8 T 8.00 4.09 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 1.30 0.00 0.00 9 S 7.24 4.70 0.00 3.93 3.82 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 10 I 8.20 3.75 1.88 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 1.42 0.82 0.92 0.00 0.00 11 C 8.60 4.76 0.00 3.01 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 12 S 9.24 4.45 0.00 4.09 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 3.89 0.00 1.81 1.81 0.96 0.81 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 14 Y 8.13 4.19 0.00 3.06 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 15 Q 7.84 3.87 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 16 L 7.92 4.25 0.00 1.94 1.77 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.44 3.92 0.00 2.16 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 2.38 0.00 18 N 7.16 3.80 0.00 2.41 2.54 0.00 0.00 7.15 7.42 0.00 0.00 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 7.79 4.32 0.00 3.14 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 20 C 7.96 4.36 0.00 3.01 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 8.55 4.51 0.00 2.65 2.67 0.00 0.00 6.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00