NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -7 M 4.3984 8.3049 118.1954 55.8026 32.5574 174.0718 -6 H 3.8620 8.9070 113.2309 55.4170 26.3289 173.8800 -5 H 4.0090 8.5592 118.6983 57.1754 31.0175 173.2099 -4 H 4.5982 8.2137 125.2868 55.0484 32.5380 171.8866 -3 H 4.4364 8.5098 124.4541 54.5007 28.8972 174.2430 -2 H 4.6469 8.3661 124.8608 55.7104 30.7648 174.1389 -1 H 4.7215 8.9248 122.1777 53.6255 32.1519 174.3353 0 A 3.9371 8.8685 127.2351 55.4501 18.2536 177.8798 1 M 4.4664 7.8804 112.5884 55.1281 32.0697 176.0205 2 E 4.2228 8.2545 119.1288 56.5502 31.0949 175.9235 3 E 4.9335 8.8053 120.9753 55.0051 32.5870 175.1968 4 V 4.7686 9.1745 117.5649 59.7717 36.6163 174.6769 5 T 5.1102 8.6515 117.2825 62.0477 71.3020 173.7625 6 I 4.5754 8.9232 127.6747 59.5626 39.7512 174.8059 7 K 4.6505 9.1080 127.4904 55.2454 33.5744 175.7512 8 A 4.9440 9.1504 129.1184 50.5662 20.7462 175.8670 9 N 4.9208 9.1426 122.0088 52.7858 39.6017 174.5943 10 L 4.8422 8.9937 125.7129 53.9765 43.5357 176.2444 11 I 4.6977 8.7309 124.5062 59.5800 40.3028 175.0398 12 F 5.1835 8.8879 125.6112 55.6744 40.9500 177.0335 13 A 4.0515 8.2717 121.2764 55.4965 18.2314 178.6238 14 N 4.6488 8.2792 110.3641 53.0922 37.4968 176.1076 15 G 4.0390 8.3761 108.6748 45.4000 0.0000 174.3786 16 S 4.6849 7.8414 114.5363 58.6480 64.5619 173.1376 17 T 5.3529 8.2372 109.8989 60.7428 72.4042 172.8114 18 Q 4.6014 8.8783 121.2299 55.6980 33.2020 172.7027 19 T 5.0912 8.7120 123.1384 62.0118 70.3245 173.7021 20 A 4.6324 9.0966 128.5679 50.0459 21.8567 174.5523 21 E 4.9539 8.4308 121.6870 54.7785 31.6442 175.4245 22 F 4.5723 9.1675 122.8926 55.5084 41.7183 174.5458 23 K 5.4368 9.4547 122.4891 53.2134 34.8345 177.5661 24 G 3.7832 8.2402 109.2775 45.6037 0.0000 172.0518 25 T 4.6813 7.8529 113.5580 60.6681 71.0697 175.0054 26 F 3.9446 9.3789 123.7742 61.5637 39.3423 177.2123 27 E 3.8895 8.2667 117.5759 59.4379 29.2985 179.4110 28 K 3.9884 8.2357 118.2975 59.1997 32.1187 179.3580 29 A 3.9712 8.1452 121.3000 55.3178 18.3812 179.8059 30 T 3.2706 7.3758 114.1101 66.6338 68.5011 176.7146 31 S 4.1594 7.8158 114.9425 61.6044 62.3289 176.1453 32 E 3.9203 8.4200 121.3167 59.0171 29.1371 179.1689 33 A 2.0000 7.2456 120.8952 54.7014 18.2601 179.3801 34 Y 3.7855 7.1493 114.4393 60.8273 37.6305 178.4411 35 A 4.0622 7.7563 121.2643 55.2557 18.7773 178.7532 36 Y 4.2052 8.1556 118.0204 60.7303 38.8926 177.8602 37 A 4.0074 7.9430 121.7411 55.3495 18.3540 179.3118 38 D 4.7204 8.4026 117.6432 57.8146 40.7053 179.0618 39 T 4.0196 7.5465 108.6405 63.9066 69.1002 175.6689 40 L 4.2377 7.5974 120.7724 55.1116 41.9102 178.3643 41 K 4.7721 7.8767 121.8433 58.8658 31.9422 178.2719 42 K 3.8746 8.1109 118.9525 59.4676 32.1398 177.0670 43 D 4.6090 8.0061 115.8007 55.3382 41.4961 176.6836 44 N 4.7835 8.6706 114.6707 52.4460 40.0178 175.1034 45 G 4.4527 8.5511 105.7004 44.1854 0.0000 172.5816 46 E 4.5253 8.5197 116.2804 56.0632 30.7082 175.9929 47 W 5.1322 8.1091 117.7495 55.0976 31.1773 174.9128 48 T 4.8198 8.7505 117.0550 61.7725 71.9609 173.2829 49 V 5.0558 8.7134 124.7604 60.0420 34.3656 174.6069 50 D 4.9448 9.0067 122.8530 52.6029 43.7915 175.1959 51 V 4.5853 8.5930 123.5954 62.3707 33.0497 174.5046 52 A 4.6948 8.8339 127.5787 49.9428 23.7214 174.9971 53 D 4.1878 9.2480 115.1747 56.3104 38.2476 174.6258 54 K 3.8837 9.3666 109.5792 57.4431 30.0510 177.2094 55 G 4.0827 8.3640 107.1404 45.6400 0.0000 174.7632 56 Y 4.2693 8.2756 116.6823 59.0866 38.5852 174.8469 57 T 5.0605 7.8356 117.0637 61.5300 72.4038 172.6539 58 L 4.8172 9.1043 126.4951 53.0968 44.7021 175.6412 59 N 5.0780 9.1010 123.4008 52.2070 39.6530 174.2950 60 I 4.7376 8.4641 126.1307 59.3819 39.4803 174.7835 61 K 4.9661 8.9023 129.4446 54.6355 34.3486 174.6687 62 F 5.2855 9.2073 126.0907 55.9977 40.4985 176.7993 63 A 4.0146 9.1849 125.7212 52.8090 19.0344 177.8496 64 G 4.1145 8.3977 109.3280 45.9554 0.0000 173.3833 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 -7 M 8.30 4.40 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.49 0.00 -6 H 8.91 3.86 0.00 3.34 3.30 0.00 5.75 0.00 0.00 0.00 0.00 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -5 H 8.56 4.01 0.00 3.06 3.27 0.00 5.91 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 H 8.21 4.60 0.00 2.92 2.99 0.00 5.96 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 H 8.51 4.44 0.00 3.15 3.18 0.00 5.75 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 8.37 4.65 0.00 3.06 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.92 4.72 0.00 3.21 3.11 0.00 5.88 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 A 8.87 3.94 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 1 M 7.88 4.47 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 2 E 8.25 4.22 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 3 E 8.81 4.93 0.00 1.85 1.92 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 2.40 2.26 0.00 4 V 9.17 4.77 2.52 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 1.14 0.00 0.00 1.12 0.00 0.00 5 T 8.65 5.11 4.31 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 1.28 0.00 0.00 6 I 8.92 4.58 1.83 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.79 0.70 0.00 0.00 7 K 9.11 4.65 0.00 1.74 1.77 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 8 A 9.15 4.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.14 4.92 0.00 2.78 2.80 0.00 0.00 6.63 6.35 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 10 L 8.99 4.84 0.00 1.61 1.29 1.25 0.74 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 11 I 8.73 4.70 1.85 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 1.22 0.88 0.94 0.00 0.00 12 F 8.89 5.18 0.00 3.05 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 13 A 8.27 4.05 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 14 N 8.28 4.65 0.00 2.88 2.97 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.38 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 0.00 0.00 0.00 16 S 7.84 4.68 0.00 4.01 4.06 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 0.00 0.00 0.00 17 T 8.24 5.35 4.29 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 1.30 0.00 0.00 18 Q 8.88 4.60 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 19 T 8.71 5.09 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 1.27 0.00 0.00 20 A 9.10 4.63 1.04 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 0.00 0.00 21 E 8.43 4.95 0.00 1.70 1.80 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 2.20 2.24 0.00 22 F 9.17 4.57 0.00 2.90 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 23 K 9.45 5.44 0.00 1.58 1.69 0.00 1.85 0.00 0.00 2.35 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.19 7.81 24 G 8.24 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 25 T 7.85 4.68 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 26 F 9.38 3.94 0.00 3.09 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 27 E 8.27 3.89 0.00 2.13 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 2.43 2.58 0.00 28 K 8.24 3.99 0.00 1.87 1.85 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.51 7.81 29 A 8.15 3.97 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 30 T 7.38 3.27 4.08 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 0.00 0.00 0.00 1.00 0.00 0.00 31 S 7.82 4.16 0.00 3.95 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 32 E 8.42 3.92 0.00 2.18 2.04 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 2.35 2.44 0.00 33 A 7.25 2.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.15 3.79 0.00 3.13 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.76 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.16 4.21 0.00 3.21 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 4.01 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.40 4.72 0.00 3.03 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.55 4.02 4.20 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 1.34 0.00 0.00 40 L 7.60 4.24 0.00 1.68 1.37 0.70 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.88 4.77 0.00 2.12 2.02 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.78 1.57 7.81 42 K 8.11 3.87 0.00 1.78 1.85 0.00 1.82 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 1.44 1.49 7.81 43 D 8.01 4.61 0.00 2.63 2.64 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 0.00 0.00 0.00 0.00 44 N 8.67 4.78 0.00 2.76 2.91 0.00 0.00 6.97 6.97 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 45 G 8.55 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.52 4.53 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 47 W 8.11 5.13 0.00 2.70 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 0.00 0.00 0.00 48 T 8.75 4.82 4.23 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 1.21 0.00 0.00 49 V 8.71 5.06 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.11 0.00 0.00 50 D 9.01 4.94 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.59 4.59 2.18 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 0.92 0.00 0.00 1.05 0.00 0.00 52 A 8.83 4.69 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 53 D 9.25 4.19 0.00 2.95 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.37 3.88 0.00 2.05 1.94 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.47 7.81 55 G 8.36 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.28 4.27 0.00 3.32 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 7.84 5.06 4.45 0.00 0.00 0.00 0.00 0.00 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 58 L 9.10 4.82 0.00 1.37 1.45 0.17 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 59 N 9.10 5.08 0.00 2.81 2.78 0.00 0.00 6.46 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 60 I 8.46 4.74 1.73 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.78 0.30 0.00 0.00 61 K 8.90 4.97 0.00 1.74 1.61 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.55 7.81 62 F 9.21 5.29 0.00 3.18 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.18 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.40 4.11 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 0.00 0.00 0.00