NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2616 8.2544 119.7070 56.2185 32.1671 176.3316 2 C 4.3827 8.0557 116.9019 55.7782 44.1026 172.0134 3 C 5.0323 9.0243 122.9149 56.6058 36.6315 172.4608 4 H 4.9915 7.8408 119.0366 53.4083 32.6911 172.2458 5 P 4.2482 0.0000 0.0000 65.8441 31.5399 178.2254 6 Q 3.9861 8.7482 118.2320 59.3071 28.8534 175.8944 7 C 4.6193 8.0076 109.9507 55.4630 41.6487 173.7448 8 G 3.7834 8.1781 106.5872 46.4879 0.0000 174.2403 9 A 4.0375 8.0741 121.5827 52.4372 18.9444 177.7674 10 V 4.1585 8.4573 120.6597 64.1954 33.3223 175.8321 11 E 4.4657 7.8726 117.6815 54.9658 30.5729 175.8607 12 E 4.2928 8.4812 120.5423 56.0860 30.9754 177.3156 13 C 4.4482 8.5837 116.9519 57.2849 41.5163 173.7262 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 4.26 0.00 1.82 2.06 0.00 3.17 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 2 C 8.06 4.38 0.00 3.02 2.99 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 0.00 0.00 0.00 3 C 9.02 5.03 0.00 2.97 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 4 H 7.84 4.99 0.00 3.11 3.06 0.00 5.70 0.00 0.00 0.00 0.00 6.79 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 4.25 0.00 2.18 2.09 0.00 3.05 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 6 Q 8.75 3.99 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.57 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 7 C 8.01 4.62 0.00 3.09 3.15 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 0.00 0.00 0.00 0.00 8 G 8.18 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 4.04 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.46 4.16 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 0.87 0.00 0.00 0.93 0.00 0.00 11 E 7.87 4.47 0.00 1.99 1.85 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 2.27 2.28 0.00 12 E 8.48 4.29 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 13 C 8.58 4.45 0.00 2.98 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