NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3894 8.4449 121.4874 55.6983 31.6728 175.4730 3 Q 5.3824 7.7604 115.3822 53.1275 33.2001 172.5257 4 Y 4.6547 9.0271 119.8554 56.4435 40.6929 173.5680 5 Y 5.9474 8.6675 125.2188 55.0158 42.1926 174.4641 6 G 4.0877 7.3430 112.0084 44.7319 0.0000 171.7106 7 T 4.3218 8.8033 122.7101 62.6191 68.5755 173.6135 8 G 4.1147 8.4060 114.5912 44.5204 0.0000 170.7613 9 R 5.2449 7.9532 123.4638 54.5999 34.6252 174.8951 10 R 4.2747 8.5108 121.6999 56.7947 33.8654 172.2930 11 K 3.3844 8.4175 129.3540 57.5905 30.2926 175.9638 12 E 3.6163 7.9893 129.4280 55.0406 26.4027 176.4423 13 A 5.0990 7.0868 122.7150 52.0910 23.0956 176.9473 14 V 4.7113 8.3899 121.3834 61.1677 35.2138 174.3047 15 A 5.0980 9.0579 127.4911 50.5306 22.8542 175.1091 16 R 4.2959 9.6604 122.1656 54.7129 32.4178 175.5966 17 V 4.3507 7.4623 122.6566 60.9679 33.9997 174.2281 18 F 6.3000 9.1881 126.2554 55.0483 42.6572 174.2720 19 L 5.1652 8.7166 120.7230 53.3698 46.3319 176.2607 20 R 4.6085 8.8134 120.8906 54.6061 33.4478 171.8998 21 P 3.6128 0.0000 0.0000 60.3732 30.8718 175.3280 22 G 3.9330 8.6949 115.1080 46.6763 0.0000 174.8522 23 N 4.5926 8.8593 117.9101 53.7761 38.1148 176.5983 24 G 4.7883 8.6085 108.0071 44.8694 0.0000 173.8010 25 K 4.2691 8.3716 120.4856 56.6596 33.9894 176.2502 26 V 5.4494 8.2343 121.7622 60.6293 35.2301 174.0124 27 T 5.1823 8.4511 121.7489 62.2118 73.2869 172.7820 28 V 5.1034 9.2141 122.7222 61.0050 35.5892 174.8772 29 N 3.8779 8.6344 121.3552 55.0428 36.6354 175.7064 30 G 3.9491 7.7001 106.2471 44.4833 0.0000 172.1957 31 Q 4.5045 7.6396 118.4308 55.5255 33.5626 172.5767 32 D 4.6812 8.5302 125.0933 54.0587 41.7632 176.1630 33 F 4.1302 8.4836 128.0588 61.9390 39.6443 178.4402 34 N 4.6628 8.0400 117.2888 53.0377 37.7823 175.8355 35 E 4.5484 8.8421 119.3086 56.4085 32.4990 175.3231 36 Y 4.5959 7.8487 118.3264 58.3281 39.3167 175.6573 37 F 4.9740 7.5369 117.4473 56.9141 39.7377 174.6097 38 Q 4.1398 7.9061 122.0103 56.2719 29.7944 173.9805 39 G 4.2487 9.0656 118.1766 46.4153 0.0000 174.8571 40 L 4.1280 7.5788 127.1510 53.4834 40.4758 178.6088 41 V 4.1642 7.8192 132.5031 62.1407 30.5655 176.7085 42 R 4.3410 7.4525 117.7739 57.7384 32.9792 176.4428 43 A 3.9407 7.7333 120.8741 55.3713 18.5470 179.7562 44 V 3.9833 8.0217 104.7328 62.9327 31.9548 176.7607 45 A 4.4242 8.9562 125.5636 53.8619 19.4932 179.8721 46 A 4.1677 8.1518 117.0739 54.3066 18.7896 177.8618 47 L 4.3861 7.7775 114.5919 54.8180 42.7492 178.1016 48 E 4.0032 8.4265 121.0918 58.4548 29.6543 176.9849 49 P 3.5742 0.0000 0.0000 65.0288 31.0096 177.5716 50 L 4.2611 7.6547 117.6686 56.0380 41.8110 178.3215 51 R 4.1155 7.9503 117.0543 57.0940 30.3200 176.9171 52 A 4.3190 7.2644 118.5577 52.6982 19.6715 178.1561 53 V 3.9211 7.6663 106.8870 60.5325 32.1326 175.4445 54 D 4.3304 8.0651 117.9255 54.5092 38.1054 174.4006 55 A 4.4903 7.7046 121.7639 51.9170 20.2060 176.0317 56 L 4.5145 8.5017 123.2757 56.7852 43.8837 177.2101 57 G 4.2199 7.9316 105.4667 44.0747 0.0000 173.5425 58 H 4.8630 8.1332 116.4613 54.7772 30.6694 174.5763 59 F 4.8852 7.9943 117.0744 55.7296 43.3707 173.6532 60 D 5.2922 9.2781 123.7178 52.3596 41.4680 175.1152 61 A 4.7320 8.3951 126.1367 51.3326 20.6324 175.0529 62 Y 5.2401 9.5618 124.2991 56.0074 41.1542 174.5820 63 I 4.6249 8.4181 126.8886 59.7364 41.6758 175.0752 64 T 4.5581 8.5185 121.1431 62.1311 72.2626 173.1739 65 V 4.5957 7.7819 126.9711 59.8557 33.5749 175.6135 66 R 4.4106 9.8442 124.7180 56.5206 33.5085 174.7016 67 G 4.0333 9.2347 113.9439 46.6407 0.0000 172.5816 68 G 4.3284 9.1852 106.3124 43.9625 0.0000 172.9136 69 G 4.1491 8.0338 109.0513 43.3138 0.0000 173.3023 70 K 4.1938 7.6189 119.8624 58.9156 33.0374 178.1551 71 S 3.9857 7.7023 115.4551 60.8994 62.9153 176.4073 72 G 3.6845 8.3043 109.3260 47.6474 0.0000 175.8599 73 Q 4.0457 7.9500 119.9469 58.8703 28.7318 178.5538 74 I 3.8438 7.6520 119.3936 63.6008 37.2926 177.5396 75 D 4.5204 7.8219 119.6333 56.6461 41.1908 178.1187 76 A 3.9878 8.0493 120.7339 55.7560 18.2425 179.6260 77 I 3.6332 7.8497 117.8098 64.2312 35.9161 178.1909 78 K 4.3483 8.7256 119.9343 58.1114 32.0347 177.9682 79 L 4.6411 8.0374 120.4409 57.3302 42.5475 178.4503 80 G 3.5049 7.8685 105.2951 47.8291 0.0000 175.6722 81 I 3.6574 7.8853 122.1338 63.9104 35.5511 178.1765 82 A 4.1490 7.6640 121.1897 54.1235 18.3993 179.0948 83 R 4.2790 7.9600 116.8602 58.2457 30.2374 178.3065 84 A 4.3191 8.3075 122.7213 54.4276 18.4450 179.2725 85 L 4.1163 7.5457 116.2699 57.5292 40.6154 178.7178 86 V 3.9610 6.9929 119.1221 64.2335 32.0542 177.5632 87 Q 4.0404 7.6606 119.1251 58.8090 30.3605 176.7151 88 Y 3.7884 7.7575 118.6215 55.2539 35.8313 174.3881 89 N 3.6087 7.6579 116.0223 51.9468 39.2806 172.4864 90 P 4.4640 0.0000 0.0000 63.7803 31.7286 176.4658 91 D 4.9111 8.2557 118.9552 55.3698 40.1205 176.4568 92 Y 4.7054 7.6535 113.3530 57.7708 38.3683 176.8964 93 R 4.5939 7.7157 119.4765 56.8302 32.7199 175.8468 94 A 4.3764 7.9122 119.6412 51.8696 18.1675 176.8681 95 K 4.3307 7.9887 121.6421 58.7173 38.0645 176.6424 96 L 4.4890 7.4043 119.0061 56.2128 43.0181 177.6366 97 K 4.0873 8.1721 118.8543 59.0170 31.8519 175.6606 98 P 4.1952 0.0000 0.0000 65.6256 31.8171 176.2242 99 L 4.1492 8.0658 118.2687 55.1291 42.1289 178.9684 100 G 3.9112 9.0214 113.6856 47.8590 0.0000 174.3784 101 F 3.9622 8.5041 118.2823 59.1611 39.1420 175.8435 102 L 4.2848 8.2355 122.8079 57.1126 42.4957 177.3872 103 T 3.9808 7.5855 113.2035 64.0078 68.8861 172.6001 104 R 4.1884 8.3572 118.2784 59.0616 31.6514 176.0178 105 D 4.8114 8.2229 122.1872 54.8505 38.7447 175.6875 106 A 4.3392 8.1700 132.0200 51.9645 18.7249 178.1373 107 R 4.4997 7.7452 120.6677 55.4800 31.2471 177.0470 108 V 4.4668 7.9052 115.3959 59.0817 35.4594 176.6634 109 V 3.8020 8.2359 122.7242 62.3116 29.4296 175.1118 110 E 3.9116 8.4275 122.8615 55.7581 29.7584 177.5475 111 R 3.9060 8.3203 120.6957 56.4960 30.6122 174.9861 112 K 4.5674 8.2787 120.3422 54.3711 34.4489 175.3734 113 K 4.5412 8.3348 124.6549 54.4357 34.3822 175.4099 114 Y 4.2871 8.8431 118.8918 58.0310 38.5372 175.6697 115 G 3.8134 9.6605 111.6139 46.2173 0.0000 175.0239 116 K 4.6070 8.0521 117.2203 56.4064 34.5043 177.9954 117 H 3.9791 7.3039 119.3988 57.9712 30.1837 176.2724 118 K 4.5614 7.3823 116.9750 55.4103 32.8020 177.2964 119 A 4.2651 9.1591 123.9831 52.6143 18.8406 179.7289 120 R 4.5910 7.8630 109.5913 56.6059 33.1969 175.9838 121 R 4.1220 7.8894 118.0272 55.7111 28.1059 174.5468 122 A 4.2725 8.0631 126.0003 50.3760 19.2870 175.9186 123 P 4.4811 0.0000 0.0000 62.5126 31.8190 175.8091 124 Q 4.1190 8.4265 120.5411 55.8591 29.4348 175.1853 125 Y 4.4165 8.6570 126.8131 58.0014 39.4368 174.0845 126 S 4.4972 9.1251 121.5709 59.5646 64.9950 174.8083 127 K 4.4927 8.4395 122.9947 56.4057 32.0079 176.0930 128 R 4.1839 7.6699 117.8611 56.1775 29.7091 175.8994 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 2 E 8.44 4.39 0.00 1.96 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 0.00 2.19 2.34 0.00 3 Q 7.76 5.38 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.56 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 4 Y 9.03 4.65 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 5 Y 8.67 5.95 0.00 3.22 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 6 G 7.34 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 0.00 0.00 0.00 7 T 8.80 4.32 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 1.30 0.00 0.00 8 G 8.41 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 0.00 0.00 0.00 0.00 9 R 7.95 5.24 0.00 1.67 1.79 0.00 3.32 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 10 R 8.51 4.27 0.00 1.72 1.79 0.00 3.52 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.48 0.00 11 K 8.42 3.38 0.00 1.89 1.79 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.31 1.43 7.81 12 E 7.99 3.62 0.00 2.12 2.29 0.00 0.00 0.00 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 2.26 0.00 13 A 7.09 5.10 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.39 4.71 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 1.03 0.00 0.00 0.95 0.00 0.00 15 A 9.06 5.10 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 16 R 9.66 4.30 0.00 1.43 1.53 0.00 3.32 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.56 0.00 17 V 7.46 4.35 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 0.98 0.00 0.00 0.73 0.00 0.00 18 F 9.19 6.30 0.00 3.35 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 19 L 8.72 5.17 0.00 1.55 1.33 0.67 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.81 4.61 0.00 1.67 1.79 0.00 3.18 0.00 0.00 3.16 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 21 P 0.00 3.61 0.00 1.70 1.46 0.00 3.60 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.43 0.00 22 G 8.69 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 0.00 0.00 0.00 23 N 8.86 4.59 0.00 2.94 3.06 0.00 0.00 6.09 7.06 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 24 G 8.61 4.79 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 25 K 8.37 4.27 0.00 1.82 2.08 0.00 1.26 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.72 1.41 7.81 26 V 8.23 5.45 1.95 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 1.05 0.00 0.00 0.93 0.00 0.00 27 T 8.45 5.18 4.38 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 1.31 0.00 0.00 28 V 9.21 5.10 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 1.01 0.00 0.00 0.93 0.00 0.00 29 N 8.63 3.88 0.00 2.51 2.73 0.00 0.00 6.99 7.53 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 30 G 7.70 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 0.00 0.00 0.00 31 Q 7.64 4.50 0.00 1.99 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.93 0.00 0.00 0.00 0.00 0.00 2.16 2.06 0.00 32 D 8.53 4.68 0.00 2.79 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 33 F 8.48 4.13 0.00 3.20 3.06 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 34 N 8.04 4.66 0.00 2.79 2.84 0.00 0.00 6.56 7.66 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 35 E 8.84 4.55 0.00 1.81 2.05 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 2.23 2.24 0.00 36 Y 7.85 4.60 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.54 4.97 0.00 2.46 2.51 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 38 Q 7.91 4.14 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.99 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 39 G 9.07 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 0.00 0.00 0.00 40 L 7.58 4.13 0.00 1.54 1.37 0.66 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.82 4.16 2.05 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 0.80 0.00 0.00 0.94 0.00 0.00 42 R 7.45 4.34 0.00 1.66 1.71 0.00 3.24 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 43 A 7.73 3.94 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 44 V 8.02 3.98 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 0.82 0.00 0.00 1.03 0.00 0.00 45 A 8.96 4.42 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 46 A 8.15 4.17 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.78 4.39 0.00 1.77 1.65 0.70 0.83 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 48 E 8.43 4.00 0.00 2.26 2.47 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 2.69 2.42 0.00 49 P 0.00 3.57 0.00 2.21 2.39 0.00 3.82 0.00 0.00 4.06 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 50 L 7.65 4.26 0.00 1.78 1.90 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 51 R 7.95 4.12 0.00 1.92 1.93 0.00 3.40 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 52 A 7.26 4.32 1.08 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 0.00 0.00 53 V 7.67 3.92 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 0.89 0.00 0.00 1.11 0.00 0.00 54 D 8.07 4.33 0.00 2.82 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 55 A 7.70 4.49 1.53 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 0.00 0.00 0.00 56 L 8.50 4.51 0.00 1.59 1.66 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.93 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 0.00 0.00 0.00 0.00 58 H 8.13 4.86 0.00 3.36 2.94 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.99 4.89 0.00 2.79 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 60 D 9.28 5.29 0.00 2.75 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 61 A 8.40 4.73 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 62 Y 9.56 5.24 0.00 3.04 3.03 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 63 I 8.42 4.62 1.71 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 0.71 0.79 0.00 0.00 64 T 8.52 4.56 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 1.14 0.00 0.00 65 V 7.78 4.60 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 0.84 0.00 0.00 1.02 0.00 0.00 66 R 9.84 4.41 0.00 1.79 1.76 0.00 3.05 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 67 G 9.23 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 68 G 9.19 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 69 G 8.03 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 0.00 0.00 0.00 0.00 70 K 7.62 4.19 0.00 1.82 1.51 0.00 1.33 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.15 7.81 71 S 7.70 3.99 0.00 3.74 3.77 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 72 G 8.30 3.68 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 0.00 0.00 0.00 73 Q 7.95 4.05 0.00 2.47 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 74 I 7.65 3.84 1.79 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 -0.03 0.76 0.00 0.00 75 D 7.82 4.52 0.00 2.93 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 76 A 8.05 3.99 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 77 I 7.85 3.63 2.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.15 0.94 0.00 0.00 78 K 8.73 4.35 0.00 1.78 1.99 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.66 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.64 1.62 7.81 79 L 8.04 4.64 0.00 1.71 1.76 0.96 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.87 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 0.00 0.00 0.00 81 I 7.89 3.66 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.31 0.83 0.00 0.00 82 A 7.66 4.15 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 83 R 7.96 4.28 0.00 2.03 2.10 0.00 3.27 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 84 A 8.31 4.32 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 85 L 7.55 4.12 0.00 1.47 1.55 1.06 0.94 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 86 V 6.99 3.96 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 0.82 0.00 0.00 1.05 0.00 0.00 87 Q 7.66 4.04 0.00 2.29 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.57 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 88 Y 7.76 3.79 0.00 2.10 2.38 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 89 N 7.66 3.61 0.00 2.60 2.51 0.00 0.00 6.81 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 90 P 0.00 4.46 0.00 2.23 2.14 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 91 D 8.26 4.91 0.00 3.19 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 92 Y 7.65 4.71 0.00 3.02 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 93 R 7.72 4.59 0.00 1.89 1.89 0.00 3.26 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 94 A 7.91 4.38 1.23 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 95 K 7.99 4.33 0.00 1.82 1.85 0.00 1.26 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.87 1.11 7.81 96 L 7.40 4.49 0.00 1.73 1.86 1.05 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.17 4.09 0.00 1.76 1.98 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.54 7.81 98 P 0.00 4.20 0.00 2.10 2.04 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 99 L 8.07 4.15 0.00 2.14 2.46 1.18 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 G 9.02 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 0.00 101 F 8.50 3.96 0.00 2.97 3.18 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 0.00 102 L 8.24 4.28 0.00 1.94 1.69 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.59 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 1.23 0.00 0.00 104 R 8.36 4.19 0.00 1.73 1.89 0.00 3.21 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.76 0.00 105 D 8.22 4.81 0.00 2.74 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.17 4.34 1.25 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 0.00 0.00 107 R 7.75 4.50 0.00 1.78 1.87 0.00 3.19 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 108 V 7.91 4.47 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 0.70 0.00 0.00 0.93 0.00 0.00 109 V 8.24 3.80 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 0.81 0.00 0.00 0.92 0.00 0.00 110 E 8.43 3.91 0.00 2.11 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 2.29 2.33 0.00 111 R 8.32 3.91 0.00 1.77 1.92 0.00 3.13 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 112 K 8.28 4.57 0.00 1.71 1.62 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.37 7.81 113 K 8.33 4.54 0.00 1.87 2.06 0.00 1.71 0.00 0.00 1.97 0.00 0.00 3.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.48 1.50 7.81 114 Y 8.84 4.29 0.00 3.00 2.86 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 0.00 115 G 9.66 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 0.00 0.00 0.00 116 K 8.05 4.61 0.00 1.96 1.72 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.44 7.81 117 H 7.30 3.98 0.00 3.40 3.32 0.00 5.64 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 0.00 118 K 7.38 4.56 0.00 1.90 1.71 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.39 7.81 119 A 9.16 4.27 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 0.00 120 R 7.86 4.59 0.00 1.78 1.92 0.00 3.17 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 121 R 7.89 4.12 0.00 1.83 1.96 0.00 3.40 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 122 A 8.06 4.27 1.23 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 0.00 123 P 0.00 4.48 0.00 2.19 2.01 0.00 3.73 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 124 Q 8.43 4.12 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 125 Y 8.66 4.42 0.00 2.93 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 0.00 126 S 9.13 4.50 0.00 3.98 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 0.00 127 K 8.44 4.49 0.00 1.33 1.78 0.00 1.39 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.22 1.37 7.81 128 R 7.67 4.18 0.00 1.94 1.86 0.00 3.19 0.00 0.00 3.40 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