NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9971 8.2127 109.7415 45.5770 0.0000 174.2667 2 I 3.2200 8.0509 117.8283 63.0389 37.7344 173.8690 3 V 3.4989 7.7441 119.0924 65.7205 31.9262 176.9592 4 E 3.9010 8.0750 118.6301 59.5482 29.3030 178.7458 5 Q 4.0567 8.0700 116.8924 58.3044 28.8846 176.9223 6 C 4.7791 8.3402 115.5006 56.8957 41.9310 174.2258 7 C 4.4361 7.9906 119.2539 61.4637 32.3737 175.0385 8 T 3.9320 8.0142 114.2338 66.4515 68.1609 174.7100 9 S 4.7128 7.6878 115.0434 57.0268 65.1570 172.9135 10 I 4.4293 8.0867 121.5704 59.9902 38.4669 174.3304 11 C 5.2097 8.5836 119.0073 53.4835 41.1295 173.7054 12 S 4.7084 8.6240 116.0143 56.6434 65.9485 174.8431 13 L 3.7850 8.1342 122.9034 58.7594 41.3328 178.6031 14 Y 4.1569 7.3112 114.8493 61.0301 38.1332 177.9499 15 Q 4.2648 8.1769 118.7276 59.0269 28.8443 178.7502 16 L 4.1722 8.0150 120.0356 57.8926 41.5152 179.4285 17 E 4.0666 8.4649 118.3899 59.1677 29.1297 178.8222 18 N 4.4337 7.9128 115.1108 55.1326 38.5193 175.1691 19 Y 4.5463 7.5926 116.2725 57.6248 38.7029 175.5861 20 C 4.4477 7.6272 118.4502 59.2961 29.0002 173.5769 21 N 4.5417 8.6323 119.0655 53.7267 38.1654 175.1585 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 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 3.22 0.56 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.15 0.63 0.00 0.00 3 V 7.74 3.50 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 1.04 0.00 0.00 0.87 0.00 0.00 4 E 8.07 3.90 0.00 2.07 2.08 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 2.38 2.41 0.00 5 Q 8.07 4.06 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 6 C 8.34 4.78 0.00 2.94 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 7.99 4.44 0.00 2.87 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 3.93 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 1.21 0.00 0.00 9 S 7.69 4.71 0.00 4.11 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.09 4.43 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 1.47 0.56 0.92 0.00 0.00 11 C 8.58 5.21 0.00 3.19 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 8.62 4.71 0.00 4.16 4.12 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 13 L 8.13 3.79 0.00 1.51 1.06 0.79 0.53 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 14 Y 7.31 4.16 0.00 3.07 3.03 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 15 Q 8.18 4.26 0.00 2.39 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 16 L 8.02 4.17 0.00 1.88 1.74 0.90 0.94 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 17 E 8.46 4.07 0.00 2.26 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 2.33 2.53 0.00 18 N 7.91 4.43 0.00 2.72 2.55 0.00 0.00 6.84 8.42 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 7.59 4.55 0.00 3.07 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 20 C 7.63 4.45 0.00 2.93 2.87 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 0.00 0.00 0.00 21 N 8.63 4.54 0.00 2.72 2.74 0.00 0.00 6.82 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