NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4552 8.2644 123.5827 51.5220 21.2155 175.8600 3 K 4.4381 7.4208 122.8673 56.1455 33.8604 175.4222 4 H 4.5862 10.1312 117.0459 55.4131 28.3240 176.1769 5 P 4.4414 0.0000 0.0000 63.6742 32.1115 175.6135 6 V 4.4867 7.7994 119.6700 60.6668 34.5108 172.2621 7 P 4.4362 0.0000 0.0000 62.5015 31.8830 176.5419 8 K 4.1635 8.5821 122.6893 58.3461 32.6340 176.9089 9 K 4.6306 7.5733 116.2732 53.8582 36.0187 175.6479 10 K 3.8032 8.7246 123.4026 57.3008 32.4830 175.8467 11 T 4.4573 8.1901 115.4018 60.0504 70.3351 175.3197 12 S 4.2103 8.6932 119.4785 59.0963 64.6079 175.4028 13 K 4.4013 8.5004 123.7051 59.6747 32.0021 178.1433 14 A 3.9314 8.1402 120.0046 56.1502 18.0873 179.6099 15 R 4.0498 9.1522 116.9164 59.6476 30.4000 177.8585 16 R 3.9072 9.2546 120.7115 58.0591 29.9038 177.7213 17 D 4.3719 8.8053 118.0185 57.8050 41.4128 179.5101 18 A 4.0531 8.6403 121.1580 55.1093 18.1200 179.6120 19 R 3.9134 8.0885 116.5078 58.6996 30.3168 177.8639 20 R 3.7582 8.1164 116.8176 55.6789 30.2072 177.7725 21 S 3.8040 7.3414 115.1624 61.6700 61.5180 175.0437 22 H 4.6838 7.7176 116.7582 56.5667 29.1650 176.5833 23 H 4.4915 9.0927 117.3017 58.4026 28.8316 175.4740 24 A 3.7167 6.9308 118.5687 50.1458 18.7974 176.3104 25 L 4.3256 8.3588 125.0487 54.0853 43.2323 175.5957 26 T 4.4354 8.2445 120.5917 59.3214 68.1456 172.3436 27 P 4.3866 0.0000 0.0000 61.6480 31.9643 174.3713 28 P 4.2398 0.0000 0.0000 63.7541 31.5035 175.2631 29 T 4.5295 8.3782 110.9028 60.6544 70.4026 173.5287 30 L 5.3451 8.4730 125.0785 53.0339 46.1005 175.8339 31 V 4.3188 8.9668 119.1642 60.4862 34.8324 173.9912 32 P 3.7883 0.0000 0.0000 64.2042 30.9957 172.2859 33 C 3.7033 7.7020 131.8442 58.5795 28.7664 172.6888 34 P 3.8618 0.0000 0.0000 65.7195 31.8297 177.8010 35 E 4.0564 7.8604 119.9244 58.6053 29.9305 178.2061 36 C 4.5224 7.5372 113.9322 56.5196 41.2028 175.5317 37 K 4.1537 8.5061 124.2997 56.9883 31.1197 175.0278 38 A 4.8603 7.4273 120.9512 51.3844 22.4875 176.6824 39 M 4.9808 8.4667 116.2841 53.8385 34.7804 175.9772 40 K 4.8088 9.0475 122.5537 53.4559 37.3429 173.9367 41 P 4.8475 0.0000 0.0000 61.9634 32.0315 173.8825 42 P 4.2111 0.0000 0.0000 65.0073 31.6461 175.8714 43 H 4.3783 9.6490 118.7827 56.1367 25.6519 174.7313 44 T 4.7755 7.4224 107.5804 59.5396 71.5853 173.6570 45 V 4.1441 8.3888 123.3637 62.9373 32.1098 174.9024 46 C 4.7571 8.1238 125.7927 58.3218 34.2388 173.8956 47 P 4.3479 0.0000 0.0000 63.7178 30.5638 174.6375 48 E 4.6453 10.1880 126.7659 57.2775 37.4300 179.1505 49 C 3.4425 9.5238 125.7167 58.7744 42.1698 176.4404 50 G 3.7621 8.3693 108.0630 46.4367 0.0000 174.7651 51 Y 4.8183 8.2872 117.9886 56.0158 41.6153 173.6034 52 Y 3.8705 8.9028 119.1028 57.2205 39.5366 176.7149 53 A 3.7823 8.6949 125.5845 52.6577 16.2810 175.9747 54 G 3.8037 7.4401 109.7547 45.2103 0.0000 172.3072 55 R 4.5638 8.5999 120.0019 54.0454 33.2953 176.7792 56 K 4.7466 6.8854 118.8943 57.6924 31.8563 174.7614 57 V 4.2301 7.5987 106.6880 60.5164 34.3721 174.1989 58 L 4.7562 7.3163 123.5495 52.8424 44.6845 176.0106 59 E 5.0983 7.8815 120.7053 56.2085 31.3090 176.7611 60 V 3.9845 8.3475 121.9123 63.0733 31.9221 174.5874 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 2 A 8.26 4.46 1.30 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 0.00 0.00 0.00 3 K 7.42 4.44 0.00 1.72 1.21 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.53 7.81 4 H 10.13 4.59 0.00 3.18 2.71 0.00 5.78 0.00 0.00 0.00 0.00 7.19 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 4.44 0.00 2.04 1.98 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 6 V 7.80 4.49 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.03 0.00 0.00 7 P 0.00 4.44 0.00 2.22 2.04 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 8 K 8.58 4.16 0.00 1.74 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.46 7.81 9 K 7.57 4.63 0.00 1.72 1.63 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.35 7.81 10 K 8.72 3.80 0.00 1.71 1.74 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.46 7.81 11 T 8.19 4.46 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 12 S 8.69 4.21 0.00 4.06 4.04 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 13 K 8.50 4.40 0.00 1.82 1.85 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.56 7.81 14 A 8.14 3.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.15 4.05 0.00 1.64 1.97 0.00 3.27 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 16 R 9.25 3.91 0.00 1.78 2.12 0.00 3.20 0.00 0.00 3.17 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 17 D 8.81 4.37 0.00 2.89 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 4.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.09 3.91 0.00 1.92 2.16 0.00 3.29 0.00 0.00 3.27 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 20 R 8.12 3.76 0.00 1.88 1.85 0.00 3.22 0.00 0.00 3.29 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.91 0.00 21 S 7.34 3.80 0.00 3.92 3.99 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 22 H 7.72 4.68 0.00 3.22 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 9.09 4.49 0.00 3.17 3.35 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 6.93 3.72 1.23 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 0.00 0.00 25 L 8.36 4.33 0.00 1.62 1.58 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.24 4.44 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 1.22 0.00 0.00 27 P 0.00 4.39 0.00 2.22 2.04 0.00 3.85 0.00 0.00 3.84 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 28 P 0.00 4.24 0.00 2.20 2.13 0.00 3.75 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 2.00 1.99 0.00 29 T 8.38 4.53 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 1.22 0.00 0.00 30 L 8.47 5.35 0.00 1.50 1.56 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.97 4.32 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 0.79 0.00 0.00 0.95 0.00 0.00 32 P 0.00 3.79 0.00 2.09 2.03 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 33 C 7.70 3.70 0.00 3.14 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.86 0.00 2.20 2.01 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 35 E 7.86 4.06 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 36 C 7.54 4.52 0.00 2.97 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 37 K 8.51 4.15 0.00 1.86 1.89 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.44 7.81 38 A 7.43 4.86 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 M 8.47 4.98 0.00 1.87 1.96 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 40 K 9.05 4.81 0.00 1.66 1.65 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.38 7.81 41 P 0.00 4.85 0.00 2.14 2.25 0.00 3.91 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.88 0.00 42 P 0.00 4.21 0.00 2.22 2.15 0.00 3.71 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 43 H 9.65 4.38 0.00 3.29 3.71 0.00 5.64 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.42 4.78 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 1.26 0.00 0.00 45 V 8.39 4.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.64 0.00 0.00 46 C 8.12 4.76 0.00 2.97 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.35 0.00 2.14 2.18 0.00 3.79 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 2.01 2.15 0.00 48 E 10.19 4.65 0.00 2.05 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 2.22 2.30 0.00 49 C 9.52 3.44 0.00 3.05 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.37 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.29 4.82 0.00 2.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.90 3.87 0.00 3.16 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 53 A 8.69 3.78 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.44 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.60 4.56 0.00 1.78 1.72 0.00 3.34 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 56 K 6.89 4.75 0.00 1.99 1.31 0.00 1.43 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.18 1.20 7.81 57 V 7.60 4.23 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 0.93 0.00 0.00 58 L 7.32 4.76 0.00 1.55 1.52 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.88 5.10 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 60 V 8.35 3.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.93 0.00 0.00