NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 4.0731 8.2548 109.1138 45.1743 0.0000 174.9863 17 I 3.6855 7.2549 120.4587 63.6115 37.3452 175.4128 18 T 3.9911 7.8225 117.0389 63.0962 70.1496 174.1435 19 G 3.4643 7.5204 113.4327 45.0567 0.0000 171.1985 20 T 4.5690 7.5054 117.8649 61.4803 70.5428 174.3832 21 W 4.6289 7.9499 124.7213 54.8080 33.4020 173.8742 22 Y 5.4598 9.1687 120.8487 56.4885 41.1139 175.1311 23 N 5.3815 8.6535 120.8786 50.6633 39.6615 174.6507 24 Q 4.1451 8.7872 116.3936 58.4398 28.9632 177.1090 25 L 4.5102 8.0654 115.7654 54.4576 41.8460 177.1278 26 G 4.0994 8.5603 107.1194 45.1119 0.0000 174.3748 27 S 4.8624 8.6006 116.1595 58.4377 64.8635 173.3678 28 T 5.2259 8.5863 117.8136 61.8044 72.7191 173.1404 29 F 5.1257 8.7295 119.6727 55.1665 41.5772 173.3397 30 I 4.7399 8.8259 123.6087 59.5195 39.4864 175.0691 31 V 4.8815 8.5869 125.0361 60.2916 35.4237 174.1691 32 T 4.7237 9.0439 118.9480 61.7502 71.5355 172.9514 33 A 4.4558 8.6707 129.2401 50.2765 19.7801 177.2006 34 G 3.8529 9.2478 111.6594 45.3547 0.0000 173.9301 35 A 4.1351 8.5404 123.0997 54.3792 18.5124 178.2348 36 D 4.5841 8.1147 113.9556 53.2671 39.8884 177.4441 37 G 3.4475 8.2084 108.8691 44.9339 0.0000 173.3788 38 A 4.7981 8.3244 122.5197 51.6668 20.0331 176.4670 39 L 5.2922 8.9101 121.8196 53.1390 44.7108 175.8766 40 T 4.8937 8.8855 113.0721 59.6544 72.5714 174.3447 41 G 3.9175 7.4773 109.2206 46.4587 0.0000 171.2726 42 T 5.1899 7.9137 110.1418 60.1713 72.7486 172.5381 43 Y 5.0553 9.1909 125.3558 56.0023 41.5411 174.1642 44 I 5.1573 8.7682 127.5835 59.3222 40.1444 175.7527 45 G 4.2510 9.4933 114.6092 45.9419 0.0000 174.2266 46 A 4.3115 8.8784 123.7739 55.3577 18.1885 179.5134 47 R 3.8721 8.2054 115.3515 57.4895 30.2688 177.9934 48 G 3.9939 8.5851 104.4750 45.6689 0.0000 173.3986 49 N 4.4289 7.5783 117.5679 52.8576 39.6446 175.7867 50 A 3.9424 8.3944 125.8982 55.2047 18.6305 179.5180 51 E 3.6733 7.7463 113.4042 58.3538 29.9258 177.3920 52 S 4.9167 8.1068 114.8653 58.2915 64.2278 173.3015 53 R 5.2556 7.4662 119.7694 54.9257 31.4619 175.4285 54 Y 4.9046 9.2229 120.5119 56.0367 42.5561 174.7464 55 V 4.4586 8.4843 121.6707 62.5908 33.3687 174.6212 56 L 5.1770 8.6708 127.1125 54.3649 43.5173 175.1929 57 T 4.9786 8.5886 114.6915 61.3074 71.4266 173.2078 58 G 4.1815 8.6997 112.6561 46.3184 0.0000 171.9009 59 R 5.5605 8.8608 117.6195 55.0137 34.8491 174.1155 60 Y 5.2884 8.5911 118.7316 55.3864 41.3971 174.7958 61 D 4.3232 9.0830 120.8366 53.8223 40.2989 177.0189 62 S 4.1125 8.0302 120.8941 59.5192 63.8424 174.5684 63 A 4.6648 7.9373 123.5792 50.0589 18.5809 173.6368 64 P 4.7333 0.0000 0.0000 60.6973 32.8302 177.2519 65 A 4.2098 8.4069 122.2514 52.8145 18.7811 177.7396 66 T 4.6948 8.3089 110.3796 61.8750 69.4193 174.6606 67 D 4.8234 8.4868 118.4247 54.2168 39.7480 176.9756 68 G 3.9927 8.3855 108.3877 45.8977 0.0000 174.7671 69 S 4.2825 7.7783 115.4573 58.2159 63.3365 174.2203 70 G 4.0369 8.3611 110.4491 45.8322 0.0000 172.7100 71 T 4.7874 8.6463 116.4925 61.6676 70.0589 174.9018 72 A 4.8349 8.7071 129.3095 52.1809 19.9604 175.8473 73 L 4.9876 8.9000 119.9203 55.5360 44.4566 173.9780 74 G 4.6889 9.1053 105.9152 45.3960 0.0000 171.9493 75 W 5.9044 8.7132 117.1078 55.4175 32.4153 173.5482 76 T 5.1946 9.3168 117.3174 61.8175 71.9202 173.1851 77 V 4.7147 8.8858 124.4578 59.9858 34.2742 173.8876 78 A 4.6159 8.2243 129.0612 49.2902 20.7978 177.4003 79 W 4.3054 8.4226 124.0195 56.1118 28.6005 176.4684 80 K 5.2868 7.8758 118.1918 54.6972 35.2515 174.6178 81 N 5.0762 8.9491 122.9175 51.9891 39.4394 174.3370 82 N 4.2434 8.8096 113.5206 55.7322 38.8722 175.1344 83 Y 4.6052 7.4966 114.7823 58.3792 39.9916 175.6930 84 R 4.7106 8.4861 114.5255 55.2643 32.5299 173.7632 85 N 5.1846 8.4963 116.9912 52.9843 41.1079 173.6849 86 A 4.3887 9.0153 128.3958 51.5289 19.8594 176.4319 87 H 4.1550 8.6982 114.6862 56.2389 26.9269 173.4537 88 S 5.2156 7.3080 111.9585 57.6157 66.9863 174.6685 89 A 4.9700 9.0543 121.6567 50.7116 22.7337 175.1697 90 T 4.9696 8.3795 118.1950 61.7381 71.7239 173.4433 91 T 4.9955 8.4834 115.3675 59.6578 71.8187 172.6923 92 W 4.9694 8.8329 125.3365 54.8061 31.7394 174.7710 93 S 4.9379 8.6746 119.2585 56.8655 64.7628 172.8623 94 G 4.3727 8.5314 113.6547 46.5904 0.0000 171.6345 95 Q 5.2402 8.5945 118.2510 54.8507 32.8589 173.6547 96 Y 4.7736 9.2854 123.5301 56.9732 40.6981 174.1318 97 V 3.9402 8.6137 126.2685 61.0184 34.5649 175.5947 98 G 3.7930 8.0591 115.3627 44.5779 0.0000 170.2573 99 G 3.8008 8.7876 104.1063 43.9079 0.0000 173.5015 100 A 4.1011 8.6041 120.7540 54.6554 18.7901 178.2966 101 E 4.5541 7.7970 115.5679 55.7760 29.5012 176.3475 102 A 4.5216 7.7147 120.0786 52.6091 19.7112 178.5006 103 R 5.2520 8.9336 118.7213 55.3184 35.7215 174.0765 104 I 4.8983 9.1674 122.6074 59.8260 39.9650 174.2838 105 N 5.4681 9.1051 125.4600 52.0042 40.5569 174.4612 106 T 5.3322 9.3089 113.1129 60.2147 73.0766 172.6498 107 Q 5.2211 9.1380 120.9336 53.8822 32.6890 174.7380 108 W 5.4260 8.4507 118.0148 54.6859 32.1796 173.8352 109 L 5.2755 8.8199 120.8029 52.8920 44.8300 175.2054 110 L 4.9879 9.2051 125.8349 53.7793 44.6345 174.8658 111 T 5.0281 8.7520 123.8921 62.0276 70.7250 173.9032 112 S 5.1545 8.7470 122.9352 56.2482 65.2565 174.5035 113 G 3.8557 8.7856 112.0383 46.9624 0.0000 172.8826 114 T 4.7913 8.3145 114.1511 59.6033 72.3478 173.1656 115 T 4.1625 8.0409 111.7525 60.8626 69.9968 175.4238 116 E 3.9750 8.7227 120.7956 59.5114 29.0976 179.4993 117 A 4.1955 8.0214 119.6164 54.3473 18.8141 178.1907 118 N 4.7483 7.7808 113.2416 53.3339 38.6765 176.8318 119 A 4.1918 7.9556 125.1324 53.7432 18.4733 179.4196 120 W 4.3631 8.3122 113.9664 58.2775 28.5816 176.7818 121 K 4.1397 6.5971 118.6884 56.0846 32.2316 177.3147 122 S 4.2715 7.8452 116.1625 61.4411 64.6675 173.3625 123 T 5.0138 7.5634 116.0663 61.7260 71.1521 173.6092 124 L 4.6236 8.9952 127.6697 53.8187 43.6181 176.4105 125 V 4.3051 7.8143 120.6641 60.2931 34.4434 175.1803 126 G 3.1995 6.3871 108.1842 45.8119 0.0000 171.2676 127 H 5.4255 8.1887 113.8334 54.5309 31.9473 172.1581 128 D 4.8486 9.1432 117.2281 53.7108 45.0595 173.9289 129 T 5.2255 8.4831 119.9672 61.8557 72.0033 172.8963 130 F 5.5078 9.7111 124.6356 56.0296 42.6824 174.4250 131 T 5.4461 9.1846 111.0597 60.1324 72.2262 174.7560 132 K 3.8620 8.7556 120.0135 57.3314 32.5828 177.3418 133 V 4.5159 7.4492 110.7168 59.2853 35.4523 175.3369 134 K 4.0416 8.1033 121.0915 56.5608 32.0238 176.0344 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 16 G 8.25 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 0.00 0.00 0.00 0.00 17 I 7.25 3.69 1.40 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.33 0.56 0.00 0.00 18 T 7.82 3.99 4.16 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 0.00 0.00 0.00 1.20 0.00 0.00 19 G 7.52 3.46 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 0.00 0.00 0.00 0.00 20 T 7.51 4.57 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 0.67 0.00 0.00 21 W 7.95 4.63 0.00 1.78 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 22 Y 9.17 5.46 0.00 3.01 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 23 N 8.65 5.38 0.00 2.62 2.27 0.00 0.00 6.97 7.47 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 24 Q 8.79 4.15 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 7.22 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 25 L 8.07 4.51 0.00 1.69 1.72 0.97 1.02 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 26 G 8.56 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 27 S 8.60 4.86 0.00 4.16 3.76 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 28 T 8.59 5.23 4.20 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 0.96 0.00 0.00 29 F 8.73 5.13 0.00 2.82 2.50 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 30 I 8.83 4.74 1.79 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 1.12 0.45 0.80 0.00 0.00 31 V 8.59 4.88 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 0.73 0.00 0.00 0.77 0.00 0.00 32 T 9.04 4.72 4.20 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 1.18 0.00 0.00 33 A 8.67 4.46 0.65 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 0.00 0.00 34 G 9.25 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 0.00 0.00 0.00 35 A 8.54 4.14 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 36 D 8.11 4.58 0.00 2.78 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 37 G 8.21 3.45 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 0.00 0.00 0.00 38 A 8.32 4.80 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 39 L 8.91 5.29 0.00 1.60 1.46 1.02 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.89 4.89 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 1.21 0.00 0.00 41 G 7.48 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 0.00 0.00 0.00 0.00 42 T 7.91 5.19 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 1.27 0.00 0.00 43 Y 9.19 5.06 0.00 2.93 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 44 I 8.77 5.16 1.89 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 1.20 0.86 1.02 0.00 0.00 45 G 9.49 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 46 A 8.88 4.31 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 47 R 8.21 3.87 0.00 1.89 1.97 0.00 3.31 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 48 G 8.59 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 49 N 7.58 4.43 0.00 2.83 2.75 0.00 0.00 7.05 7.59 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 50 A 8.39 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 7.75 3.67 0.00 1.85 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.03 0.00 52 S 8.11 4.92 0.00 4.04 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 7.47 5.26 0.00 1.59 1.86 0.00 3.11 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 54 Y 9.22 4.90 0.00 2.92 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 55 V 8.48 4.46 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 0.99 0.00 0.00 0.95 0.00 0.00 56 L 8.67 5.18 0.00 1.86 1.65 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.59 4.98 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 1.24 0.00 0.00 58 G 8.70 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 0.00 0.00 0.00 0.00 59 R 8.86 5.56 0.00 1.75 1.79 0.00 3.29 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 60 Y 8.59 5.29 0.00 3.11 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 61 D 9.08 4.32 0.00 2.80 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 62 S 8.03 4.11 0.00 3.88 3.47 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 0.00 0.00 0.00 63 A 7.94 4.66 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.73 0.00 2.28 2.17 0.00 3.44 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 65 A 8.41 4.21 1.36 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 0.00 0.00 66 T 8.31 4.69 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 67 D 8.49 4.82 0.00 2.79 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 68 G 8.39 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 69 S 7.78 4.28 0.00 4.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.36 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 71 T 8.65 4.79 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 1.43 0.00 0.00 72 A 8.71 4.83 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 73 L 8.90 4.99 0.00 2.05 1.94 1.24 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.11 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 75 W 8.71 5.90 0.00 3.39 3.16 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 0.00 0.00 0.00 0.00 76 T 9.32 5.19 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 1.22 0.00 0.00 77 V 8.89 4.71 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 -0.08 0.00 0.00 0.75 0.00 0.00 78 A 8.22 4.62 1.15 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 79 W 8.42 4.31 0.00 3.41 2.90 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 80 K 7.88 5.29 0.00 1.92 1.72 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.46 7.81 81 N 8.95 5.08 0.00 2.88 2.72 0.00 0.00 6.73 6.47 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 82 N 8.81 4.24 0.00 2.20 2.40 0.00 0.00 6.63 7.46 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 83 Y 7.50 4.61 0.00 3.03 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 84 R 8.49 4.71 0.00 2.08 2.09 0.00 2.89 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.84 0.00 85 N 8.50 5.18 0.00 2.67 2.64 0.00 0.00 6.91 7.96 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 86 A 9.02 4.39 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 87 H 8.70 4.15 0.00 3.29 3.28 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.31 5.22 0.00 4.01 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 89 A 9.05 4.97 1.15 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 90 T 8.38 4.97 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 -0.48 0.00 0.00 91 T 8.48 5.00 4.17 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 1.15 0.00 0.00 92 W 8.83 4.97 0.00 1.78 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 0.00 0.00 0.00 0.00 93 S 8.67 4.94 0.00 3.81 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 94 G 8.53 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 0.00 0.00 0.00 0.00 95 Q 8.59 5.24 0.00 2.31 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 96 Y 9.29 4.77 0.00 2.94 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.61 3.94 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 0.82 0.00 0.00 0.90 0.00 0.00 98 G 8.06 3.79 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 99 G 8.79 3.80 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 0.00 0.00 0.00 100 A 8.60 4.10 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 0.00 101 E 7.80 4.55 0.00 1.98 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 2.26 2.25 0.00 102 A 7.71 4.52 1.47 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 0.00 0.00 0.00 0.00 0.00 103 R 8.93 5.25 0.00 1.83 1.91 0.00 3.26 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 104 I 9.17 4.90 1.89 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.22 1.11 0.00 0.00 105 N 9.11 5.47 0.00 2.73 2.81 0.00 0.00 6.05 6.39 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 0.00 106 T 9.31 5.33 4.49 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 1.49 0.00 0.00 107 Q 9.14 5.22 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 108 W 8.45 5.43 0.00 2.64 2.37 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 0.00 109 L 8.82 5.28 0.00 1.51 1.53 0.87 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.21 4.99 0.00 1.67 1.65 0.65 0.95 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 0.00 111 T 8.75 5.03 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 1.19 0.00 0.00 112 S 8.75 5.15 0.00 3.67 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 0.00 113 G 8.79 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 0.00 0.00 0.00 114 T 8.31 4.79 4.19 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 0.00 0.00 1.21 0.00 0.00 115 T 8.04 4.16 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 1.21 0.00 0.00 116 E 8.72 3.98 0.00 2.05 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 2.42 2.39 0.00 117 A 8.02 4.20 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 0.00 118 N 7.78 4.75 0.00 2.65 2.70 0.00 0.00 6.79 7.85 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 0.00 119 A 7.96 4.19 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 0.00 120 W 8.31 4.36 0.00 3.62 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 0.00 121 K 6.60 4.14 0.00 1.19 0.74 0.00 0.68 0.00 0.00 1.19 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.70 0.87 7.81 122 S 7.85 4.27 0.00 4.02 4.12 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 0.00 123 T 7.56 5.01 4.21 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 0.00 0.00 0.00 1.18 0.00 0.00 124 L 9.00 4.62 0.00 1.78 1.77 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.81 4.31 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 0.54 0.00 0.00 0.67 0.00 0.00 126 G 6.39 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 0.00 0.00 0.00 127 H 8.19 5.43 0.00 3.23 3.14 0.00 5.76 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 0.00 128 D 9.14 4.85 0.00 3.17 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 0.00 129 T 8.48 5.23 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 1.38 0.00 0.00 130 F 9.71 5.51 0.00 3.20 3.34 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 0.00 131 T 9.18 5.45 4.39 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 1.39 0.00 0.00 132 K 8.76 3.86 0.00 1.53 1.56 0.00 1.49 0.00 0.00 1.37 0.00 0.00 2.45 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.30 0.33 7.81 133 V 7.45 4.52 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 0.67 0.00 0.00 0.92 0.00 0.00 134 K 8.10 4.04 0.00 0.95 1.36 0.00 1.72 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.27 7.81