NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.3460 8.1844 120.6389 54.1844 42.8721 176.6383 2 F 3.8366 8.0551 120.6355 58.1206 40.3429 172.5359 3 R 4.3056 8.1575 127.7349 55.0896 31.6913 175.7748 4 L 4.8605 8.3066 122.7780 53.5871 43.5889 176.9306 5 R 4.2388 8.6552 119.8292 58.8622 30.4964 176.2955 6 H 4.9373 7.7021 110.0038 53.6911 31.9322 172.3066 7 F 4.4932 8.7835 122.2813 57.3007 39.1606 173.8889 8 P 4.2748 0.0000 0.0000 64.1069 31.4467 175.6143 9 C 4.5169 6.4202 118.2300 57.8281 33.2381 172.9963 10 G 3.9648 8.4765 110.3700 45.8345 0.0000 172.7568 11 N 4.7053 8.0542 117.3193 51.4173 37.8571 174.0730 12 V 4.4547 7.8328 121.8763 59.5492 34.2602 176.5161 13 N 4.5310 8.1473 120.7282 50.4609 36.1154 172.6577 14 Y 4.2107 6.5939 120.5774 59.1928 38.3490 175.3425 15 G 3.9579 8.3664 111.1605 46.8545 0.0000 172.3461 16 Y 4.2247 8.0991 118.5822 56.6199 38.6144 175.6380 17 Q 4.4222 8.6904 121.9772 55.8688 29.4151 175.0814 18 Q 4.4371 7.7124 119.5669 54.5534 30.5432 174.9569 19 Q 4.1375 8.7130 123.1878 56.7181 28.9348 176.3910 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 L 8.18 4.35 0.00 1.67 1.74 0.95 0.54 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 2 F 8.06 3.84 0.00 3.10 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 3 R 8.16 4.31 0.00 1.47 1.71 0.00 3.23 0.00 0.00 3.06 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 4 L 8.31 4.86 0.00 1.75 1.70 0.97 1.09 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 5 R 8.66 4.24 0.00 1.91 2.05 0.00 3.24 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 6 H 7.70 4.94 0.00 3.27 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.78 4.49 0.00 3.06 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 8 P 0.00 4.27 0.00 2.02 2.00 0.00 3.25 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 9 C 6.42 4.52 0.00 2.51 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 0.00 0.00 0.00 0.00 10 G 8.48 3.96 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 0.00 0.00 0.00 11 N 8.05 4.71 0.00 2.71 2.78 0.00 0.00 6.67 7.68 0.00 0.00 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 V 7.83 4.45 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.82 0.00 0.00 13 N 8.15 4.53 0.00 2.79 2.80 0.00 0.00 6.08 7.55 0.00 0.00 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 Y 6.59 4.21 0.00 3.03 2.91 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 15 G 8.37 3.96 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 0.00 0.00 0.00 16 Y 8.10 4.22 0.00 2.92 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 17 Q 8.69 4.42 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 18 Q 7.71 4.44 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.07 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 19 Q 8.71 4.14 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.41 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00