NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.4579 8.3449 118.3795 60.0591 28.4611 170.9788 2 R 3.6371 8.8857 127.6454 55.1520 29.5377 175.6372 3 K 3.8076 8.8306 124.9352 55.2430 33.2259 175.2482 4 A 3.7010 8.3678 122.6898 53.0797 18.4268 178.2677 5 G 4.3203 8.8819 107.7725 45.9101 0.0000 174.2228 6 V 4.5030 7.7436 108.9705 62.4152 38.6087 174.5739 7 G 3.7727 7.8215 110.3119 45.7838 0.0000 174.2139 8 Q 4.6875 8.3326 116.2915 57.7002 32.4621 177.0938 9 S 4.2193 8.2823 106.6763 58.8281 62.0891 174.7121 10 W 4.4272 8.4117 118.0050 59.0366 28.2152 175.9746 11 K 4.0995 6.6785 116.0697 56.5696 38.7007 174.1753 12 E 3.0548 5.9000 120.5356 57.0105 26.5994 173.2453 13 N 4.3993 7.7588 118.1655 53.6642 41.4581 173.9158 14 S 4.9371 7.9189 112.3243 56.1913 66.0459 172.4656 15 P 4.3521 0.0000 0.0000 63.4092 31.5611 176.9793 16 L 3.4603 9.0559 116.9175 56.3020 39.0531 173.5052 17 N 4.3187 8.0700 114.2031 54.8924 36.7303 176.3161 18 V 3.7295 7.7066 118.9094 65.3677 31.8639 175.8556 19 S 4.1820 7.4832 114.9782 58.6496 62.8045 173.7270 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 C 8.34 4.46 0.00 3.01 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 2 R 8.89 3.64 0.00 2.03 1.95 0.00 3.38 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.73 0.00 3 K 8.83 3.81 0.00 1.85 1.80 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.37 7.81 4 A 8.37 3.70 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.88 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.74 4.50 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.07 0.00 0.00 7 G 7.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.33 4.69 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.38 7.08 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 9 S 8.28 4.22 0.00 3.86 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.41 4.43 0.00 3.62 3.14 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 11 K 6.68 4.10 0.00 1.52 1.67 0.00 1.11 0.00 0.00 1.45 0.00 0.00 2.42 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.93 0.21 7.81 12 E 5.90 3.05 0.00 1.83 1.84 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 2.03 2.16 0.00 13 N 7.76 4.40 0.00 2.43 2.62 0.00 0.00 6.94 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 14 S 7.92 4.94 0.00 4.05 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 15 P 0.00 4.35 0.00 2.24 2.32 0.00 3.89 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.97 0.00 16 L 9.06 3.46 0.00 1.95 1.97 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.07 4.32 0.00 2.94 2.96 0.00 0.00 6.74 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.71 3.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.99 0.00 0.00 19 S 7.48 4.18 0.00 4.03 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00