NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 R 4.1363 8.2544 120.8562 56.1086 31.1170 174.6225 10 V 3.8340 8.0376 124.1935 60.1810 32.4789 172.9558 11 A 4.1648 8.9797 131.6743 51.7719 20.1581 175.8011 12 Y 4.7363 8.2604 119.1899 56.2705 40.2418 175.4390 13 K 4.6997 8.3102 120.2637 54.2376 35.6665 176.6135 14 L 4.1570 8.4910 123.2814 54.4491 42.4590 177.9099 15 K 4.1832 8.4548 122.0984 56.0254 34.0362 177.8889 16 E 3.8912 8.7580 123.3521 59.5253 29.6092 178.4614 17 N 4.1984 8.2843 116.1913 57.0731 39.0236 176.2125 18 A 4.1642 8.0545 121.1964 55.2197 18.3699 179.6880 19 K 3.9293 8.0519 116.7882 59.6597 32.1250 179.5287 20 L 4.0020 8.0371 119.2627 57.9360 41.4364 179.4617 21 E 3.9427 8.3574 118.4864 59.2588 29.3316 178.8967 22 N 4.2669 7.9334 116.5617 56.8565 39.0862 176.9839 23 I 3.7129 7.7263 121.1566 64.2278 37.0760 178.4475 24 V 3.5312 8.0395 119.0360 66.0665 31.4494 177.8891 25 A 3.9660 8.2155 120.5612 55.0791 18.1561 179.5342 26 R 3.7991 8.3862 117.5032 59.6336 30.2342 178.6598 27 L 3.9712 8.4116 119.0031 57.8806 41.6427 179.3434 28 E 3.9584 8.4581 118.7430 59.5218 29.4463 179.0416 29 N 4.3126 8.0926 116.7004 56.6012 38.9376 176.4133 30 D 4.3885 8.2530 120.4613 57.7384 40.9304 178.7178 31 N 4.3086 8.3053 116.4103 56.1357 38.5192 177.1739 32 A 4.1278 8.0290 122.0615 55.5716 18.4872 179.5215 33 N 4.3327 8.2621 114.6519 56.4280 38.6029 177.7780 34 L 4.1445 8.3507 120.8550 57.7306 41.5727 179.4086 35 E 4.0180 8.3683 118.9338 59.2171 29.3923 179.4772 36 K 3.9796 8.1766 118.6419 59.3444 32.0796 179.0462 37 D 4.3550 8.2942 119.3176 57.5105 40.8215 178.9626 38 I 3.6730 7.8421 119.8097 64.4048 37.1013 178.2745 39 A 4.1962 8.1863 121.6727 55.4700 18.0806 179.5023 40 N 4.3252 8.2737 114.8840 56.2093 38.4977 177.7943 41 L 3.9790 8.0237 120.5658 57.8755 41.7597 179.3255 42 E 3.9649 8.7551 118.8471 59.1826 29.3259 179.5606 43 K 3.9256 8.2316 118.5477 59.6463 32.1089 178.9092 44 D 4.3679 8.2980 119.2244 57.5672 40.7866 179.1619 45 I 3.6593 8.1090 120.1432 64.2410 36.9998 178.0327 46 A 4.1269 7.9572 121.6350 55.4951 18.1288 179.4794 47 N 4.2969 8.1064 114.5065 56.5592 38.8170 177.5607 48 L 3.9921 8.1454 120.5660 57.9518 41.4763 179.4696 49 E 3.9984 8.5251 117.9442 59.4497 29.7274 179.3667 50 R 4.0738 7.8062 116.2593 59.4069 29.3255 178.6295 51 D 4.4001 7.8891 118.7071 56.8327 40.8479 178.4458 52 V 3.9317 7.6019 110.6576 62.4120 31.9363 176.5476 53 A 4.3832 7.6451 125.1082 52.1750 18.9563 176.6469 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 9 R 8.25 4.14 0.00 1.77 1.88 0.00 3.14 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 10 V 8.04 3.83 1.88 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 0.47 0.00 0.00 0.86 0.00 0.00 11 A 8.98 4.16 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.26 4.74 0.00 3.00 2.88 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 13 K 8.31 4.70 0.00 1.72 1.69 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.37 7.81 14 L 8.49 4.16 0.00 1.65 1.62 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.45 4.18 0.00 1.80 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.51 7.81 16 E 8.76 3.89 0.00 2.08 1.96 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 2.38 2.44 0.00 17 N 8.28 4.20 0.00 2.79 2.82 0.00 0.00 7.03 7.71 0.00 0.00 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 A 8.05 4.16 1.33 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 0.00 0.00 0.00 19 K 8.05 3.93 0.00 2.02 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.64 7.81 20 L 8.04 4.00 0.00 1.85 1.72 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.36 3.94 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 22 N 7.93 4.27 0.00 2.78 3.03 0.00 0.00 7.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.73 3.71 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.63 0.91 0.00 0.00 24 V 8.04 3.53 2.26 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 1.10 0.00 0.00 0.96 0.00 0.00 25 A 8.22 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.39 3.80 0.00 1.85 2.09 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 27 L 8.41 3.97 0.00 1.87 1.70 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.46 3.96 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 29 N 8.09 4.31 0.00 2.92 2.93 0.00 0.00 7.25 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.25 4.39 0.00 2.99 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.31 4.31 0.00 2.91 2.87 0.00 0.00 6.98 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.03 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.26 4.33 0.00 2.88 2.88 0.00 0.00 7.14 6.08 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 34 L 8.35 4.14 0.00 1.89 1.71 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.37 4.02 0.00 2.24 1.99 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 2.33 2.45 0.00 36 K 8.18 3.98 0.00 1.97 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.71 7.81 37 D 8.29 4.35 0.00 2.88 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 38 I 7.84 3.67 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.95 0.00 0.00 39 A 8.19 4.20 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 N 8.27 4.33 0.00 2.91 2.87 0.00 0.00 7.04 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.02 3.98 0.00 1.88 1.71 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.76 3.96 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 43 K 8.23 3.93 0.00 2.02 1.85 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.63 7.81 44 D 8.30 4.37 0.00 2.85 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 45 I 8.11 3.66 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.67 0.91 0.00 0.00 46 A 7.96 4.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.11 4.30 0.00 2.94 2.87 0.00 0.00 7.08 6.84 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 48 L 8.15 3.99 0.00 1.81 1.72 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.53 4.00 0.00 2.10 2.02 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 2.35 2.45 0.00 50 R 7.81 4.07 0.00 1.99 2.19 0.00 2.78 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.62 0.00 51 D 7.89 4.40 0.00 2.79 2.78 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 52 V 7.60 3.93 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 0.72 0.00 0.00 1.00 0.00 0.00 53 A 7.65 4.38 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00