NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3567 8.2549 117.2788 56.1702 30.7221 172.5669 2 V 3.9201 7.2118 118.1213 56.8199 40.3000 171.8906 3 W 4.5408 7.4635 121.5000 55.9894 30.0780 174.6333 4 Y 4.7266 7.7648 118.1667 55.0032 39.6345 173.6006 5 P 4.2878 0.0000 0.0000 63.6073 30.7259 177.9502 6 Y 4.7087 8.5784 121.7764 58.6427 37.0502 175.3315 7 G 4.6844 8.0573 108.7164 46.0926 0.0000 174.7858 8 S 4.3664 8.7388 115.0961 58.7200 62.2895 178.0835 9 Y 4.8457 8.9511 129.3043 58.2059 39.2799 173.7742 10 L 4.0826 8.7870 119.7153 55.2767 41.5978 175.3810 11 T 3.7468 8.3408 114.0593 63.1520 66.5952 172.8254 12 A 4.7254 8.1263 129.8408 51.2509 22.3453 175.1593 13 S 4.5298 8.4428 110.9957 58.7061 65.0007 174.5148 14 G 3.9714 8.6262 110.0111 50.6465 0.0000 173.2869 15 S 4.3136 6.9177 117.3037 57.6969 62.1832 174.5691 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 R 8.25 4.36 0.00 1.92 1.99 0.00 3.01 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.58 0.00 2 V 7.21 3.92 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 0.53 0.00 0.00 0.98 0.00 0.00 3 W 7.46 4.54 0.00 3.43 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 7.76 4.73 0.00 2.94 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 5 P 0.00 4.29 0.00 1.76 0.60 0.00 3.43 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.04 0.00 6 Y 8.58 4.71 0.00 2.91 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 7 G 8.06 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.74 4.37 0.00 3.83 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 8.95 4.85 0.00 3.06 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 10 L 8.79 4.08 0.00 1.52 1.66 -0.31 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.34 3.75 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 12 A 8.13 4.73 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.44 4.53 0.00 3.80 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 14 G 8.63 3.97 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 0.00 0.00 0.00 15 S 6.92 4.31 0.00 3.95 3.87 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