NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.4063 8.0333 110.9478 61.4526 70.3633 174.6436 6 T 3.7414 8.4668 119.9496 66.0564 68.3466 175.0103 7 Y 4.1598 8.5262 122.9395 60.7701 39.4309 177.6149 8 A 3.8006 8.2758 121.5806 55.2889 18.2521 179.3732 9 D 4.2985 8.0366 116.3928 57.2643 41.0736 178.4230 10 F 4.4093 8.5002 121.5193 61.6034 39.2309 177.3993 11 I 3.2773 7.4608 117.5823 63.5900 36.8847 177.5387 12 A 4.1963 7.4730 119.5686 52.1354 18.8170 177.5900 13 S 4.2968 7.2850 112.5795 57.5534 63.9679 174.4565 14 G 3.9001 8.3652 107.9845 46.0522 0.0000 174.0760 15 R 4.6722 7.2997 117.9602 55.8708 30.8200 176.3450 16 T 4.0120 7.7928 107.3479 61.9473 69.9215 174.8223 17 G 3.9710 7.5387 110.9341 43.9956 0.0000 173.1507 18 R 3.9849 8.3814 118.0826 56.4291 30.4360 176.4701 19 R 4.5359 8.3218 121.2633 54.4271 31.5315 176.1846 20 N 4.5044 8.5981 120.4335 52.5666 39.3563 174.9976 21 A 4.1430 8.4667 124.7582 52.3362 19.1252 176.9773 22 I 4.5023 7.8423 113.9159 59.6052 40.2375 174.5232 23 H 4.8120 7.8498 114.6446 54.2285 30.7937 173.3767 24 D 4.5184 8.7227 119.6503 53.8827 39.1431 176.1429 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 5 T 8.03 4.41 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 6 T 8.47 3.74 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 7 Y 8.53 4.16 0.00 3.11 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.28 3.80 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.04 4.30 0.00 2.87 2.77 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 10 F 8.50 4.41 0.00 3.02 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 I 7.46 3.28 1.45 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 -0.20 0.73 0.00 0.00 12 A 7.47 4.20 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.28 4.30 0.00 3.92 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 14 G 8.37 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 0.00 0.00 0.00 15 R 7.30 4.67 0.00 1.82 1.93 0.00 3.16 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 16 T 7.79 4.01 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 17 G 7.54 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 18 R 8.38 3.98 0.00 1.82 1.90 0.00 3.20 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 19 R 8.32 4.54 0.00 1.81 1.88 0.00 3.25 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.84 0.00 20 N 8.60 4.50 0.00 2.71 2.74 0.00 0.00 7.09 7.35 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 21 A 8.47 4.14 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.84 4.50 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.62 0.90 0.00 0.00 23 H 7.85 4.81 0.00 3.21 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.72 4.52 0.00 2.80 2.72 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 0.00 0.00 0.00 0.00