NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4939 8.3049 120.3277 55.6851 32.8293 173.1547 2 E 4.3315 7.7170 118.1189 53.0087 36.0554 172.0551 3 T 3.2872 7.8904 127.2034 63.5465 66.5679 170.1194 4 I 4.8901 7.9375 117.4121 58.7377 40.4717 174.5667 5 A 4.9934 8.2388 124.4579 50.4539 22.9622 174.5388 6 K 4.6940 8.1654 116.6742 56.5617 35.9610 174.8640 7 H 4.7623 9.3423 120.0604 54.7950 32.2752 172.1845 8 R 5.1205 8.7485 124.3319 56.0407 32.4642 176.7383 9 H 4.2264 9.4811 116.9698 55.2610 26.2823 175.2593 10 A 3.8325 7.5651 122.0925 53.0981 18.5189 177.8562 11 R 4.5363 8.1271 123.2979 53.3728 29.0707 175.9775 12 S 4.4805 7.2023 113.6670 57.1164 66.2838 175.0105 13 S 4.7320 7.9313 113.4606 56.9741 66.2444 174.4619 14 A 4.0497 8.2858 123.4824 54.7161 17.9868 179.6173 15 Q 3.9788 7.9128 117.2506 58.7566 29.5264 177.7922 16 K 4.0841 8.3915 120.0950 59.2280 32.2894 179.0965 17 V 3.5407 7.3904 117.9760 66.4701 31.4531 177.9646 18 R 3.9202 7.6981 117.7982 59.4075 29.4822 178.2188 19 L 3.9504 7.8259 119.7215 57.7543 42.6467 178.5228 20 V 4.0694 7.5774 116.0354 61.8670 31.7073 177.4180 21 A 4.1279 7.7697 124.0907 55.4612 18.6194 179.2612 22 D 4.6315 7.8691 112.6284 55.5762 41.0423 177.3620 23 L 4.1437 7.5393 120.9268 57.0166 42.3973 177.3168 24 I 4.3400 7.4104 109.5124 60.0961 38.1617 175.1952 25 R 4.0076 7.7866 122.1892 58.0752 30.4510 175.2301 26 G 4.3251 8.6041 120.4534 45.6184 0.0000 174.1151 27 K 4.0068 7.3749 116.2245 57.0641 33.9457 175.8744 28 K 4.7137 7.5083 113.6536 55.9301 33.4639 178.4929 29 V 4.5441 8.4139 125.8761 64.9660 37.1896 174.5964 30 S 4.2960 8.2408 116.1066 61.6448 63.3129 176.3861 31 Q 3.8596 8.1963 118.5528 58.8459 28.8436 176.5560 32 A 4.8044 7.8258 122.4114 50.5784 16.1557 177.0637 33 L 5.5725 7.8391 132.9222 56.6246 40.8895 175.8002 34 D 4.5098 7.1660 117.0930 56.5786 40.8377 177.4061 35 I 4.1804 7.8747 110.9664 61.5021 38.5848 176.4380 36 L 4.9171 7.8523 121.1791 56.5046 42.4256 178.8052 37 T 3.7241 7.8002 113.1136 66.0760 68.5576 174.0546 38 Y 4.9234 7.4484 117.3548 56.1116 40.4140 174.3951 39 T 4.4548 8.9703 118.6881 62.6746 69.8943 176.2417 40 N 4.8047 9.4620 133.4361 54.8641 36.6643 176.2378 41 K 3.8520 7.4636 119.8255 55.9212 32.9347 177.9225 42 K 3.9802 8.8500 123.7164 59.6536 32.7347 178.0581 43 A 3.9727 8.1786 120.9236 54.9625 18.4506 178.9943 44 A 4.0265 9.3015 119.9682 55.1755 18.4131 180.1705 45 V 4.8946 7.4652 107.5784 61.4659 31.4389 176.9120 46 L 4.5197 7.7068 119.2469 57.1474 43.5524 177.5167 47 V 3.9313 7.5676 111.3583 63.4758 31.6515 178.5058 48 K 3.8594 7.5172 119.5740 59.5130 31.8919 178.4839 49 K 3.9105 8.2105 119.3765 60.4241 31.7232 177.5535 50 V 3.6998 7.4180 119.1142 64.6530 31.3285 177.2568 51 L 3.8854 8.4995 119.6579 58.6517 42.2671 179.3852 52 E 3.9548 8.7006 118.3479 59.6810 29.3177 179.4796 53 S 4.0655 7.7721 112.5094 61.3441 62.6269 176.0679 54 A 3.9551 8.3186 123.8715 55.0158 18.1805 179.3640 55 I 3.7103 8.3681 118.5976 64.6920 37.1230 178.3973 56 A 4.0026 7.7228 120.6510 55.2417 18.1411 179.1077 57 N 4.4482 8.2727 112.0057 54.9347 38.4519 176.1312 58 A 4.7583 7.4117 122.7737 52.7721 20.1108 178.8750 59 E 4.0482 7.7865 115.9424 59.8487 29.7096 178.7699 60 H 4.2526 8.2608 117.0645 61.1614 30.6343 175.3674 61 N 4.7343 8.2311 122.3349 52.6635 39.3592 174.4488 62 D 4.2868 8.7375 122.3607 54.2695 39.7870 173.7533 63 G 3.4271 8.6075 108.6695 44.7522 0.0000 172.0256 64 A 4.5863 7.8295 131.5400 51.2512 17.4765 178.2740 65 D 4.3699 8.8901 121.8092 56.4035 40.7562 177.6280 66 I 3.9182 8.4020 118.0551 62.3799 37.7641 177.6033 67 D 4.5061 7.6222 121.1445 56.8301 41.2995 176.2898 68 D 4.9852 7.5325 115.8383 52.5428 39.3262 177.2257 69 L 5.2450 7.2148 117.8840 51.7794 42.2921 176.1866 70 K 3.8090 8.1021 117.1804 56.5240 32.5534 178.3067 71 V 4.0371 8.3505 125.9388 61.5343 30.4781 178.0684 72 T 4.1206 8.6128 120.2081 63.5063 67.8004 177.5417 73 K 4.2267 9.2055 117.6576 56.6302 34.2590 177.1285 74 I 4.4425 8.2283 123.6400 60.4737 39.7498 173.2733 75 F 5.1842 8.5266 125.2195 54.9951 41.2861 173.9717 76 V 4.8194 8.6141 121.2428 60.4043 33.4582 174.4560 77 D 5.1852 8.5733 121.5016 52.2445 45.1683 174.8671 78 E 4.3201 8.8515 119.5040 56.5653 30.1876 177.4267 79 G 4.6882 8.3690 112.3893 42.8012 0.0000 171.4808 80 P 4.3858 0.0000 0.0000 61.8430 30.4123 175.8730 81 S 4.0007 8.4649 120.5309 59.4292 63.4490 174.2419 82 M 4.3575 8.6646 125.8698 53.9564 32.8154 175.9638 83 K 4.2959 8.6157 124.5632 56.7125 32.6030 176.5034 84 R 4.8640 8.1481 121.8171 54.7259 34.0345 173.8098 85 I 4.8558 8.2329 114.1831 59.1376 40.5923 174.2708 86 M 4.7534 8.5413 125.0037 52.9792 34.9437 172.5326 87 P 4.7550 0.0000 0.0000 62.6435 32.0421 175.5018 88 R 4.5859 8.7368 127.6936 54.4004 33.3361 175.2433 89 A 3.9795 8.4281 120.9533 53.5496 18.7879 178.5632 90 K 3.7819 9.3664 118.3987 56.6171 30.0546 176.0454 91 G 3.7433 7.8372 105.7530 46.6468 0.0000 173.9127 92 R 4.6958 7.5977 116.5673 53.9418 33.0709 175.8590 93 A 5.0258 8.5780 125.4822 50.8690 20.4476 176.4730 94 D 4.6852 8.7059 122.8292 53.0813 42.4586 177.9755 95 R 3.7758 8.6312 119.2510 58.0702 30.9751 175.8279 96 I 3.3877 7.7420 114.8764 61.5843 36.0142 173.5847 97 L 4.0140 7.6014 119.8468 55.1759 42.5438 178.3943 98 K 4.3957 8.2910 123.7394 54.4394 31.3856 176.0926 99 R 4.4175 8.1020 121.9017 56.1049 31.8299 177.4520 100 T 4.9046 7.9821 109.9006 60.6641 69.5439 173.3953 101 S 4.9597 7.2125 113.6473 58.4978 67.0803 176.7277 102 H 5.0405 8.5534 118.6855 53.9529 31.1526 172.9733 103 I 3.8107 8.9642 125.7917 61.4996 37.6605 175.0658 104 T 4.5406 8.3116 124.9616 61.9755 69.8840 174.5300 105 V 4.6499 8.0665 125.0193 61.2266 35.5240 173.8981 106 V 4.6357 8.7316 126.4714 61.1377 34.6411 175.4132 107 V 4.2425 8.0699 126.7516 60.5787 33.4792 174.6240 108 S 4.6940 8.1932 122.2231 56.9276 64.6132 173.7533 109 D 4.4088 8.6358 118.1147 55.0457 39.9131 176.1708 110 R 4.1735 7.6662 123.5599 56.0740 30.0783 175.1083 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 4.49 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 2 E 7.72 4.33 0.00 1.99 1.76 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 2.23 2.36 0.00 3 T 7.89 3.29 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 1.28 0.00 0.00 4 I 7.94 4.89 2.06 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 1.27 0.53 0.92 0.00 0.00 5 A 8.24 4.99 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 0.00 0.00 0.00 0.00 0.00 6 K 8.17 4.69 0.00 1.85 1.68 0.00 1.49 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.40 7.81 7 H 9.34 4.76 0.00 3.14 3.12 0.00 5.55 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.75 5.12 0.00 1.72 1.76 0.00 3.25 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 9 H 9.48 4.23 0.00 3.32 3.62 0.00 5.94 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 10 A 7.57 3.83 1.12 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 0.00 0.00 11 R 8.13 4.54 0.00 1.81 1.90 0.00 3.42 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 12 S 7.20 4.48 0.00 3.76 3.65 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 13 S 7.93 4.73 0.00 4.06 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 14 A 8.29 4.05 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 15 Q 7.91 3.98 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.03 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 16 K 8.39 4.08 0.00 1.81 1.82 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.43 7.81 17 V 7.39 3.54 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 0.93 0.00 0.00 18 R 7.70 3.92 0.00 2.23 2.06 0.00 3.16 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 19 L 7.83 3.95 0.00 1.95 1.75 0.93 0.86 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 20 V 7.58 4.07 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 0.87 0.00 0.00 0.93 0.00 0.00 21 A 7.77 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 22 D 7.87 4.63 0.00 2.71 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 4.14 0.00 1.64 1.83 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.41 4.34 1.88 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 1.19 0.76 0.92 0.00 0.00 25 R 7.79 4.01 0.00 1.82 1.90 0.00 3.28 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 26 G 8.60 4.33 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 0.00 27 K 7.37 4.01 0.00 1.84 1.80 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.59 7.81 28 K 7.51 4.71 0.00 1.84 0.81 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.50 7.81 29 V 8.41 4.54 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 0.73 0.00 0.00 0.98 0.00 0.00 30 S 8.24 4.30 0.00 3.93 3.90 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 31 Q 8.20 3.86 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.15 0.00 0.00 0.00 0.00 0.00 2.46 2.31 0.00 32 A 7.83 4.80 1.28 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 0.00 0.00 0.00 33 L 7.84 5.57 0.00 2.06 1.73 0.91 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.17 4.51 0.00 2.92 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 35 I 7.87 4.18 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.56 0.94 0.00 0.00 36 L 7.85 4.92 0.00 1.91 1.69 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.80 3.72 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 38 Y 7.45 4.92 0.00 2.93 2.82 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 39 T 8.97 4.45 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 1.22 0.00 0.00 40 N 9.46 4.80 0.00 2.87 2.97 0.00 0.00 5.94 7.13 0.00 0.00 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 7.46 3.85 0.00 1.81 1.88 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.09 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.55 7.81 42 K 8.85 3.98 0.00 1.77 1.82 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.49 7.81 43 A 8.18 3.97 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 44 A 9.30 4.03 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 45 V 7.47 4.89 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 0.67 0.00 0.00 0.91 0.00 0.00 46 L 7.71 4.52 0.00 1.83 1.57 0.74 0.87 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 47 V 7.57 3.93 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 0.73 0.00 0.00 0.97 0.00 0.00 48 K 7.52 3.86 0.00 1.83 1.77 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.42 7.81 49 K 8.21 3.91 0.00 1.85 1.99 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.51 7.81 50 V 7.42 3.70 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 0.99 0.00 0.00 1.01 0.00 0.00 51 L 8.50 3.89 0.00 1.76 1.66 0.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.70 3.95 0.00 2.09 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 2.32 2.31 0.00 53 S 7.77 4.07 0.00 3.88 4.14 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 54 A 8.32 3.96 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 55 I 8.37 3.71 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.97 0.91 0.00 0.00 56 A 7.72 4.00 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 57 N 8.27 4.45 0.00 2.69 2.89 0.00 0.00 6.95 8.10 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 58 A 7.41 4.76 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 59 E 7.79 4.05 0.00 2.11 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 0.00 2.65 2.46 0.00 60 H 8.26 4.25 0.00 3.13 3.41 0.00 5.75 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 61 N 8.23 4.73 0.00 2.98 2.69 0.00 0.00 6.91 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 62 D 8.74 4.29 0.00 2.82 2.82 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 63 G 8.61 3.43 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 0.00 0.00 0.00 64 A 7.83 4.59 1.10 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 65 D 8.89 4.37 0.00 2.71 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 I 8.40 3.92 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 1.42 1.09 1.04 0.00 0.00 67 D 7.62 4.51 0.00 2.68 2.80 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 68 D 7.53 4.99 0.00 2.82 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 69 L 7.21 5.25 0.00 1.76 1.62 0.97 1.00 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 70 K 8.10 3.81 0.00 1.73 1.82 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.52 7.81 71 V 8.35 4.04 2.15 0.00 0.00 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 0.98 0.00 0.00 72 T 8.61 4.12 4.27 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 1.26 0.00 0.00 73 K 9.21 4.23 0.00 1.81 2.05 0.00 1.79 0.00 0.00 1.94 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.49 7.81 74 I 8.23 4.44 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 1.42 0.46 0.95 0.00 0.00 75 F 8.53 5.18 0.00 3.08 3.05 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 76 V 8.61 4.82 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 0.80 0.00 0.00 0.95 0.00 0.00 77 D 8.57 5.19 0.00 2.80 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 78 E 8.85 4.32 0.00 1.87 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 2.31 2.33 0.00 79 G 8.37 4.69 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 80 P 0.00 4.39 0.00 2.14 2.09 0.00 3.67 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 1.90 1.84 0.00 81 S 8.46 4.00 0.00 3.87 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 82 M 8.66 4.36 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.50 0.00 83 K 8.62 4.30 0.00 1.64 1.77 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.38 7.81 84 R 8.15 4.86 0.00 1.74 1.74 0.00 3.25 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 85 I 8.23 4.86 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 1.23 0.72 0.91 0.00 0.00 86 M 8.54 4.75 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 87 P 0.00 4.76 0.00 2.11 2.08 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 88 R 8.74 4.59 0.00 2.02 1.87 0.00 3.10 0.00 0.00 3.46 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 89 A 8.43 3.98 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 90 K 9.37 3.78 0.00 1.93 1.96 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.42 7.81 91 G 7.84 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.60 4.70 0.00 1.88 1.82 0.00 3.11 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 93 A 8.58 5.03 1.22 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 0.00 0.00 94 D 8.71 4.69 0.00 2.70 2.60 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 0.00 95 R 8.63 3.78 0.00 1.88 1.90 0.00 3.37 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 96 I 7.74 3.39 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 1.41 0.83 0.94 0.00 0.00 97 L 7.60 4.01 0.00 1.67 1.60 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.29 4.40 0.00 1.83 1.73 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.37 7.81 99 R 8.10 4.42 0.00 1.78 1.84 0.00 3.15 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 100 T 7.98 4.90 4.37 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 1.22 0.00 0.00 101 S 7.21 4.96 0.00 3.89 3.93 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 0.00 102 H 8.55 5.04 0.00 3.07 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.96 3.81 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.55 0.86 0.00 0.00 104 T 8.31 4.54 3.28 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 0.73 0.00 0.00 105 V 8.07 4.65 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.85 0.00 0.00 106 V 8.73 4.64 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 0.88 0.00 0.00 0.94 0.00 0.00 107 V 8.07 4.24 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 0.77 0.00 0.00 0.97 0.00 0.00 108 S 8.19 4.69 0.00 4.00 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 0.00 109 D 8.64 4.41 0.00 2.81 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 0.00 110 R 7.67 4.17 0.00 1.73 1.81 0.00 3.29 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00