NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0134 8.2127 109.7466 45.2155 0.0000 173.9402 2 I 2.8786 7.9020 117.6038 62.8776 37.5350 172.8953 3 V 3.5182 8.3120 120.0831 65.9397 31.9850 177.2283 4 E 3.9557 8.0978 117.8596 59.5325 29.1392 179.0258 5 Q 4.1849 7.9890 116.5965 57.7665 29.1164 176.6986 6 C 4.7444 8.1344 115.6727 57.1129 41.7346 174.2838 7 C 4.3960 7.8359 119.2422 61.5708 32.1970 174.9959 8 T 3.9634 7.9893 114.3377 66.3997 68.4282 174.1474 9 S 4.8140 7.3830 114.3393 56.7663 64.5137 172.4412 10 I 4.7010 8.1563 118.7280 59.7324 40.2326 173.6036 11 C 5.2348 8.4866 117.9329 52.8709 43.7981 174.4709 12 S 4.5358 8.8306 117.3010 57.9020 65.1030 175.3320 13 L 4.1167 8.4593 120.7421 57.6830 41.0256 179.2905 14 Y 3.9562 8.1251 116.0912 61.0120 38.0734 177.6492 15 Q 4.2075 8.3305 119.0520 58.5597 28.8487 178.2975 16 L 4.2142 8.0297 121.7619 57.9555 42.2649 178.3418 17 E 4.0935 8.2558 118.7696 58.4645 29.2858 178.2537 18 N 4.3064 7.6403 115.8530 56.0716 38.5306 175.6106 19 Y 4.4249 7.6023 115.9491 57.3011 38.5372 175.3356 20 C 4.5043 7.2331 118.1014 58.8574 29.3272 173.5423 21 N 4.5287 8.6003 118.4871 53.7721 38.1113 175.2003 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 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.90 2.88 0.86 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.68 0.00 0.00 3 V 8.31 3.52 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 0.98 0.00 0.00 0.87 0.00 0.00 4 E 8.10 3.96 0.00 2.10 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 2.46 0.00 5 Q 7.99 4.18 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.74 0.00 6 C 8.13 4.74 0.00 3.05 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 4.40 0.00 2.89 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 8 T 7.99 3.96 4.43 0.00 0.00 0.00 0.00 0.00 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 9 S 7.38 4.81 0.00 3.84 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.70 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 1.48 0.80 0.93 0.00 0.00 11 C 8.49 5.23 0.00 3.10 3.24 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 0.00 12 S 8.83 4.54 0.00 4.26 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 13 L 8.46 4.12 0.00 1.74 1.60 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.13 3.96 0.00 2.93 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 15 Q 8.33 4.21 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 16 L 8.03 4.21 0.00 1.98 1.85 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.26 4.09 0.00 2.11 2.03 0.00 0.00 0.00 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 18 N 7.64 4.31 0.00 2.45 2.48 0.00 0.00 6.95 7.38 0.00 0.00 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 7.60 4.42 0.00 3.12 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 20 C 7.23 4.50 0.00 3.08 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 21 N 8.60 4.53 0.00 2.71 2.74 0.00 0.00 6.81 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