NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3057 8.3044 120.3269 54.7213 32.7242 174.4989 2 E 3.7303 8.7901 125.7413 55.2913 29.2744 174.7220 3 S 4.2562 9.2274 122.9666 58.2207 63.9925 174.6719 4 K 4.2072 8.5425 125.5299 58.1016 32.5475 177.8867 5 R 4.2362 7.8481 114.3409 56.5218 30.0486 176.9281 6 N 4.8772 7.8669 115.3268 53.1272 39.0463 174.5903 7 K 4.5785 7.7230 118.3603 53.9111 33.7664 174.3990 8 P 4.5886 0.0000 0.0000 62.7084 32.4181 175.0801 9 G 3.7052 8.6962 107.4094 45.8217 0.0000 171.8330 10 K 5.0285 8.3140 120.7610 54.1295 34.4942 175.2536 11 A 4.6708 8.8917 129.6440 52.1649 19.8069 176.6013 12 T 4.6437 8.6897 112.5480 59.3834 72.7499 173.7577 13 G 4.1043 8.9568 107.6055 45.5871 0.0000 174.0454 14 K 3.9449 9.6883 121.7664 57.4807 32.4430 178.6033 15 G 3.8793 9.6690 105.9534 44.6462 0.0000 172.1862 16 K 4.6716 8.1186 115.7715 53.7835 36.1643 174.4899 17 P 4.8033 0.0000 0.0000 62.1452 31.9177 176.6295 18 V 4.5114 7.9373 114.8075 59.2904 35.4881 175.8751 19 G 3.8831 8.5590 112.7243 44.9402 0.0000 174.1424 20 D 4.8759 8.7295 119.7466 55.1930 39.5018 177.8369 21 K 4.1456 8.0012 119.7906 57.1106 31.8787 177.9091 22 W 4.5403 8.8259 117.4176 60.5493 27.5132 177.2836 23 L 3.7266 6.9093 115.7988 55.0599 41.3110 177.8335 24 D 4.5353 7.9118 119.9700 56.7804 40.8353 177.9004 25 D 4.3465 7.8674 117.7465 56.1399 40.6543 178.1275 26 A 4.1694 8.1740 122.0746 55.2709 18.3542 178.4160 27 G 3.8558 7.6666 101.2344 46.0094 0.0000 173.1568 28 K 4.5328 7.8447 119.9068 54.8875 36.0239 179.8157 29 D 4.2816 7.6700 119.3908 55.6007 41.4346 175.5387 30 S 4.5924 9.1433 124.7451 59.1443 62.9787 173.6333 31 G 3.9126 8.0244 106.3066 44.5490 0.0000 173.0739 32 A 4.7328 8.5596 120.4883 50.0928 20.2133 175.8001 33 P 4.7813 0.0000 0.0000 62.2826 32.9804 176.1934 34 I 3.8336 8.2950 121.6920 60.8362 38.0792 174.3914 35 P 4.6435 0.0000 0.0000 62.1740 32.1806 177.1049 36 D 4.4838 8.8420 122.3080 56.9002 39.1304 179.4071 37 R 3.9721 7.7324 118.9092 58.8718 30.2009 178.9352 38 I 3.5697 7.4596 119.0403 64.1811 37.1799 178.0380 39 A 4.0151 7.9012 121.6606 55.1699 17.9113 179.4000 40 D 4.2651 7.6662 116.4086 57.5890 41.0311 178.7717 41 K 4.0592 7.7632 117.4352 58.8395 32.2755 178.4201 42 L 4.6160 7.6075 116.4537 53.4077 42.5614 176.5289 43 R 4.0533 7.4750 120.3571 57.7337 30.3919 176.1790 44 D 4.5333 9.3797 123.7967 54.5765 39.6035 174.1165 45 K 4.1096 7.5297 120.0623 55.7912 33.2729 176.1592 46 E 4.3872 8.2249 125.0600 56.1532 30.6857 175.7303 47 F 4.9319 8.9444 123.6350 55.9678 42.8689 176.0561 48 K 4.3088 9.0683 121.3821 58.7178 32.5936 176.7336 49 S 4.8291 8.0178 111.1215 56.0048 67.5222 174.6449 50 F 4.1323 8.9116 122.6105 61.0930 38.8217 176.4017 51 D 4.6068 8.5251 118.5276 57.8753 40.6594 178.7291 52 D 4.3648 7.9732 118.8917 57.3501 40.8084 178.5286 53 F 2.6653 7.7272 121.1487 60.7645 39.1850 177.0632 54 R 3.3096 8.1808 118.4787 59.2054 29.8362 177.8295 55 K 3.9834 8.3412 120.4986 59.0918 32.0032 178.0953 56 A 3.8926 7.9560 120.4081 55.1358 18.2829 179.5629 57 V 3.0059 7.1678 116.5920 65.9861 31.4454 178.4294 58 W 4.4838 7.5459 118.3722 59.8207 28.5700 178.4888 59 E 4.7629 8.4073 120.1334 59.0203 28.9906 179.2305 60 E 3.9365 8.5311 119.1578 59.2901 29.2458 179.3749 61 V 3.6453 7.5010 117.7836 66.1456 31.9874 177.9971 62 S 4.3540 8.1463 113.8871 61.2345 62.6674 176.5593 63 K 4.2967 7.5233 121.1558 57.6004 32.1525 176.7972 64 D 4.4055 7.7696 119.9008 53.0029 41.1162 174.1424 65 P 4.1846 0.0000 0.0000 66.5225 31.2665 177.5825 66 E 4.6636 8.0554 117.0502 55.6907 29.4685 178.1636 67 L 4.7419 7.8418 121.2213 55.1408 43.4154 177.6605 68 S 4.8561 7.6935 111.4231 57.8514 63.1619 175.9630 69 K 4.0753 8.2018 124.1310 59.2886 32.0776 177.1533 70 N 4.8203 8.1304 113.0843 52.7957 39.1577 174.3542 71 L 4.4870 7.2403 118.6959 53.4055 43.0116 177.1265 72 N 4.6527 8.4914 120.8268 51.9907 39.6374 174.1754 73 P 4.3468 0.0000 0.0000 66.2276 31.1693 178.3687 74 S 4.1299 8.2338 112.2138 62.2384 62.4355 176.2434 75 N 4.4730 8.2916 120.2339 54.3776 38.0017 177.8299 76 K 4.0571 8.5662 121.0516 59.7287 31.7340 179.3766 77 S 4.2019 8.0449 115.2058 61.5525 62.6909 176.9997 78 S 4.2794 7.8832 117.9720 61.9426 62.6907 177.2948 79 V 4.1621 7.5755 114.2587 64.1042 31.0354 178.7533 80 S 4.3840 7.6962 115.3462 59.8025 62.6552 175.5683 81 K 4.4923 7.4145 118.2630 55.5178 31.9225 177.1375 82 G 3.9240 7.7674 106.6877 46.0477 0.0000 173.0163 83 Y 4.4528 8.0033 117.6813 56.9208 38.6677 175.6675 84 S 2.7900 8.4888 118.3414 57.6416 63.2974 172.0091 85 P 4.2428 0.0000 0.0000 62.1062 32.7154 175.5212 86 F 4.6786 8.4858 121.3091 58.3480 39.3183 175.3791 87 T 3.9785 8.5526 114.2753 59.8918 70.2282 172.7194 88 P 4.1488 0.0000 0.0000 62.9563 32.0857 177.2562 89 K 3.7710 8.9918 124.3405 59.7764 32.0518 177.4048 90 N 4.6132 8.0742 112.0310 53.9276 37.5031 174.9835 91 Q 4.5148 8.6113 117.8427 55.7980 30.2775 175.3466 92 Q 4.4043 7.7103 117.7806 55.0986 29.7618 175.7815 93 V 4.1883 8.3984 121.5516 61.5712 33.2705 176.0615 94 G 4.2443 8.2855 119.5502 47.2141 0.0000 173.2932 95 G 3.8229 8.8396 113.4904 45.3942 0.0000 172.7930 96 R 4.4523 8.4383 121.0921 54.6866 30.4498 176.8789 97 K 4.5647 8.5214 120.9812 55.4683 34.4999 176.2352 98 V 4.6191 7.3616 110.9725 58.9860 34.2090 175.2507 99 Y 4.4409 7.7996 120.3323 59.0356 38.6969 176.0407 100 E 4.8327 9.7972 121.1388 54.7499 33.4160 175.7874 101 L 4.9233 8.7811 124.5992 53.7347 40.3117 175.3076 102 H 4.3193 9.1547 122.6220 56.0073 31.5706 173.3659 103 A 4.7503 8.1674 126.6057 50.4588 19.7406 175.8914 104 D 4.2701 9.3993 125.1400 57.0602 41.4208 176.1194 105 K 4.2046 8.9697 119.2566 54.7141 33.1839 175.1298 106 P 4.5997 0.0000 0.0000 62.3925 32.1576 177.1214 107 I 3.9351 8.8202 121.1624 63.9290 37.0413 178.9211 108 S 4.2579 8.0487 112.3583 60.6521 62.9755 174.8947 109 Q 4.2799 9.1692 118.5274 55.8595 29.3773 175.5797 110 G 3.8737 7.1351 112.5818 45.1558 0.0000 173.6224 111 G 3.9403 8.1455 111.7596 45.0569 0.0000 172.6598 112 E 4.5054 8.4298 122.3071 54.4984 31.0927 177.4587 113 V 3.3389 8.5136 123.1019 65.8168 31.6602 176.3864 114 Y 3.9474 7.7293 114.6595 57.3722 38.2894 174.3909 115 D 4.7440 7.7695 121.4356 53.5746 40.7124 177.0806 116 M 4.3376 8.2746 127.7164 57.7172 32.1817 177.8384 117 D 4.5135 8.2184 117.7575 56.4481 41.4869 176.8927 118 N 4.5084 8.2738 117.3181 55.1642 39.3598 174.4052 119 I 4.6564 7.5694 118.6372 60.8515 38.5018 175.4398 120 R 4.8648 9.4704 126.1154 54.2726 33.6339 175.0984 121 V 4.5962 9.0820 124.9607 62.9264 32.4523 174.8838 122 T 5.3855 9.5868 119.3942 59.8770 72.1007 174.1136 123 T 4.3351 8.4186 112.5398 60.5326 70.3083 173.6589 124 P 4.2455 0.0000 0.0000 65.8568 30.9636 178.8547 125 K 3.9095 8.2821 118.3921 59.5446 32.2572 178.8776 126 R 4.0334 8.0553 118.9906 59.6763 30.0715 177.8235 127 H 4.2182 8.6374 118.4842 59.4622 29.7584 177.3069 128 I 3.7961 7.9512 121.5599 64.3204 36.9130 178.0153 129 D 4.3572 7.8220 119.5122 57.6584 40.4741 179.0631 130 I 3.7256 7.4633 118.6430 64.5282 37.0961 177.7546 131 H 4.4729 7.6426 114.6212 58.1265 29.1451 177.5411 132 R 4.2357 8.3167 119.7910 58.0894 29.7144 178.3514 133 G 3.8377 7.5058 103.8092 45.9953 0.0000 173.6178 134 K 4.1879 7.7802 125.4644 56.5901 32.1876 176.6500 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 4.31 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 2 E 8.79 3.73 0.00 2.01 1.93 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 2.31 2.37 0.00 3 S 9.23 4.26 0.00 3.89 3.72 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 4 K 8.54 4.21 0.00 1.76 1.83 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 5 R 7.85 4.24 0.00 1.84 1.97 0.00 2.84 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 6 N 7.87 4.88 0.00 2.86 2.93 0.00 0.00 6.87 8.79 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 7 K 7.72 4.58 0.00 1.97 1.80 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.22 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.70 7.81 8 P 0.00 4.59 0.00 1.95 2.03 0.00 3.82 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 9 G 8.70 3.71 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 0.00 0.00 0.00 10 K 8.31 5.03 0.00 1.65 1.61 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.33 7.81 11 A 8.89 4.67 1.66 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 0.00 0.00 12 T 8.69 4.64 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 1.23 0.00 0.00 13 G 8.96 4.10 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 0.00 0.00 0.00 14 K 9.69 3.94 0.00 1.85 1.87 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.38 7.81 15 G 9.67 3.88 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 0.00 0.00 0.00 16 K 8.12 4.67 0.00 1.76 1.64 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.55 7.81 17 P 0.00 4.80 0.00 2.03 1.96 0.00 3.67 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 18 V 7.94 4.51 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 0.78 0.00 0.00 0.62 0.00 0.00 19 G 8.56 3.88 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 0.00 0.00 0.00 20 D 8.73 4.88 0.00 2.96 3.09 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 0.00 0.00 0.00 0.00 21 K 8.00 4.15 0.00 1.81 1.91 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.47 1.57 7.81 22 W 8.83 4.54 0.00 3.69 3.50 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 23 L 6.91 3.73 0.00 0.98 1.14 0.20 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.91 4.54 0.00 2.81 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 25 D 7.87 4.35 0.00 2.79 2.76 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 26 A 8.17 4.17 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 27 G 7.67 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 28 K 7.84 4.53 0.00 2.01 1.75 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.39 7.81 29 D 7.67 4.28 0.00 2.77 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 30 S 9.14 4.59 0.00 3.86 3.88 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 31 G 8.02 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 32 A 8.56 4.73 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 33 P 0.00 4.78 0.00 2.12 2.10 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 34 I 8.29 3.83 2.04 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.01 0.84 0.00 0.00 35 P 0.00 4.64 0.00 1.74 1.52 0.00 3.26 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.37 0.00 36 D 8.84 4.48 0.00 2.80 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 37 R 7.73 3.97 0.00 1.72 1.91 0.00 3.03 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 38 I 7.46 3.57 1.76 0.00 0.00 0.67 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 0.97 0.66 0.00 0.00 39 A 7.90 4.02 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 40 D 7.67 4.27 0.00 2.86 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 41 K 7.76 4.06 0.00 1.87 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.66 7.81 42 L 7.61 4.62 0.00 1.77 1.88 0.63 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 43 R 7.48 4.05 0.00 2.05 1.84 0.00 3.37 0.00 0.00 3.45 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 44 D 9.38 4.53 0.00 2.82 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 45 K 7.53 4.11 0.00 1.30 1.23 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.61 1.56 7.81 46 E 8.22 4.39 0.00 1.79 1.60 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 2.15 2.21 0.00 47 F 8.94 4.93 0.00 2.78 3.04 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 48 K 9.07 4.31 0.00 2.17 1.92 0.00 1.57 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.51 7.81 49 S 8.02 4.83 0.00 4.18 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 50 F 8.91 4.13 0.00 3.01 3.04 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 51 D 8.53 4.61 0.00 2.87 2.83 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 52 D 7.97 4.36 0.00 2.99 2.92 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 0.00 53 F 7.73 2.67 0.00 2.25 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 3.31 0.00 1.79 2.18 0.00 3.49 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 55 K 8.34 3.98 0.00 1.94 1.96 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.21 7.81 56 A 7.96 3.89 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 57 V 7.17 3.01 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 0.12 0.00 0.00 -0.37 0.00 0.00 58 W 7.55 4.48 0.00 3.62 3.20 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 0.00 59 E 8.41 4.76 0.00 2.11 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 2.58 2.37 0.00 60 E 8.53 3.94 0.00 1.95 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 2.46 2.37 0.00 61 V 7.50 3.65 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 1.30 0.00 0.00 1.00 0.00 0.00 62 S 8.15 4.35 0.00 4.17 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 0.00 63 K 7.52 4.30 0.00 1.89 1.90 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.56 7.81 64 D 7.77 4.41 0.00 2.79 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 65 P 0.00 4.18 0.00 2.26 2.29 0.00 3.72 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 66 E 8.06 4.66 0.00 2.05 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 0.00 2.40 2.33 0.00 67 L 7.84 4.74 0.00 1.78 1.80 0.45 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.69 4.86 0.00 4.18 4.16 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 69 K 8.20 4.08 0.00 1.99 1.95 0.00 1.79 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.49 7.81 70 N 8.13 4.82 0.00 2.77 2.84 0.00 0.00 6.89 7.85 0.00 0.00 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 L 7.24 4.49 0.00 1.87 1.63 1.01 0.94 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 72 N 8.49 4.65 0.00 2.93 2.97 0.00 0.00 6.24 7.76 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 73 P 0.00 4.35 0.00 2.19 2.18 0.00 3.63 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 2.13 2.18 0.00 74 S 8.23 4.13 0.00 4.12 4.12 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 75 N 8.29 4.47 0.00 3.08 2.92 0.00 0.00 7.18 7.16 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 76 K 8.57 4.06 0.00 1.93 1.89 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.77 7.81 77 S 8.04 4.20 0.00 4.03 3.96 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 0.00 0.00 0.00 78 S 7.88 4.28 0.00 3.77 3.96 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 0.00 0.00 0.00 79 V 7.58 4.16 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.13 0.00 0.00 80 S 7.70 4.38 0.00 4.06 3.96 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 0.00 0.00 0.00 81 K 7.41 4.49 0.00 1.94 1.79 0.00 1.96 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.70 7.81 82 G 7.77 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 0.00 0.00 0.00 0.00 83 Y 8.00 4.45 0.00 2.87 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 84 S 8.49 2.79 0.00 3.68 3.50 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 85 P 0.00 4.24 0.00 2.14 2.01 0.00 2.22 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 86 F 8.49 4.68 0.00 2.92 2.92 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 0.00 87 T 8.55 3.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 88 P 0.00 4.15 0.00 2.30 2.04 0.00 3.85 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 89 K 8.99 3.77 0.00 1.78 1.81 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.50 7.81 90 N 8.07 4.61 0.00 2.85 2.90 0.00 0.00 5.84 7.39 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 91 Q 8.61 4.51 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 92 Q 7.71 4.40 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 93 V 8.40 4.19 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 0.97 0.00 0.00 0.92 0.00 0.00 94 G 8.29 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 0.00 0.00 0.00 0.00 95 G 8.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.44 4.45 0.00 1.97 1.88 0.00 3.07 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 97 K 8.52 4.56 0.00 1.93 2.00 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.44 7.81 98 V 7.36 4.62 1.79 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 0.20 0.00 0.00 0.83 0.00 0.00 99 Y 7.80 4.44 0.00 2.87 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 0.00 100 E 9.80 4.83 0.00 1.90 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 0.00 2.31 2.49 0.00 101 L 8.78 4.92 0.00 1.98 1.95 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 102 H 9.15 4.32 0.00 2.94 3.32 0.00 5.76 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 0.00 103 A 8.17 4.75 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 104 D 9.40 4.27 0.00 2.74 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.97 4.20 0.00 1.84 1.71 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.40 7.81 106 P 0.00 4.60 0.00 2.21 1.96 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 107 I 8.82 3.94 1.82 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 1.02 1.74 0.88 0.00 0.00 108 S 8.05 4.26 0.00 3.97 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 0.00 109 Q 9.17 4.28 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.27 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 110 G 7.14 3.87 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 0.00 0.00 0.00 111 G 8.15 3.94 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 0.00 0.00 0.00 112 E 8.43 4.51 0.00 2.04 1.89 0.00 0.00 0.00 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 2.28 0.00 113 V 8.51 3.34 1.79 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 0.07 0.00 0.00 0.82 0.00 0.00 114 Y 7.73 3.95 0.00 3.13 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 0.00 115 D 7.77 4.74 0.00 2.73 2.56 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 0.00 116 M 8.27 4.34 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.87 0.00 117 D 8.22 4.51 0.00 2.94 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 0.00 118 N 8.27 4.51 0.00 2.97 2.90 0.00 0.00 7.04 7.31 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 0.00 119 I 7.57 4.66 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.85 1.06 0.00 0.00 120 R 9.47 4.86 0.00 1.74 1.91 0.00 3.33 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.93 0.00 121 V 9.08 4.60 2.21 0.00 0.00 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 1.05 0.00 0.00 122 T 9.59 5.39 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 1.25 0.00 0.00 123 T 8.42 4.34 4.28 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 0.00 0.00 0.00 1.27 0.00 0.00 124 P 0.00 4.25 0.00 2.34 2.15 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 125 K 8.28 3.91 0.00 1.84 1.96 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 126 R 8.06 4.03 0.00 2.00 1.94 0.00 3.33 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.70 0.00 127 H 8.64 4.22 0.00 3.35 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 I 7.95 3.80 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.71 0.89 0.00 0.00 129 D 7.82 4.36 0.00 2.90 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 0.00 130 I 7.46 3.73 1.73 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.78 0.00 0.00 131 H 7.64 4.47 0.00 3.26 3.31 0.00 5.66 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 0.00 132 R 8.32 4.24 0.00 2.08 1.97 0.00 3.24 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 133 G 7.51 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 0.00 134 K 7.78 4.19 0.00 1.80 1.73 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.23 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.67 1.53 7.81