NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2618 8.3044 120.3490 55.6095 32.1930 174.9988 2 H 4.3440 8.6148 127.3606 54.5497 28.9246 172.5844 3 L 4.7699 7.8798 126.9972 52.5142 44.5832 177.2499 4 T 4.0554 8.5664 115.2229 60.7226 71.0193 173.4792 5 P 4.1879 0.0000 0.0000 66.2605 31.4347 178.8010 6 E 3.9744 8.0446 116.5507 59.2573 29.4585 179.1129 7 E 3.8455 8.0756 118.5354 59.2168 29.5489 178.8663 8 K 3.6612 7.9317 119.6248 59.8568 32.0919 178.3815 9 S 4.0020 7.9132 112.3658 61.2850 62.3840 175.8102 10 A 4.0019 7.7449 123.1016 55.5664 18.1181 179.3933 11 V 3.2546 8.2044 116.8629 66.1774 31.2795 177.9228 12 T 3.9127 8.5364 115.5580 67.3927 68.7903 175.6922 13 A 3.9190 8.6679 121.7619 56.0687 18.4069 179.1613 14 L 3.8213 8.3056 116.4940 57.9215 42.2996 179.5124 15 W 4.3874 8.7175 128.1480 60.0669 30.3981 177.7213 16 G 3.8257 7.9905 103.9103 46.3481 0.0000 174.1838 17 K 4.3590 7.5846 118.6024 56.3486 32.7875 177.0345 18 V 3.7724 6.9744 119.0580 62.3073 32.1901 175.6021 19 N 4.6520 7.9858 124.4365 51.4630 38.2840 175.2662 20 V 3.5246 8.1533 117.3839 64.5227 30.9402 177.2300 21 D 4.3948 8.1828 117.5716 57.2632 40.5292 178.3188 22 E 4.3042 7.8252 117.4483 58.3442 30.3247 178.1865 23 V 3.5453 8.2083 118.7217 65.7550 31.3521 178.3762 24 G 3.6384 8.2717 105.7063 47.5843 0.0000 175.7175 25 G 3.7903 7.4583 109.0478 47.8618 0.0000 175.5194 26 E 3.9755 8.0138 120.5535 58.7666 29.4167 179.4342 27 A 3.9297 7.7481 120.3981 54.9898 18.2735 179.5064 28 L 3.9873 7.9758 117.8483 58.1805 42.5286 178.8687 29 G 3.8367 8.0669 105.6533 48.1885 0.0000 175.8284 30 R 3.9286 8.2892 121.1659 58.6296 29.8315 178.9100 31 L 4.0765 8.0847 120.2178 57.7553 41.8197 178.4512 32 L 4.3576 7.7742 117.2976 55.9004 41.9385 178.4596 33 V 3.8568 7.3690 117.2270 65.2433 32.0157 177.5443 34 V 3.5456 7.8371 117.2517 64.3486 32.8437 175.7015 35 Y 4.2856 7.0825 114.4010 54.4449 37.7325 173.8612 36 P 4.2996 0.0000 0.0000 65.6059 32.3086 177.5827 37 Y 4.3447 7.5664 115.9770 60.2363 37.7658 178.2574 38 T 4.6055 7.9143 108.7328 62.1834 68.3639 175.0672 39 Q 4.6632 8.2467 122.3514 57.0189 29.7236 177.9393 40 R 3.8347 7.8729 113.9072 58.5022 29.1369 177.2622 41 F 4.5291 7.5884 114.7466 57.7777 39.7034 176.0189 42 F 4.6206 8.2662 120.1973 56.7083 39.4427 176.7597 43 E 4.0314 8.4954 120.8473 58.8730 29.0757 177.5152 44 S 4.7697 8.0113 112.9709 58.4891 63.2247 174.3218 45 F 4.9411 8.8447 118.1757 57.7457 39.7595 177.4732 46 G 3.9690 8.1237 107.1385 45.2318 0.0000 173.5914 47 D 4.6116 8.5614 123.8797 54.0427 41.6079 176.2917 48 L 4.9433 8.2739 127.8400 54.5941 43.0691 177.9557 49 S 4.3565 8.0811 115.5776 60.3549 63.8233 174.4984 50 T 4.7257 7.4082 109.9609 58.1606 73.0478 172.4043 51 P 4.1712 0.0000 0.0000 66.2685 31.3585 178.4263 52 D 4.2978 8.0973 116.2712 57.5125 40.6265 178.3959 53 A 3.9950 7.3862 119.3333 56.0638 18.5417 179.3198 54 V 3.6817 7.8057 116.2612 65.6206 31.4410 177.8038 55 M 4.1456 8.2448 121.1643 57.7776 32.1509 178.1215 56 G 4.0618 7.8281 103.5887 43.8834 0.0000 173.8514 57 N 4.2770 7.6285 120.1926 53.6255 39.7940 173.6512 58 P 4.3757 0.0000 0.0000 64.6321 31.5477 178.5762 59 K 3.7176 8.3587 118.3485 58.6621 31.7851 179.4203 60 V 3.6091 7.6170 118.1768 65.9506 31.5931 178.0534 61 K 3.9050 7.8864 117.8025 59.3020 31.7512 179.0440 62 A 3.9390 8.0866 121.1654 55.6679 18.3933 179.1789 63 H 4.2948 8.5311 116.8981 59.1612 29.8763 177.4914 64 G 3.6944 8.3320 107.9859 47.8913 0.0000 175.2562 65 K 3.8496 7.9493 121.4196 59.4885 32.1696 178.5673 66 K 3.7941 7.8565 118.7140 60.2217 32.0120 178.3937 67 V 3.6307 7.9304 117.4154 66.3029 31.6188 178.2714 68 L 4.3002 8.1533 118.6449 57.7019 41.2618 179.8455 69 G 3.6906 8.5751 105.8753 48.0007 0.0000 175.7584 70 A 4.1594 7.9247 122.1413 54.3687 18.5276 179.1996 71 F 4.2432 8.4397 119.8117 61.6043 39.4734 177.6308 72 S 4.1691 8.5034 114.7449 61.4122 62.4818 176.3102 73 D 4.5963 7.9778 122.1606 56.9650 40.6666 178.8621 74 G 3.3365 7.6971 106.1087 47.2485 0.0000 175.5141 75 L 4.0061 7.0957 118.0754 56.2080 41.6986 177.4437 76 A 4.4948 7.1048 120.6175 52.3698 19.1677 177.3117 77 H 4.8319 7.8753 113.8158 55.5038 30.3135 175.5363 78 L 3.9372 8.0847 121.0315 57.3761 41.6512 177.8713 79 D 4.7744 7.5899 116.5169 53.6851 41.8505 176.6356 80 N 4.7137 8.1777 114.9588 51.9205 40.9880 175.3930 81 L 3.8718 7.6822 123.7080 58.0496 42.2034 179.3895 82 K 4.0269 8.1187 116.7020 59.4109 32.1918 179.0497 83 G 3.6887 7.8709 105.4142 47.7301 0.0000 175.7664 84 T 3.6625 7.3191 116.7036 65.8903 68.6366 175.7680 85 F 4.8707 7.8037 116.9492 57.1641 39.1606 177.4143 86 A 4.1096 7.6653 123.4201 55.7752 18.1634 180.7015 87 T 3.9112 7.8737 107.6315 64.9609 68.9659 176.6449 88 L 4.0913 8.0459 121.3596 57.3971 41.5801 179.3276 89 S 4.2697 8.4066 113.3017 61.5492 62.2979 175.6760 90 E 3.8620 7.9820 120.8913 59.6539 29.2813 179.1341 91 L 4.2623 8.0665 119.8716 58.7133 42.1942 178.8237 92 H 4.1350 8.7540 116.2449 58.3802 28.3884 177.2851 93 C 3.5086 7.6624 119.7232 61.6995 31.6373 175.0009 94 D 4.3970 8.5665 119.9361 56.9671 40.6574 177.8926 95 K 4.0993 7.6193 117.0198 58.1668 32.6269 177.9376 96 L 4.1704 7.6000 115.9662 54.3198 43.0970 175.8572 97 H 4.0144 7.7409 114.2905 56.7080 25.6776 174.7281 98 V 3.9111 8.0992 118.1665 60.4967 33.2936 174.4803 99 D 4.2629 8.6953 126.6628 53.9183 41.3452 174.8672 100 P 2.9700 0.0000 0.0000 64.9759 31.5995 178.0285 101 E 3.7621 8.2206 118.7252 59.4431 29.2588 178.6304 102 N 4.3396 8.3261 116.7289 56.1303 38.5017 177.1473 103 F 4.5390 7.5070 119.4271 60.8579 38.9477 177.8004 104 R 4.0877 7.9356 117.4639 58.5918 29.8134 179.1367 105 L 3.7531 7.7809 119.2768 57.6220 41.7032 178.8981 106 L 4.0777 8.0641 119.8655 58.4059 41.9885 178.4995 107 G 3.8559 8.2547 105.2346 48.6673 0.0000 175.2070 108 N 4.4561 8.4078 119.1131 55.5244 38.5883 177.8800 109 V 3.6463 8.0372 119.8554 65.6885 31.5561 177.6171 110 L 3.8615 8.4929 120.5241 58.2284 41.7942 179.1029 111 V 3.5601 7.7516 117.8648 66.2920 31.4345 177.4245 112 C 3.9646 8.0014 116.3912 63.0526 27.9316 176.4671 113 V 3.5050 7.8260 119.3652 65.8953 31.0528 177.6250 114 L 3.6996 7.7764 118.5372 58.0092 41.3073 179.2498 115 A 3.7177 7.3045 120.2290 55.5551 17.9712 179.1914 116 H 4.1036 8.1224 115.9180 59.8791 30.0582 177.0492 117 H 3.9384 8.1237 116.9559 57.5312 28.7295 176.7738 118 F 4.9161 7.9926 117.3155 56.3533 39.7662 177.1913 119 G 3.9055 8.4882 109.6832 45.3824 0.0000 177.3709 120 K 3.8575 9.0046 123.9012 59.7211 32.0552 177.7280 121 E 4.0365 8.2609 119.3712 58.5527 30.2253 176.9050 122 F 4.7111 8.3423 123.6715 57.1954 38.3382 175.5903 123 T 4.0763 7.4177 114.2010 60.9234 71.1385 172.9963 124 P 4.1415 0.0000 0.0000 65.8131 31.2810 177.0973 125 P 4.2531 0.0000 0.0000 65.5192 31.3181 178.8303 126 V 3.7003 7.7169 117.2054 65.4454 31.2685 177.9993 127 Q 3.6236 7.4596 118.8094 59.0749 28.8344 177.6543 128 A 3.8201 7.7138 120.1103 55.1749 18.6006 179.1030 129 A 4.0151 7.6152 117.6450 55.8128 18.4637 179.4939 130 Y 4.0737 7.9804 114.3821 61.3206 37.8544 178.9804 131 Q 4.1013 9.1695 119.8366 58.9455 28.6769 179.2194 132 K 4.0303 8.0996 119.5851 59.3480 32.1632 179.6577 133 V 3.5521 7.6191 118.0871 66.0524 31.5633 178.3725 134 V 3.9381 8.8207 112.4954 64.4637 31.4078 178.4583 135 A 4.1970 8.1188 120.5464 54.6761 18.1285 179.9854 136 G 3.4739 8.2519 104.7537 47.9688 0.0000 176.0477 137 V 3.4737 7.7816 121.2375 65.5453 31.3206 177.3712 138 A 3.8998 7.7426 118.7159 55.6868 18.4193 178.7314 139 N 4.3847 8.2457 113.5770 56.7739 38.3747 177.3772 140 A 4.1601 8.1466 121.6436 55.3936 18.2006 179.4015 141 L 3.9435 8.1122 115.9375 56.5798 41.9894 178.3331 142 A 4.5203 8.3795 120.4054 52.7086 19.1344 178.2200 143 H 4.0604 7.6245 116.6982 59.2783 29.8683 175.9365 144 K 4.3800 7.9958 115.3093 56.3422 31.9569 176.4648 145 Y 4.2034 8.0019 117.8173 58.4186 38.4157 175.6490 146 H 4.4370 8.4064 117.6131 56.2199 28.1936 173.3450 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 M 8.30 4.26 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 2 H 8.61 4.34 0.00 3.19 3.23 0.00 5.74 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.88 4.77 0.00 1.55 1.48 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.57 4.06 4.19 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 1.19 0.00 0.00 5 P 0.00 4.19 0.00 2.14 2.14 0.00 3.55 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 2.09 2.17 0.00 6 E 8.04 3.97 0.00 1.95 1.97 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 2.38 2.32 0.00 7 E 8.08 3.85 0.00 2.13 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 2.28 2.27 0.00 8 K 7.93 3.66 0.00 1.75 1.88 0.00 1.59 0.00 0.00 1.50 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.41 7.81 9 S 7.91 4.00 0.00 3.95 3.83 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.74 4.00 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 11 V 8.20 3.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.45 0.00 0.00 12 T 8.54 3.91 4.39 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 1.25 0.00 0.00 13 A 8.67 3.92 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 L 8.31 3.82 0.00 1.87 2.09 0.38 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.72 4.39 0.00 3.72 3.22 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 0.00 0.00 0.00 16 G 7.99 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.58 4.36 0.00 1.90 1.98 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.35 7.81 18 V 6.97 3.77 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 0.03 0.00 0.00 0.67 0.00 0.00 19 N 7.99 4.65 0.00 2.66 2.57 0.00 0.00 7.04 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 20 V 8.15 3.52 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.97 0.00 0.00 21 D 8.18 4.39 0.00 2.74 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 22 E 7.83 4.30 0.00 2.06 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 2.17 2.26 0.00 23 V 8.21 3.55 1.94 0.00 0.00 0.00 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 0.59 0.00 0.00 24 G 8.27 3.64 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 0.00 0.00 0.00 25 G 7.46 3.79 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 0.00 0.00 0.00 26 E 8.01 3.98 0.00 1.97 1.98 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 2.30 2.31 0.00 27 A 7.75 3.93 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 28 L 7.98 3.99 0.00 1.65 1.71 0.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.07 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.29 3.93 0.00 1.92 1.98 0.00 3.09 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 31 L 8.08 4.08 0.00 1.88 1.87 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 4.36 0.00 1.78 1.69 0.64 0.83 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 33 V 7.37 3.86 2.01 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 0.78 0.00 0.00 0.96 0.00 0.00 34 V 7.84 3.55 1.84 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 -0.19 0.00 0.00 0.82 0.00 0.00 35 Y 7.08 4.29 0.00 2.75 1.87 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 36 P 0.00 4.30 0.00 2.01 2.12 0.00 3.49 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.14 0.00 37 Y 7.57 4.34 0.00 3.14 3.25 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 0.00 38 T 7.91 4.61 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 39 Q 8.25 4.66 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 40 R 7.87 3.83 0.00 1.50 1.84 0.00 2.77 0.00 0.00 2.55 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.00 41 F 7.59 4.53 0.00 2.31 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.27 4.62 0.00 2.77 2.12 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 43 E 8.50 4.03 0.00 2.09 2.12 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 2.27 2.34 0.00 44 S 8.01 4.77 0.00 4.11 4.05 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 0.00 0.00 0.00 45 F 8.84 4.94 0.00 3.10 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 46 G 8.12 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 47 D 8.56 4.61 0.00 2.65 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 48 L 8.27 4.94 0.00 1.65 1.62 1.01 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.08 4.36 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.41 4.73 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 51 P 0.00 4.17 0.00 2.15 2.13 0.00 3.59 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 2.09 2.17 0.00 52 D 8.10 4.30 0.00 2.67 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 53 A 7.39 3.99 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 54 V 7.81 3.68 2.23 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 1.05 0.00 0.00 0.93 0.00 0.00 55 M 8.24 4.15 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.90 0.00 56 G 7.83 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 0.00 0.00 0.00 57 N 7.63 4.28 0.00 3.05 2.85 0.00 0.00 7.04 7.48 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 58 P 0.00 4.38 0.00 2.13 2.03 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 59 K 8.36 3.72 0.00 1.41 0.74 0.00 1.54 0.00 0.00 1.35 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.22 1.25 7.81 60 V 7.62 3.61 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.06 0.00 0.00 61 K 7.89 3.91 0.00 1.83 1.81 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.16 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.57 7.81 62 A 8.09 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.53 4.29 0.00 3.59 3.63 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.33 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.95 3.85 0.00 2.08 1.92 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.78 1.63 7.81 66 K 7.86 3.79 0.00 1.87 1.80 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.54 7.81 67 V 7.93 3.63 2.11 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 1.04 0.00 0.00 0.94 0.00 0.00 68 L 8.15 4.30 0.00 2.09 1.86 1.10 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.58 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.92 4.16 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.44 4.24 0.00 3.31 3.31 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 72 S 8.50 4.17 0.00 4.19 4.26 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 0.00 0.00 0.00 73 D 7.98 4.60 0.00 2.85 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.70 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.10 4.01 0.00 1.54 1.51 0.19 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.10 4.49 1.14 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 0.00 0.00 77 H 7.88 4.83 0.00 3.09 3.12 0.00 5.85 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.08 3.94 0.00 1.54 1.69 0.81 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.59 4.77 0.00 2.61 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.18 4.71 0.00 2.65 2.58 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.68 3.87 0.00 1.73 1.78 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.12 4.03 0.00 1.62 1.65 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.48 7.81 83 G 7.87 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.32 3.66 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 nan 0.00 0.00 85 F 7.80 4.87 0.00 3.05 2.90 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 86 A 7.67 4.11 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 87 T 7.87 3.91 4.26 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 0.00 0.00 1.22 0.00 0.00 88 L 8.05 4.09 0.00 1.96 1.86 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.41 4.27 0.00 4.17 4.05 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 0.00 0.00 0.00 90 E 7.98 3.86 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 2.34 2.61 0.00 91 L 8.07 4.26 0.00 1.89 1.84 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.75 4.13 0.00 3.49 3.65 0.00 5.85 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.66 3.51 0.00 1.23 2.41 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 94 D 8.57 4.40 0.00 2.57 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.62 4.10 0.00 1.80 1.77 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.40 7.81 96 L 7.60 4.17 0.00 1.61 1.53 0.72 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.74 4.01 0.00 3.38 3.36 0.00 5.68 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 98 V 8.10 3.91 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 0.15 0.00 0.00 0.40 0.00 0.00 99 D 8.70 4.26 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 2.97 0.00 1.79 1.57 0.00 3.33 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.44 0.00 101 E 8.22 3.76 0.00 2.01 1.90 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 2.23 2.34 0.00 102 N 8.33 4.34 0.00 2.62 2.89 0.00 0.00 6.94 8.06 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 0.00 103 F 7.51 4.54 0.00 3.06 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.94 4.09 0.00 1.79 1.99 0.00 3.40 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 105 L 7.78 3.75 0.00 1.83 1.45 0.63 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.06 4.08 0.00 1.84 1.76 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.25 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.41 4.46 0.00 2.91 2.95 0.00 0.00 6.80 7.77 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 0.00 109 V 8.04 3.65 2.27 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 1.03 0.00 0.00 1.17 0.00 0.00 110 L 8.49 3.86 0.00 1.74 1.92 0.86 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.75 3.56 2.32 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 1.41 0.00 0.00 1.17 0.00 0.00 112 C 8.00 3.96 0.00 3.24 2.97 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 0.00 113 V 7.83 3.50 2.14 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 1.00 0.00 0.00 0.88 0.00 0.00 114 L 7.78 3.70 0.00 1.06 1.00 0.36 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.30 3.72 1.37 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 0.00 0.00 116 H 8.12 4.10 0.00 3.13 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.12 3.94 0.00 2.51 2.08 0.00 5.67 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.99 4.92 0.00 3.07 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 0.00 119 G 8.49 3.91 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 0.00 0.00 0.00 120 K 9.00 3.86 0.00 1.92 2.03 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.44 7.81 121 E 8.26 4.04 0.00 2.09 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 0.00 2.34 2.28 0.00 122 F 8.34 4.71 0.00 3.04 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.42 4.08 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 1.33 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.16 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 125 P 0.00 4.25 0.00 2.12 2.08 0.00 3.48 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 126 V 7.72 3.70 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.93 0.00 0.00 127 Q 7.46 3.62 0.00 1.72 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 128 A 7.71 3.82 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 0.00 129 A 7.62 4.02 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 0.00 130 Y 7.98 4.07 0.00 3.39 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 0.00 131 Q 9.17 4.10 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 132 K 8.10 4.03 0.00 2.05 1.84 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.57 7.81 133 V 7.62 3.55 2.10 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 1.02 0.00 0.00 0.76 0.00 0.00 134 V 8.82 3.94 2.24 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 1.06 0.00 0.00 1.16 0.00 0.00 135 A 8.12 4.20 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 0.00 136 G 8.25 3.47 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 0.00 137 V 7.78 3.47 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.64 0.00 0.00 138 A 7.74 3.90 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.25 4.38 0.00 2.95 2.93 0.00 0.00 7.02 7.73 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 0.00 140 A 8.15 4.16 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.11 3.94 0.00 0.93 0.70 -0.08 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.38 4.52 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 0.00 143 H 7.62 4.06 0.00 3.16 3.71 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.00 4.38 0.00 1.87 1.81 0.00 1.76 0.00 0.00 1.60 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.77 7.81 145 Y 8.00 4.20 0.00 3.07 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.41 4.44 0.00 3.21 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00