NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.4355 8.2893 120.3567 55.6007 34.3031 176.4825 4 S 4.2079 7.6871 113.5369 57.6268 65.0423 173.0740 5 D 4.3925 9.5032 124.0169 57.6645 40.9816 180.3891 6 L 4.0241 7.9091 118.7229 58.0625 41.6791 179.7270 7 V 3.7351 8.1547 118.2806 66.1457 31.2249 178.0804 8 T 3.8779 7.9204 114.8719 66.4756 68.7172 176.0842 9 K 4.0657 8.2870 121.5058 59.4254 32.1855 178.4124 10 F 4.1808 8.3303 120.8593 61.6019 39.1551 176.9069 11 E 3.8243 8.3852 116.2898 58.3029 29.3084 178.5426 12 S 4.3077 7.5714 112.7836 58.3761 64.0679 174.0250 13 L 4.3204 7.2393 124.3438 53.4838 42.6261 177.6328 14 I 3.5832 8.1856 122.5031 64.0199 37.7449 177.8599 15 I 3.4847 7.5750 119.1335 63.4562 37.5163 177.3440 16 S 3.9615 7.7243 114.1660 59.9385 62.9266 175.3531 17 K 4.3676 7.6987 120.9438 55.3144 32.4029 175.8049 18 Y 4.0301 7.2252 122.6544 56.3554 39.0993 173.5942 19 P 4.1793 0.0000 0.0000 62.6256 31.9629 175.6949 20 V 4.1055 8.3523 124.9697 62.2692 32.2962 177.0423 21 S 4.7228 8.2338 126.6710 56.0844 61.5470 170.2964 22 F 4.9525 7.6946 122.5614 57.9322 39.8519 176.6399 23 T 4.3627 9.1196 118.1146 61.6150 70.8672 176.3566 24 K 4.0024 8.7645 127.4864 60.9096 31.5798 177.5005 25 E 4.2844 8.0987 118.7797 60.5788 29.6931 181.0618 26 Q 3.9117 8.1642 117.9865 59.2719 28.9653 178.7669 27 S 4.2009 8.3835 116.2605 61.6200 62.7637 176.8493 28 A 3.9907 7.9639 123.3817 55.3450 18.1940 179.8048 29 Q 4.0649 8.1808 117.2110 58.1107 28.7187 178.6843 30 A 4.0906 8.1591 122.0453 55.2160 18.4780 179.3120 31 A 4.0026 7.8780 118.8885 55.5340 18.2307 179.8519 32 Q 3.7977 8.1640 116.4439 59.0233 28.7367 179.1663 33 W 4.3030 8.0701 119.8293 59.7556 29.0120 178.2111 34 E 4.0333 8.5959 119.6377 59.1241 29.0531 179.0897 35 S 4.0961 8.1646 114.5183 61.3334 63.0401 176.3705 36 V 3.4827 7.8019 122.2144 65.7356 31.1755 178.0310 37 L 4.0244 8.2180 118.4429 57.9208 41.3150 179.6571 38 K 4.0331 8.3138 117.7005 59.0614 32.0694 178.5766 39 S 4.5651 8.4972 112.0966 57.3205 63.5568 174.0994 40 G 4.0367 7.9056 110.1949 47.4268 0.0000 174.0736 41 Q 4.7621 8.0163 115.7236 55.2710 29.8860 178.7276 42 I 3.9840 8.0718 120.2502 64.5896 37.3133 177.0715 43 Q 3.9787 8.2202 120.1075 58.9724 28.6340 176.7934 44 P 4.3835 0.0000 0.0000 65.5642 31.3223 176.7481 45 H 4.7408 8.2128 114.7788 55.8099 28.8896 176.7256 46 L 4.1112 7.9926 123.5253 57.9206 41.4146 179.0553 47 D 4.5131 8.2362 118.5099 57.3462 40.7659 178.4570 48 Q 3.9961 8.1116 119.5814 59.1128 29.1832 177.4512 49 L 3.9832 8.5575 121.9021 58.5433 41.9176 178.6162 50 N 4.3437 8.4694 116.7356 56.5656 38.6969 176.6542 51 L 3.9552 7.9144 120.8818 58.0005 42.3620 178.6182 52 V 3.7399 8.1763 118.6495 66.1181 31.3093 177.6120 53 L 4.3291 7.7117 117.0404 55.3808 41.6615 178.6800 54 R 3.6937 7.4503 118.7827 58.6535 30.1220 176.5363 55 D 4.7860 7.6054 115.3106 53.9554 42.1078 175.9682 56 N 4.9727 7.5373 116.5571 51.3612 42.1994 175.4153 57 T 3.5034 8.5329 119.5151 65.7775 68.9911 174.3394 58 F 5.1041 7.2578 117.6403 55.0691 42.5560 176.1514 59 I 3.4460 8.9745 123.2849 63.9235 36.7613 177.7187 60 V 4.2104 7.6884 117.9957 62.5926 31.7625 175.0709 61 S 3.6928 7.6476 110.8376 59.2805 60.7696 172.3629 62 T 4.6317 7.7312 107.9003 59.8906 70.9709 174.6770 63 L 3.9126 8.0979 121.1942 56.8688 41.8095 177.0630 64 Y 4.6771 7.0286 113.6202 54.8700 41.7959 173.2458 65 P 4.0174 0.0000 0.0000 62.8768 32.1573 176.4077 66 T 4.8067 8.3647 111.8762 59.5318 72.6997 175.3407 67 S 3.7304 8.5263 114.9440 61.8729 62.6803 176.3625 68 T 3.9483 7.6188 118.5899 66.6584 68.1316 176.1283 69 D 4.6202 8.0300 120.1011 57.3628 40.9692 178.8136 70 V 3.4673 7.2872 118.0683 66.4244 31.1987 177.8299 71 H 4.3301 8.3586 116.3002 58.8988 28.4736 178.0755 72 V 3.5594 8.0218 120.1693 65.9014 31.3806 177.7814 73 F 4.2083 8.7607 120.7039 61.4307 38.9639 176.7476 74 E 3.8846 8.2345 118.0600 58.5959 29.5193 178.4019 75 V 3.9506 7.3709 118.2378 63.7312 32.1391 178.2243 76 A 3.9922 8.7203 121.8985 54.5851 18.2312 179.0268 77 L 3.7205 8.0204 119.5485 57.9943 42.0651 177.6639 78 P 4.2367 0.0000 0.0000 65.3936 31.2175 178.0101 79 L 3.8553 7.6186 120.3614 58.2747 41.9884 179.0025 80 I 3.6306 7.9960 119.9655 64.3687 37.0224 178.6056 81 K 3.9856 8.1612 119.2739 59.5650 31.8228 179.0653 82 D 4.4339 8.0771 119.1606 56.9690 40.5875 178.8627 83 L 4.1013 7.9169 120.4713 57.1443 41.8212 179.2335 84 V 3.7272 8.1881 118.3370 66.0775 31.2589 178.0197 85 A 4.0950 7.9119 119.6011 54.4233 18.2670 178.6897 86 S 4.5488 7.9099 111.0862 57.4231 63.5025 173.8831 87 S 4.3217 7.2725 117.6962 58.3273 62.5874 174.6241 88 K 4.0423 8.5874 126.5359 58.9018 32.4857 177.3345 89 D 4.2775 7.9757 117.4816 52.2298 43.7952 175.7584 90 V 3.3132 8.1789 127.7402 65.8382 31.6256 177.4112 91 K 3.7875 7.8936 118.8560 59.8226 32.0466 178.6737 92 S 4.0928 7.9449 115.1832 61.6877 62.4616 176.8385 93 T 3.8924 7.4199 117.3168 66.8876 68.0845 175.9293 94 Y 4.6481 7.9929 118.6713 61.7638 37.7079 179.1077 95 T 3.9850 8.0922 115.4141 66.6928 68.5736 176.5866 96 T 3.9925 7.4855 116.2389 65.0801 68.8989 174.3178 97 Y 5.0664 7.6007 118.6221 56.8261 39.4709 177.9356 98 R 3.9142 8.3010 120.8856 59.8157 30.3776 177.8186 99 H 4.4962 7.8946 115.0022 58.1437 29.0231 177.5687 100 I 3.8763 7.8666 121.3595 64.5588 36.9417 178.1726 101 L 4.0926 8.2790 119.7786 57.7030 41.4652 179.2912 102 R 3.9239 8.1345 118.7028 59.5907 29.9063 178.3642 103 W 4.3025 8.3310 127.4056 60.1506 30.6475 178.1837 104 I 3.5010 8.5353 120.5369 64.2438 36.2308 177.5494 105 D 4.3105 8.3853 119.2255 57.6741 40.8898 177.5728 106 Y 3.8991 7.8939 119.5551 61.2326 38.7911 178.1856 107 M 3.6936 8.0016 119.7855 58.0840 31.7854 178.8533 108 Q 4.0272 8.1387 118.0424 58.8208 28.8762 178.3195 109 N 4.2205 7.5945 118.3562 55.8274 38.5354 176.9957 110 L 3.6951 7.5082 121.1743 57.8308 42.1357 177.5784 111 L 4.3516 7.7467 115.1478 53.8903 41.8019 176.0937 112 E 3.7250 7.7703 117.0910 56.8061 27.4015 175.2207 113 V 3.7437 7.7839 117.4828 62.6941 32.4495 175.6656 114 S 4.2393 8.5269 120.0834 58.1431 63.4607 174.9902 115 S 4.0190 8.8398 117.3515 62.3971 61.9117 176.5775 116 T 4.1156 7.3598 116.9682 65.9779 68.3690 176.0079 117 D 4.6071 8.1293 119.5599 54.5980 41.4614 177.2100 118 K 4.2648 7.3914 117.9641 56.1705 32.7621 175.7555 119 L 4.3420 9.0949 125.8812 54.8526 42.8633 177.2102 120 E 4.3748 8.6159 123.7596 55.2651 30.9868 175.2633 121 I 3.8328 8.3051 115.5502 61.0717 35.3697 177.0836 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 3 M 8.29 4.44 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 4 S 7.69 4.21 0.00 4.25 3.98 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 5 D 9.50 4.39 0.00 2.80 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 6 L 7.91 4.02 0.00 1.92 1.80 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.15 3.74 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 1.23 0.00 0.00 1.00 0.00 0.00 8 T 7.92 3.88 4.42 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 1.22 0.00 0.00 9 K 8.29 4.07 0.00 2.04 1.85 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.73 7.81 10 F 8.33 4.18 0.00 3.12 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 11 E 8.39 3.82 0.00 1.98 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 2.41 2.63 0.00 12 S 7.57 4.31 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 13 L 7.24 4.32 0.00 1.53 1.45 0.91 0.78 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 14 I 8.19 3.58 1.79 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 1.45 1.55 0.80 0.00 0.00 15 I 7.58 3.48 1.68 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.58 0.84 0.00 0.00 16 S 7.72 3.96 0.00 3.33 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 17 K 7.70 4.37 0.00 1.67 1.82 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.46 7.81 18 Y 7.23 4.03 0.00 2.82 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 19 P 0.00 4.18 0.00 2.07 1.91 0.00 2.80 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 20 V 8.35 4.11 1.83 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 -0.55 0.00 0.00 0.92 0.00 0.00 21 S 8.23 4.72 0.00 3.64 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 22 F 7.69 4.95 0.00 3.03 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 23 T 9.12 4.36 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 1.32 0.00 0.00 24 K 8.76 4.00 0.00 1.78 1.88 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.09 7.81 25 E 8.10 4.28 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 2.31 1.96 0.00 26 Q 8.16 3.91 0.00 2.28 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 27 S 8.38 4.20 0.00 4.08 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 28 A 7.96 3.99 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 29 Q 8.18 4.06 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.32 0.00 30 A 8.16 4.09 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 31 A 7.88 4.00 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 32 Q 8.16 3.80 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 33 W 8.07 4.30 0.00 3.54 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 34 E 8.60 4.03 0.00 2.14 2.19 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 2.34 2.36 0.00 35 S 8.16 4.10 0.00 4.08 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 36 V 7.80 3.48 2.33 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 1.18 0.00 0.00 0.48 0.00 0.00 37 L 8.22 4.02 0.00 1.95 1.74 1.08 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.31 4.03 0.00 1.92 1.89 0.00 1.70 0.00 0.00 1.91 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.57 7.81 39 S 8.50 4.57 0.00 3.97 3.98 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 40 G 7.91 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 41 Q 8.02 4.76 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.55 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 42 I 8.07 3.98 1.93 0.00 0.00 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 1.61 0.92 0.97 0.00 0.00 43 Q 8.22 3.98 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 44 P 0.00 4.38 0.00 2.23 2.19 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.10 0.00 45 H 8.21 4.74 0.00 3.63 3.56 0.00 5.82 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.99 4.11 0.00 1.86 1.68 0.69 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.24 4.51 0.00 2.75 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 48 Q 8.11 4.00 0.00 2.16 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.83 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 49 L 8.56 3.98 0.00 1.83 1.85 -0.07 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.47 4.34 0.00 3.17 3.09 0.00 0.00 6.89 6.18 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 51 L 7.91 3.96 0.00 1.70 1.87 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.18 3.74 2.25 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 0.96 0.00 0.00 1.16 0.00 0.00 53 L 7.71 4.33 0.00 1.54 1.58 0.06 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 54 R 7.45 3.69 0.00 1.66 1.99 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.27 0.00 55 D 7.61 4.79 0.00 2.58 2.62 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 56 N 7.54 4.97 0.00 2.73 2.70 0.00 0.00 7.15 7.05 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 57 T 8.53 3.50 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 0.20 0.00 0.00 58 F 7.26 5.10 0.00 3.12 3.30 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 59 I 8.97 3.45 1.63 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.02 0.18 0.00 0.00 60 V 7.69 4.21 2.09 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 0.18 0.00 0.00 0.91 0.00 0.00 61 S 7.65 3.69 0.00 4.06 3.89 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 0.00 0.00 0.00 62 T 7.73 4.63 4.36 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 1.59 0.00 0.00 63 L 8.10 3.91 0.00 0.77 0.55 0.82 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.03 4.68 0.00 2.72 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 65 P 0.00 4.02 0.00 1.88 1.67 0.00 3.53 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.67 0.00 66 T 8.36 4.81 4.43 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 1.46 0.00 0.00 67 S 8.53 3.73 0.00 4.02 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 68 T 7.62 3.95 4.30 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 1.23 0.00 0.00 69 D 8.03 4.62 0.00 2.80 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 70 V 7.29 3.47 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 0.94 0.00 0.00 -0.01 0.00 0.00 71 H 8.36 4.33 0.00 3.31 3.37 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.02 3.56 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 0.82 0.00 0.00 0.86 0.00 0.00 73 F 8.76 4.21 0.00 2.80 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 74 E 8.23 3.88 0.00 2.16 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 0.00 2.30 2.27 0.00 75 V 7.37 3.95 2.09 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 0.99 0.00 0.00 0.95 0.00 0.00 76 A 8.72 3.99 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.02 3.72 0.00 0.73 1.11 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.24 0.00 2.25 2.23 0.00 3.63 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 2.11 1.93 0.00 79 L 7.62 3.86 0.00 1.88 1.83 0.89 0.99 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 80 I 8.00 3.63 1.92 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.83 0.97 0.00 0.00 81 K 8.16 3.99 0.00 1.96 1.86 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.66 7.81 82 D 8.08 4.43 0.00 2.86 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 83 L 7.92 4.10 0.00 1.76 1.79 0.83 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.19 3.73 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 1.06 0.00 0.00 1.19 0.00 0.00 85 A 7.91 4.09 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 86 S 7.91 4.55 0.00 4.08 4.09 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 87 S 7.27 4.32 0.00 4.01 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 88 K 8.59 4.04 0.00 1.78 1.85 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.37 7.81 89 D 7.98 4.28 0.00 2.73 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 0.00 0.00 0.00 0.00 90 V 8.18 3.31 1.86 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 0.21 0.00 0.00 0.81 0.00 0.00 91 K 7.89 3.79 0.00 1.83 1.77 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.59 7.81 92 S 7.94 4.09 0.00 4.01 3.85 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 0.00 0.00 0.00 0.00 93 T 7.42 3.89 4.32 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 1.44 0.00 0.00 94 Y 7.99 4.65 0.00 3.12 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 95 T 8.09 3.98 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 1.20 0.00 0.00 96 T 7.49 3.99 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 0.46 0.00 0.00 97 Y 7.60 5.07 0.00 3.15 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 98 R 8.30 3.91 0.00 1.54 1.86 0.00 3.08 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.91 0.00 99 H 7.89 4.50 0.00 3.33 3.40 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.87 3.88 2.17 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.68 1.13 0.00 0.00 101 L 8.28 4.09 0.00 1.84 1.70 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.13 3.92 0.00 1.94 2.21 0.00 3.06 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 103 W 8.33 4.30 0.00 3.38 3.40 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 0.00 104 I 8.54 3.50 2.18 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.78 1.03 0.00 0.00 105 D 8.39 4.31 0.00 2.88 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 0.00 106 Y 7.89 3.90 0.00 3.18 3.07 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 0.00 0.00 0.00 0.00 107 M 8.00 3.69 0.00 0.51 0.60 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.02 0.00 108 Q 8.14 4.03 0.00 2.37 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.63 2.38 0.00 109 N 7.59 4.22 0.00 2.88 2.72 0.00 0.00 6.48 6.40 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 0.00 110 L 7.51 3.70 0.00 1.03 1.56 0.87 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.75 4.35 0.00 1.69 1.69 0.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 112 E 7.77 3.72 0.00 2.12 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 2.20 2.33 0.00 113 V 7.78 3.74 2.20 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 0.80 0.00 0.00 1.14 0.00 0.00 114 S 8.53 4.24 0.00 4.04 3.98 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 0.00 115 S 8.84 4.02 0.00 3.87 3.98 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 0.00 116 T 7.36 4.12 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 0.00 117 D 8.13 4.61 0.00 2.73 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 0.00 118 K 7.39 4.26 0.00 1.75 1.82 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.65 7.81 119 L 9.09 4.34 0.00 1.55 1.68 1.00 0.99 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 0.00 120 E 8.62 4.37 0.00 2.03 1.71 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 2.21 1.87 0.00 121 I 8.31 3.83 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 1.27 1.10 0.91 0.00 0.00