NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2542 8.2649 123.5721 50.8185 19.9555 176.3501 2 P 3.9340 0.0000 0.0000 62.4113 31.5475 175.8025 3 S 4.1768 8.0272 117.4716 60.6380 64.1402 174.1158 4 Y 4.5563 6.7800 117.6765 55.6638 39.1416 175.0432 5 S 4.4299 8.4556 116.4854 57.4493 63.6185 172.9050 6 P 4.6510 0.0000 0.0000 61.4799 32.0269 174.4072 7 P 4.4398 0.0000 0.0000 61.8957 31.9039 174.7025 8 P 4.4321 0.0000 0.0000 61.7562 31.9445 174.7579 9 P 4.3993 0.0000 0.0000 61.8831 31.9423 174.9209 10 P 4.4179 0.0000 0.0000 63.1893 31.1896 176.2000 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 A 8.26 4.25 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 3.93 0.00 1.30 0.88 0.00 3.52 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.98 0.00 3 S 8.03 4.18 0.00 3.85 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 6.78 4.56 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.46 4.43 0.00 3.95 3.88 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.65 0.00 2.21 2.08 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 7 P 0.00 4.44 0.00 2.21 2.11 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 8 P 0.00 4.43 0.00 2.07 2.03 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 9 P 0.00 4.40 0.00 2.04 1.99 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 10 P 0.00 4.42 0.00 2.17 2.04 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00