NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 M 4.1990 8.3049 120.3502 53.2523 32.9433 177.6045 5 T 2.9314 8.9713 113.7876 62.7852 65.5587 169.3332 6 D 4.3444 9.4571 128.0797 55.2679 41.9285 175.9313 7 R 4.4017 8.5080 124.2582 56.3902 30.8874 177.3681 8 Y 3.5851 8.8537 119.7662 56.5987 36.1956 175.9697 9 S 4.3117 7.3529 112.5128 58.6497 64.4430 174.8349 10 F 4.9157 6.5218 115.9410 54.9578 39.8656 175.4802 11 S 4.3483 8.6411 117.5169 58.8640 63.0379 174.6310 12 L 4.5903 8.4726 122.7668 54.9561 42.3755 176.4041 13 T 4.4295 7.7653 115.7887 61.7985 70.1651 172.9440 14 T 4.5728 7.9404 115.5341 59.4728 72.1943 172.3366 15 F 4.7193 8.5538 120.0607 56.6623 39.9891 176.1784 16 S 4.7175 8.7476 120.0033 56.2842 64.4617 173.3917 17 P 4.1845 0.0000 0.0000 65.5813 31.0446 177.7026 18 S 4.2904 8.0568 110.2396 58.7163 63.4497 174.9038 19 G 3.9930 8.9211 110.1732 45.5742 0.0000 173.5346 20 K 4.4613 7.7919 119.1578 55.2081 33.5163 176.1995 21 L 4.6987 7.3232 122.0819 51.7762 40.7613 177.5127 22 G 3.2277 7.5375 107.6496 47.6819 0.0000 172.0767 23 Q 3.9519 7.7740 119.8460 58.4996 28.8029 179.7709 24 I 3.6629 7.5377 120.4254 64.2352 37.1464 178.0757 25 D 4.3271 7.7674 119.1750 57.7212 40.7087 178.1909 26 Y 4.4096 8.0265 117.1698 61.1747 38.0142 178.5724 27 A 4.0465 8.2904 121.7079 55.4908 18.4854 179.5516 28 L 3.9887 8.1226 117.2724 58.2990 41.7617 179.9603 29 T 3.8414 8.0299 115.2802 66.7726 68.2586 176.4431 30 A 4.0635 8.0056 121.1037 55.1479 18.6354 179.5661 31 V 3.7364 7.6536 116.5459 66.0415 31.4032 178.4355 32 K 4.0176 7.7939 117.3986 59.5243 31.9137 179.0656 33 Q 4.2389 7.9287 117.2505 57.4919 28.8328 177.1179 34 G 3.7487 7.0315 107.9755 44.8075 0.0000 173.4125 35 V 3.6381 7.8827 119.7388 62.5917 31.8914 176.0979 36 T 4.1703 8.2040 122.8420 64.2344 69.5268 173.1499 37 S 5.0033 8.2102 117.8784 57.1865 66.2254 172.7730 38 L 4.8405 9.3798 121.9025 54.6560 44.5777 174.7998 39 G 4.5645 8.3694 104.7105 44.8921 0.0000 172.4177 40 I 4.7107 8.9579 124.1743 59.2235 41.1557 174.0600 41 K 4.7308 8.8365 128.3865 55.1259 33.3795 175.5639 42 A 4.8574 8.9087 131.6715 50.4760 21.6360 175.9019 43 T 4.1703 8.4392 106.5846 63.8406 69.1463 174.8843 44 N 4.9723 8.8448 118.7875 50.3689 37.9044 174.1302 45 G 4.0311 7.1357 107.6554 46.7180 0.0000 171.5793 46 V 5.1056 7.6582 118.0502 61.1569 35.1232 174.6982 47 V 4.7126 8.7295 123.5581 59.9173 34.8100 174.0924 48 I 5.1495 8.4051 116.2565 59.3161 40.3194 174.2454 49 A 4.7135 8.8365 125.1414 51.6346 23.1844 174.5633 50 T 4.5181 8.0857 112.7007 61.5607 70.7431 171.6431 51 E 4.4945 7.9669 123.9827 54.5271 31.1776 176.6888 52 K 4.2586 8.4988 126.6233 55.1535 31.3017 176.8860 53 K 4.2314 7.9579 127.8338 54.5387 30.3849 176.1411 54 S 3.9765 7.8602 113.1357 59.2505 62.8510 173.9451 55 S 4.5203 8.6312 122.3371 58.2141 63.0600 173.8194 56 S 4.5554 7.2661 112.3467 56.9036 65.5844 175.5703 57 P 4.3540 0.0000 0.0000 65.0089 31.2122 177.0202 58 L 4.2222 7.4329 117.7079 55.5197 42.0919 176.8820 59 A 4.2990 7.7073 121.6040 52.1378 19.0696 177.5048 60 M 4.6213 7.9325 119.7218 52.6886 32.0386 177.0162 61 S 4.0306 8.3261 117.8762 61.2726 64.1134 176.8932 62 E 4.1109 8.3502 120.7004 59.3865 29.3297 178.7192 63 T 3.9757 8.0530 107.6668 63.1115 68.7456 173.4449 64 L 4.6685 7.6316 123.6247 53.3663 44.0812 175.2852 65 S 4.8474 8.7400 122.0619 56.9182 64.8964 174.3102 66 K 4.3806 8.6545 123.1244 56.6728 32.7829 175.7363 67 V 4.7483 7.7365 118.6896 61.4922 32.6366 174.5896 68 S 4.9465 9.1736 124.8527 56.5180 65.8292 173.3352 69 L 4.5996 8.4702 125.5816 54.9505 42.2409 175.9344 70 L 4.3616 9.2354 127.1722 56.3706 42.8170 176.4706 71 T 4.7582 7.3091 106.2454 58.6796 71.8632 172.3603 72 P 4.5099 0.0000 0.0000 64.5860 31.1724 176.4094 73 D 4.9254 8.3472 117.6255 53.7723 42.5698 175.0271 74 I 4.6588 8.0810 120.3518 59.6630 41.1960 174.6426 75 G 4.6066 8.8674 112.5592 44.4391 0.0000 171.6456 76 A 5.1609 9.2479 121.4612 50.2686 22.9192 175.6423 77 V 5.3028 8.6474 118.3371 59.9636 34.8709 173.3697 78 Y 4.8632 7.8404 118.0514 56.4015 41.9405 173.6770 79 S 4.1895 8.6394 114.0694 57.3444 67.6184 172.3889 80 G 3.9617 8.3641 112.4952 44.9733 0.0000 175.8957 81 M 4.4542 8.9818 127.8619 54.3282 32.4212 176.4009 82 G 3.7545 8.9573 111.8332 47.5237 0.0000 172.1477 83 P 4.2315 0.0000 0.0000 65.1865 31.3955 178.2671 84 D 4.3131 8.0506 116.7990 57.7053 40.7626 178.0245 85 Y 3.9663 7.7840 119.8073 60.5630 38.5899 178.1571 86 R 3.5545 7.9604 119.5731 59.6319 30.1901 179.0171 87 V 3.5840 7.5166 111.5476 64.2794 31.3922 178.5708 88 L 3.8778 7.8469 118.8398 57.7474 41.3710 179.7493 89 V 3.3688 7.4868 118.3580 65.8111 31.3653 177.9535 90 D 4.2622 7.7125 118.2880 57.1934 40.6905 178.8145 91 K 3.9512 8.1458 119.1351 59.5005 32.1461 179.5898 92 S 4.0912 8.2991 115.6894 61.7819 62.5639 177.0305 93 R 3.9547 7.8382 119.4341 58.9076 29.9299 178.9014 94 K 4.0722 8.1386 119.7671 59.4796 32.3218 179.3684 95 V 3.8105 8.5480 120.8875 64.1819 31.1033 178.0955 96 A 4.0771 8.0760 121.0037 54.8978 17.9976 178.6967 97 H 4.3495 8.5069 115.5333 58.4861 29.1561 177.5657 98 T 3.9226 7.9071 110.8078 64.6333 68.2039 175.2887 99 S 4.7728 7.7717 114.3395 58.0547 62.5492 173.4834 100 Y 4.5248 6.9660 120.5806 58.2155 45.5399 175.3565 101 K 4.0440 8.6265 124.2559 59.4417 32.8889 177.4148 102 R 4.1390 8.2063 121.8674 56.3632 29.9498 176.0765 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 4 M 8.30 4.20 0.00 2.00 1.54 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 2.49 2.53 0.00 5 T 8.97 2.93 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 6 D 9.46 4.34 0.00 2.65 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 7 R 8.51 4.40 0.00 1.60 1.83 0.00 3.22 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 8 Y 8.85 3.59 0.00 2.92 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 0.00 0.00 0.00 0.00 9 S 7.35 4.31 0.00 3.98 3.95 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 10 F 6.52 4.92 0.00 3.16 3.14 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 11 S 8.64 4.35 0.00 3.97 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 12 L 8.47 4.59 0.00 1.63 1.74 0.81 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.77 4.43 4.15 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 0.00 0.00 0.00 1.03 0.00 0.00 14 T 7.94 4.57 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 1.24 0.00 0.00 15 F 8.55 4.72 0.00 3.09 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 16 S 8.75 4.72 0.00 4.02 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 17 P 0.00 4.18 0.00 2.08 2.19 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 18 S 8.06 4.29 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 19 G 8.92 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 0.00 0.00 0.00 20 K 7.79 4.46 0.00 1.75 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.44 1.56 7.81 21 L 7.32 4.70 0.00 1.52 1.35 0.65 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.54 3.23 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 0.00 23 Q 7.77 3.95 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 24 I 7.54 3.66 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.87 0.00 0.00 25 D 7.77 4.33 0.00 2.64 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 26 Y 8.03 4.41 0.00 3.04 2.91 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 27 A 8.29 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 28 L 8.12 3.99 0.00 1.98 1.77 0.93 0.61 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 29 T 8.03 3.84 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 1.22 0.00 0.00 30 A 8.01 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 31 V 7.65 3.74 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 1.13 0.00 0.00 1.04 0.00 0.00 32 K 7.79 4.02 0.00 1.99 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.64 7.81 33 Q 7.93 4.24 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 34 G 7.03 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.88 3.64 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 0.80 0.00 0.00 0.87 0.00 0.00 36 T 8.20 4.17 4.18 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 0.00 0.00 0.00 1.16 0.00 0.00 37 S 8.21 5.00 0.00 3.70 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 0.00 38 L 9.38 4.84 0.00 1.65 1.74 0.90 0.50 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 39 G 8.37 4.56 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 0.00 40 I 8.96 4.71 1.87 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 1.11 0.94 0.91 0.00 0.00 41 K 8.84 4.73 0.00 1.76 1.70 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.43 7.81 42 A 8.91 4.86 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 43 T 8.44 4.17 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 44 N 8.84 4.97 0.00 2.80 2.88 0.00 0.00 5.88 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 45 G 7.14 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.66 5.11 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 0.93 0.00 0.00 0.93 0.00 0.00 47 V 8.73 4.71 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 0.96 0.00 0.00 0.93 0.00 0.00 48 I 8.41 5.15 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.75 0.92 0.00 0.00 49 A 8.84 4.71 1.20 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 0.00 0.00 50 T 8.09 4.52 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 1.12 0.00 0.00 51 E 7.97 4.49 0.00 1.89 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 52 K 8.50 4.26 0.00 1.77 1.76 0.00 1.92 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.41 7.81 53 K 7.96 4.23 0.00 1.66 1.72 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.47 7.81 54 S 7.86 3.98 0.00 3.86 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 55 S 8.63 4.52 0.00 3.91 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 56 S 7.27 4.56 0.00 3.67 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 57 P 0.00 4.35 0.00 2.21 2.17 0.00 3.81 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 58 L 7.43 4.22 0.00 1.62 1.76 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.71 4.30 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 60 M 7.93 4.62 0.00 2.35 1.99 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 2.57 2.48 0.00 61 S 8.33 4.03 0.00 3.98 4.02 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 62 E 8.35 4.11 0.00 2.11 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 2.40 2.36 0.00 63 T 8.05 3.98 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 1.26 0.00 0.00 64 L 7.63 4.67 0.00 1.63 1.59 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.74 4.85 0.00 3.93 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 66 K 8.65 4.38 0.00 1.81 1.82 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.51 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.61 1.47 7.81 67 V 7.74 4.75 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 0.85 0.00 0.00 0.95 0.00 0.00 68 S 9.17 4.95 0.00 3.84 3.73 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 69 L 8.47 4.60 0.00 1.67 1.58 0.93 1.01 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 70 L 9.24 4.36 0.00 1.69 1.68 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 71 T 7.31 4.76 4.22 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 1.18 0.00 0.00 72 P 0.00 4.51 0.00 2.20 2.22 0.00 3.70 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 1.98 1.99 0.00 73 D 8.35 4.93 0.00 2.60 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 I 8.08 4.66 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.65 0.90 0.00 0.00 75 G 8.87 4.61 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 0.00 0.00 0.00 76 A 9.25 5.16 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 77 V 8.65 5.30 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 0.98 0.00 0.00 0.90 0.00 0.00 78 Y 7.84 4.86 0.00 2.92 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.64 4.19 0.00 3.75 3.66 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 80 G 8.36 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 0.00 0.00 0.00 81 M 8.98 4.45 0.00 2.11 2.08 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 2.74 2.64 0.00 82 G 8.96 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.23 0.00 2.16 2.12 0.00 3.63 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 2.13 2.21 0.00 84 D 8.05 4.31 0.00 2.89 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 85 Y 7.78 3.97 0.00 2.39 2.36 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 86 R 7.96 3.55 0.00 1.87 1.97 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 87 V 7.52 3.58 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 0.72 0.00 0.00 0.96 0.00 0.00 88 L 7.85 3.88 0.00 1.72 1.61 0.93 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.49 3.37 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 0.87 0.00 0.00 0.01 0.00 0.00 90 D 7.71 4.26 0.00 2.81 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 91 K 8.15 3.95 0.00 1.90 1.82 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.58 7.81 92 S 8.30 4.09 0.00 3.95 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 93 R 7.84 3.95 0.00 1.88 1.96 0.00 3.18 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.71 0.00 94 K 8.14 4.07 0.00 1.88 1.90 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.42 7.81 95 V 8.55 3.81 2.16 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 1.09 0.00 0.00 0.95 0.00 0.00 96 A 8.08 4.08 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 0.00 0.00 97 H 8.51 4.35 0.00 3.41 3.36 0.00 5.84 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.91 3.92 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 99 S 7.77 4.77 0.00 4.10 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 0.00 100 Y 6.97 4.52 0.00 2.91 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 0.00 101 K 8.63 4.04 0.00 1.75 1.77 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.44 7.81 102 R 8.21 4.14 0.00 1.92 1.83 0.00 3.27 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00