NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4601 8.3049 120.3271 55.5288 33.6822 173.0241 2 I 4.3353 7.7150 120.5340 60.6588 39.1487 175.1308 3 D 4.6105 8.8960 123.0122 54.4352 40.6492 175.2444 4 D 4.6462 8.3929 118.3885 56.9325 43.2660 176.4861 5 M 4.5494 8.1807 113.0539 54.6154 32.0760 173.9794 6 A 3.5780 8.5631 125.5762 52.4058 14.7696 176.3584 7 V 4.3895 7.5865 116.8272 62.7211 35.3811 176.1872 8 P 4.9084 0.0000 0.0000 62.1052 32.8683 177.9566 9 L 4.1266 8.9531 119.8969 55.7446 42.5874 174.3997 10 T 4.6933 8.3380 122.2770 62.2261 70.2378 175.0001 11 F 5.3165 8.9123 122.3768 56.2468 40.3414 174.4067 12 T 4.2965 8.5782 113.6472 61.9404 69.2842 173.6315 13 D 4.6303 8.7447 117.2016 57.0652 41.4563 178.3414 14 A 4.0775 8.1063 120.5904 55.1679 18.3535 179.1445 15 A 4.2783 8.6173 118.6086 55.4918 18.2950 179.6609 16 A 4.0066 8.3996 118.8032 55.4036 18.6765 179.2793 17 N 4.2628 8.1617 115.0744 56.5314 38.6428 177.4895 18 K 3.8069 8.4725 121.2063 59.6771 32.0159 178.2301 19 V 3.8229 7.4041 118.8515 64.8935 31.1831 177.8015 20 K 3.9018 8.7155 119.4895 59.7510 32.0688 179.1811 21 S 4.1817 7.7070 116.0427 61.0743 63.0161 175.9502 22 L 4.0704 7.2079 120.8593 57.7832 40.4232 179.2840 23 I 3.4830 7.5819 114.7821 64.1370 37.8506 178.4859 24 S 4.3350 7.5491 115.9814 60.6245 62.3348 175.9472 25 E 4.1483 7.3982 119.6091 58.2164 29.5116 177.7380 26 E 4.0644 8.2174 117.8086 56.9814 29.6656 177.1355 27 E 3.8546 7.5270 116.6944 56.2168 28.3741 174.7925 28 N 4.2690 7.6488 113.4768 54.4915 39.1708 176.3902 29 T 4.9617 7.5029 124.2199 62.6436 66.8396 172.8316 30 D 5.3338 7.1388 124.8631 54.1599 42.6568 176.0988 31 L 4.2571 7.6948 120.2314 54.9798 43.4373 177.7716 32 K 4.6745 8.0198 120.9555 54.3508 34.7392 175.7879 33 L 4.4078 8.5667 127.6427 55.6374 43.6361 176.1996 34 R 5.1611 9.0724 125.1321 53.6772 31.8595 174.3835 35 V 3.7932 7.7193 126.2629 62.7835 33.5100 173.9181 36 Y 5.4037 8.0140 122.4945 54.7837 42.2981 173.5001 37 I 4.5000 8.4496 120.1915 60.8014 37.2907 176.7610 38 T 4.6625 8.3725 121.7322 63.5799 71.1839 175.8186 39 G 4.2200 7.9242 110.3458 45.2652 0.0000 171.3973 40 G 3.9700 8.4763 105.4553 46.1931 0.0000 178.3876 41 G 3.9416 8.1035 113.5243 44.9680 0.0000 172.3859 42 C 4.2631 8.5971 118.4020 62.0685 31.3884 175.6022 43 S 4.9384 6.8551 115.3296 57.6200 63.1500 173.3859 44 G 4.2733 8.0563 109.8512 45.0920 0.0000 173.8465 45 F 4.8460 8.7477 114.5526 57.0151 39.5482 174.5062 46 Q 3.6756 6.1326 116.9684 52.5836 31.6088 170.7184 47 Y 4.2489 6.9094 127.2087 57.9627 37.5616 169.6809 48 G 3.3886 8.2008 112.3745 45.5247 0.0000 171.5986 49 F 4.8044 8.4001 123.1100 55.8319 41.0036 174.8554 50 T 4.0405 8.2968 116.2971 60.2371 71.6763 172.5970 51 F 4.9801 8.0930 122.9750 55.9453 38.8801 174.8609 52 D 4.7774 9.3137 125.0655 52.3265 42.4343 176.0965 53 E 4.3179 8.9705 127.9937 57.9273 31.7007 178.4786 54 K 4.0078 8.5046 114.9969 57.9528 30.8898 176.2038 55 V 4.1949 5.4500 117.6655 62.0010 40.3000 170.2276 56 N 4.2801 8.1239 123.1409 52.6701 34.5262 172.8522 57 D 4.2856 8.1438 119.6902 55.9304 41.6232 177.0473 58 G 3.6911 8.8574 111.0135 46.7353 0.0000 173.3749 59 D 4.7274 7.8998 118.5119 51.7470 43.8783 174.9690 60 L 4.3289 8.2801 125.8271 55.2876 43.2291 176.5870 61 T 5.2290 8.4589 111.6458 59.9826 71.8940 172.3257 62 I 4.8205 9.4021 120.7067 58.5208 39.9453 174.9390 63 E 4.1500 9.0795 127.5982 56.5501 30.7430 175.4876 64 K 5.1439 9.3714 123.8478 54.3749 35.6256 177.1181 65 S 4.2224 9.5338 115.8058 61.3766 62.0441 175.1920 66 G 4.3296 8.0142 103.3095 44.9155 0.0000 172.6351 67 V 4.1841 7.3576 113.2610 60.6691 35.4361 172.6547 68 Q 4.9465 8.6051 121.5107 55.1178 32.7828 173.9834 69 L 4.9793 9.6377 126.5654 53.5406 44.5748 175.7224 70 V 5.0768 9.1826 119.6945 59.9980 35.6303 174.4009 71 I 4.9538 8.3981 119.6611 58.7405 40.8816 174.8917 72 D 4.7434 8.1873 121.9541 52.0854 40.5008 175.6198 73 P 4.2149 0.0000 0.0000 66.3072 30.7132 178.3850 74 M 4.0638 8.0506 116.4574 58.8336 32.0914 178.3445 75 S 4.2483 8.0803 113.7706 60.8571 63.4776 175.5827 76 L 3.9152 8.1136 124.8501 58.3948 41.5283 179.0207 77 Q 4.1989 7.8669 115.2257 58.6834 28.8446 177.2782 78 Y 4.2673 7.5470 119.1243 60.1912 38.5852 176.9389 79 L 4.2878 9.3206 121.0028 56.2181 40.9062 176.4292 80 I 3.4279 7.8834 111.9478 60.7176 37.3664 175.1544 81 G 4.0956 8.7052 113.9480 46.1441 0.0000 174.2022 82 G 4.3212 8.1016 114.8010 44.8187 0.0000 173.3409 83 T 5.5068 9.3083 117.3675 62.2316 73.3907 173.6791 84 V 4.9514 8.5829 124.8960 60.0833 35.4448 174.0296 85 D 5.1137 8.7250 120.7175 52.4099 42.9014 173.3168 86 Y 4.9485 8.8127 121.7394 56.6916 41.9492 175.8842 87 T 4.7155 9.0725 121.4962 62.6721 71.2136 172.9102 88 E 4.9148 9.0714 125.2032 52.9923 31.9366 178.7725 89 G 4.2858 8.0603 110.3969 46.7957 0.0000 174.0024 90 L 4.1195 8.2218 125.4037 57.8287 42.1206 178.4926 91 E 3.9475 8.1484 116.1218 57.6104 29.6047 177.4967 92 G 4.1107 7.5331 105.3313 43.8441 0.0000 174.1611 93 S 4.5538 8.5220 116.2750 58.8403 62.0361 173.0491 94 R 4.5111 8.8477 124.0913 55.5309 31.4303 175.2454 95 F 4.7560 8.4145 123.3218 56.5986 42.2601 174.2131 96 T 4.2134 7.5123 120.6641 61.7999 72.5751 173.1129 97 V 4.8419 8.6472 125.3918 61.1924 35.3854 174.3669 98 N 5.1903 9.6849 121.9710 51.8820 42.9202 173.7469 99 N 5.2601 8.7099 119.3515 49.9795 43.4616 173.5288 100 P 4.2802 0.0000 0.0000 66.3818 31.0740 178.3777 101 N 4.3319 8.1815 116.0471 55.6936 37.0277 176.1602 102 A 4.1581 7.8823 122.8419 54.4602 18.8731 178.8481 103 T 3.7919 8.3061 108.4222 63.9330 69.3079 175.8027 104 S 3.7862 8.0322 115.2794 57.4685 63.0283 170.0667 105 T 4.6690 8.2527 115.8443 61.9335 70.5416 173.6685 106 C 4.4806 8.6904 119.5614 59.5632 31.4446 174.8929 107 G 3.9656 8.7944 106.5458 44.5046 0.0000 171.7934 108 C 3.8254 8.2137 119.8278 59.7300 24.8009 172.6168 109 G 3.9647 7.5247 111.9440 44.0126 0.0000 168.6026 110 S 3.5442 8.1318 123.0129 58.2274 62.9305 172.3990 111 S 4.3202 7.3897 116.8557 57.3931 65.1950 172.8332 112 F 5.0587 7.8243 124.7772 57.2427 45.0546 177.6513 113 S 4.5072 7.8389 121.1134 58.0259 65.2975 175.0926 114 I 3.8752 8.6277 112.7225 61.7918 36.9672 175.4383 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 4.46 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 I 7.72 4.34 1.88 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 1.48 0.16 0.92 0.00 0.00 3 D 8.90 4.61 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.39 4.65 0.00 2.62 2.69 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 5 M 8.18 4.55 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 6 A 8.56 3.58 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 7 V 7.59 4.39 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 0.98 0.00 0.00 8 P 0.00 4.91 0.00 2.09 1.08 0.00 3.86 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 9 L 8.95 4.13 0.00 1.73 1.64 1.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 10 T 8.34 4.69 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 1.12 0.00 0.00 11 F 8.91 5.32 0.00 3.33 3.33 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 12 T 8.58 4.30 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 13 D 8.74 4.63 0.00 2.76 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 14 A 8.11 4.08 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 15 A 8.62 4.28 1.78 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 0.00 0.00 16 A 8.40 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.16 4.26 0.00 2.93 2.89 0.00 0.00 7.07 7.25 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 18 K 8.47 3.81 0.00 1.30 1.58 0.00 1.35 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.24 1.05 7.81 19 V 7.40 3.82 2.31 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 1.19 0.00 0.00 1.20 0.00 0.00 20 K 8.72 3.90 0.00 2.03 2.09 0.00 1.25 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.72 7.81 21 S 7.71 4.18 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 22 L 7.21 4.07 0.00 1.70 1.77 -0.87 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.58 3.48 1.75 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.72 0.45 0.00 0.00 24 S 7.55 4.34 0.00 4.04 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 25 E 7.40 4.15 0.00 2.15 1.96 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 2.27 2.43 0.00 26 E 8.22 4.06 0.00 2.12 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 2.41 2.31 0.00 27 E 7.53 3.85 0.00 2.16 2.11 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 2.17 2.24 0.00 28 N 7.65 4.27 0.00 2.73 2.78 0.00 0.00 6.78 7.41 0.00 0.00 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 T 7.50 4.96 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 1.26 0.00 0.00 30 D 7.14 5.33 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 31 L 7.69 4.26 0.00 1.51 1.69 1.04 0.99 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 32 K 8.02 4.67 0.00 2.09 1.80 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.35 7.81 33 L 8.57 4.41 0.00 1.67 1.31 -0.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 34 R 9.07 5.16 0.00 1.72 1.68 0.00 3.38 0.00 0.00 3.24 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 35 V 7.72 3.79 1.77 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 0.99 0.00 0.00 -0.52 0.00 0.00 36 Y 8.01 5.40 0.00 2.98 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 37 I 8.45 4.50 1.80 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.16 0.79 0.00 0.00 38 T 8.37 4.66 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 1.25 0.00 0.00 39 G 7.92 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 40 G 8.48 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 0.00 0.00 0.00 41 G 8.10 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 42 C 8.60 4.26 0.00 2.95 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 43 S 6.86 4.94 0.00 3.90 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 44 G 8.06 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 0.00 0.00 0.00 0.00 45 F 8.75 4.85 0.00 3.37 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 46 Q 6.13 3.68 0.00 1.48 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 5.78 0.00 0.00 0.00 0.00 0.00 1.89 1.16 0.00 47 Y 6.91 4.25 0.00 3.52 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 48 G 8.20 3.39 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 0.00 49 F 8.40 4.80 0.00 2.45 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.30 4.04 4.34 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 1.20 0.00 0.00 51 F 8.09 4.98 0.00 3.00 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 52 D 9.31 4.78 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.97 4.32 0.00 1.99 1.96 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 2.36 2.25 0.00 54 K 8.50 4.01 0.00 1.89 1.64 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.74 1.38 7.81 55 V 5.45 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 0.78 0.00 0.00 0.92 0.00 0.00 56 N 8.12 4.28 0.00 2.88 3.00 0.00 0.00 6.85 8.59 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 57 D 8.14 4.29 0.00 2.63 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 58 G 8.86 3.69 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 59 D 7.90 4.73 0.00 2.67 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 60 L 8.28 4.33 0.00 1.70 1.57 0.92 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.46 5.23 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 1.24 0.00 0.00 62 I 9.40 4.82 2.01 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 1.28 1.29 1.00 0.00 0.00 63 E 9.08 4.15 0.00 2.05 1.96 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 2.51 2.40 0.00 64 K 9.37 5.14 0.00 1.90 2.03 0.00 1.50 0.00 0.00 1.52 0.00 0.00 2.67 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.41 7.81 65 S 9.53 4.22 0.00 4.00 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 66 G 8.01 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 67 V 7.36 4.18 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 0.87 0.00 0.00 0.98 0.00 0.00 68 Q 8.61 4.95 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.22 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 69 L 9.64 4.98 0.00 1.46 1.73 0.53 0.65 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 70 V 9.18 5.08 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 0.88 0.00 0.00 1.09 0.00 0.00 71 I 8.40 4.95 1.74 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 1.22 1.11 0.73 0.00 0.00 72 D 8.19 4.74 0.00 2.87 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 73 P 0.00 4.21 0.00 2.18 2.19 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 74 M 8.05 4.06 0.00 2.21 2.04 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 2.31 2.43 0.00 75 S 8.08 4.25 0.00 3.88 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 76 L 8.11 3.92 0.00 1.70 1.84 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 7.87 4.20 0.00 2.25 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 78 Y 7.55 4.27 0.00 3.26 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 79 L 9.32 4.29 0.00 1.53 1.18 0.72 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.88 3.43 1.88 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 1.24 0.84 0.98 0.00 0.00 81 G 8.71 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 82 G 8.10 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 0.00 0.00 0.00 0.00 83 T 9.31 5.51 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 1.22 0.00 0.00 84 V 8.58 4.95 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 1.17 0.00 0.00 1.27 0.00 0.00 85 D 8.73 5.11 0.00 2.72 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 86 Y 8.81 4.95 0.00 3.22 2.85 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 87 T 9.07 4.72 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 1.26 0.00 0.00 88 E 9.07 4.91 0.00 1.85 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 2.36 2.29 0.00 89 G 8.06 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.22 4.12 0.00 1.75 1.67 0.93 0.90 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 91 E 8.15 3.95 0.00 2.00 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 2.34 2.40 0.00 92 G 7.53 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 93 S 8.52 4.55 0.00 4.16 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 94 R 8.85 4.51 0.00 1.94 2.11 0.00 2.88 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 95 F 8.41 4.76 0.00 2.12 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 96 T 7.51 4.21 4.07 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 1.22 0.00 0.00 97 V 8.65 4.84 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 1.05 0.00 0.00 0.48 0.00 0.00 98 N 9.68 5.19 0.00 2.58 2.66 0.00 0.00 7.06 5.12 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 99 N 8.71 5.26 0.00 2.77 2.71 0.00 0.00 7.20 8.54 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 0.00 100 P 0.00 4.28 0.00 2.25 2.31 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 101 N 8.18 4.33 0.00 2.90 3.08 0.00 0.00 6.21 8.04 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 0.00 102 A 7.88 4.16 1.40 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 0.00 0.00 103 T 8.31 3.79 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 1.24 0.00 0.00 104 S 8.03 3.79 0.00 3.99 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 0.00 105 T 8.25 4.67 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 1.20 0.00 0.00 106 C 8.69 4.48 0.00 3.02 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 0.00 107 G 8.79 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 0.00 0.00 0.00 108 C 8.21 3.83 0.00 3.10 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 0.00 109 G 7.52 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 0.00 110 S 8.13 3.54 0.00 4.00 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 0.00 111 S 7.39 4.32 0.00 3.56 3.53 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 0.00 112 F 7.82 5.06 0.00 3.01 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 0.00 113 S 7.84 4.51 0.00 3.85 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 0.00 114 I 8.63 3.88 1.87 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 1.28 0.98 0.91 0.00 0.00