NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.2280 8.4444 121.4666 55.7913 31.6392 175.7360 8 L 4.0929 7.7572 121.0528 53.6578 42.9692 174.6680 9 K 4.7228 9.2504 127.1030 54.6726 36.5106 174.2779 10 V 4.4444 9.1064 127.6162 61.7854 33.1985 174.3372 11 T 4.5654 9.0874 125.4465 61.8780 69.9324 173.4312 12 Q 5.0959 8.8280 125.3899 52.6725 29.8444 174.5453 13 P 4.4336 0.0000 0.0000 64.3393 31.9556 176.5907 14 E 4.6795 7.3596 118.0940 54.5324 31.1542 176.1625 15 K 4.4293 8.6418 122.8908 58.7140 33.4393 176.6088 16 S 5.3209 7.8642 112.1150 57.3155 66.2114 173.8616 17 V 4.6783 9.1501 113.0851 59.8822 36.1987 174.5874 18 S 5.3717 8.7361 118.9068 56.7748 65.5661 173.9856 19 V 4.5659 8.8873 123.4574 59.7402 34.7112 174.9176 20 A 5.0433 8.9040 125.1357 50.6654 19.9125 176.6276 21 A 4.1423 8.5554 122.9862 54.2446 18.4236 178.0892 22 G 3.9648 9.4560 111.9467 45.0267 0.0000 173.0437 23 D 4.9850 8.0784 119.9505 53.0810 43.6239 175.2366 24 S 5.2167 8.3547 112.6676 57.4955 66.2612 173.1583 25 T 4.6149 8.6950 113.9712 60.8641 71.1026 172.2277 26 V 4.5619 8.2120 125.9638 61.4081 33.5117 174.8220 27 L 4.6038 8.5244 128.0261 53.1977 43.4363 175.4070 28 N 5.6573 8.7302 121.6393 52.2614 40.7324 174.9931 29 C 5.2824 8.7536 121.8133 55.7574 44.1309 172.5939 30 T 5.4307 9.2684 115.8009 60.0336 72.1594 172.6644 31 L 5.3262 8.7420 122.6646 53.3916 44.1439 176.8952 32 T 4.2943 8.4563 111.5152 63.2769 69.5956 174.7477 33 S 4.6290 7.7701 114.9154 56.9612 65.4734 173.0072 34 L 4.5250 8.4952 123.9656 54.5871 41.7693 176.4107 35 L 4.6418 7.5684 119.1980 52.0075 43.6863 174.5208 36 P 4.4567 0.0000 0.0000 61.7184 32.5465 175.9421 37 V 3.4906 7.9542 118.2488 61.6880 31.6247 175.1658 38 G 4.8922 8.2394 115.6301 44.8696 0.0000 170.0237 39 P 4.9195 0.0000 0.0000 62.9593 33.0353 175.0889 40 I 4.9076 8.6704 122.1189 59.7601 39.2585 174.9399 41 K 5.2636 9.3994 126.1680 54.4623 36.1683 175.0225 42 W 5.4676 9.3262 123.2543 55.5746 31.5317 174.9362 43 Y 5.3609 9.5739 121.2843 56.2889 41.9705 174.2152 44 R 4.3905 9.1430 123.0811 56.0166 31.9340 176.9193 45 G 4.3910 9.8465 113.1927 45.0524 0.0000 172.1106 46 V 4.1831 7.5492 110.3120 60.2570 35.5822 176.8315 47 G 3.7925 8.2827 109.5584 44.5304 0.0000 174.0325 48 Q 3.9791 8.4662 115.6662 58.9125 28.4804 177.3917 49 S 4.4141 7.9058 110.8758 58.3298 63.7151 174.4635 50 R 4.1073 7.5163 118.3959 56.7348 29.6880 175.3660 51 L 4.7423 8.6669 122.1665 53.2041 44.0091 175.2334 52 L 4.1507 8.8325 129.0619 55.6570 42.1706 175.7542 53 I 4.4203 8.6642 127.1251 62.9770 38.9837 175.5203 54 Y 4.5372 7.5150 120.2184 56.5447 42.1619 173.2228 55 S 5.0126 7.4825 120.6263 57.0196 66.6747 174.2018 56 F 4.6623 9.8178 124.7123 56.7851 38.3739 177.0931 57 T 3.8519 8.5489 119.9204 66.3298 69.4165 176.0328 58 G 3.9768 8.1379 107.7504 44.8039 0.0000 172.6121 59 E 4.3047 8.5031 119.5657 56.3140 31.2426 177.0581 60 H 4.7049 8.4521 120.7899 55.1260 28.3900 174.1550 61 F 4.8484 8.2041 123.2203 56.6558 40.3766 173.0831 62 P 3.0064 0.0000 0.0000 62.2014 31.6698 176.7382 63 R 3.8094 7.6487 119.8468 58.3650 30.2752 176.4104 64 V 4.3976 7.9719 118.3632 61.1789 33.1734 175.4149 65 T 5.1228 8.6712 115.1668 61.3985 69.6686 173.5658 66 N 5.0799 8.1914 118.3435 52.5436 38.0229 173.7137 67 V 4.4520 8.3420 118.1838 61.7417 33.7026 174.7198 68 S 4.7764 8.2696 119.7848 56.0139 66.2427 172.8630 69 D 4.3679 8.7349 120.5879 54.5481 41.1540 175.4962 70 A 4.6296 8.6741 128.4574 52.2549 19.2533 176.9469 71 T 4.3827 8.3443 107.6576 62.3974 69.7908 175.3557 72 K 4.3606 7.6743 121.5932 55.5526 33.2555 177.1086 73 R 4.0138 8.5313 121.0315 58.5838 30.4943 176.9732 74 N 4.8782 7.7362 115.8530 51.5957 41.2636 174.3460 75 N 4.4296 8.8710 122.7943 55.4527 39.0354 175.4444 76 M 4.4615 8.6122 118.0417 55.1412 32.4797 174.4849 77 D 5.1485 7.5047 119.6325 52.4923 42.7275 176.1388 78 F 4.1613 8.9144 124.8098 57.0812 40.2900 175.4392 79 S 4.9774 8.5538 114.4561 58.7344 64.1397 173.7343 80 I 4.6100 8.2535 115.1360 58.9863 41.1255 173.8287 81 R 4.8410 8.1343 122.7744 54.5699 32.3415 174.7825 82 I 4.3546 8.5453 127.0484 59.7493 39.3901 175.1591 83 S 4.9010 8.5953 122.3168 56.0050 66.0267 173.1539 84 N 4.3013 8.4525 114.8190 53.1135 36.0870 175.6674 85 V 3.9732 7.6551 110.6682 61.7082 32.6776 176.1533 86 T 4.9914 8.6920 112.3264 58.7316 71.9160 173.1149 87 P 4.2542 0.0000 0.0000 65.5305 31.3321 178.6361 88 E 4.1480 7.6644 113.6540 58.5822 29.5826 177.5773 89 D 4.6217 8.2168 118.3758 55.4531 41.2525 176.6142 90 A 4.3388 7.7111 123.0832 51.5691 19.2897 178.4843 91 G 3.7558 7.2165 107.8986 45.1005 0.0000 170.8416 92 T 4.9513 8.0010 116.9523 62.0843 70.8677 173.1888 93 Y 5.1849 8.9482 124.7942 56.4827 40.5983 174.3912 94 Y 5.1067 9.5796 121.7108 56.3175 41.7740 173.6770 95 C 4.1090 8.8001 124.1294 54.8249 45.0912 172.3923 96 V 4.7466 8.6060 126.1917 60.9411 34.4033 173.9706 97 K 4.7103 8.7891 129.8509 55.5183 33.9229 175.3000 98 F 5.1782 9.2109 125.0489 55.6820 43.2579 173.6272 99 Q 4.7837 9.2672 123.0439 54.7074 30.1734 175.8267 100 K 3.9624 9.1143 129.7527 59.7110 32.3905 178.7105 101 G 4.0331 8.0771 107.1639 44.0950 0.0000 170.7787 102 P 4.3991 0.0000 0.0000 65.1980 31.4538 176.5249 103 S 4.6806 7.5177 109.2803 56.4274 65.5850 172.8585 104 E 4.2669 8.5057 123.1936 55.3712 29.9487 175.0855 105 P 4.6974 0.0000 0.0000 61.3609 33.0368 175.2358 106 D 4.7051 8.4192 118.5027 55.2395 41.5023 176.2511 107 T 4.5686 8.6772 119.6028 61.9950 70.3540 173.8172 108 E 3.5202 8.9100 128.3083 56.5821 29.7741 175.7561 109 I 4.1444 8.1969 128.2695 62.7932 38.5285 176.0394 110 Q 4.4113 7.3064 120.5770 55.0230 32.2538 172.4427 111 S 4.9120 8.4923 120.9727 56.6448 64.0701 173.6721 112 G 3.8680 8.8754 114.2181 45.9612 0.0000 173.6539 113 G 3.8812 8.7308 107.2906 45.8177 0.0000 175.0748 114 G 3.6917 8.8245 105.5111 45.8514 0.0000 172.9531 115 T 4.8037 8.4401 116.8311 61.4369 72.5102 172.6710 116 E 4.6410 9.2443 128.3095 55.4778 31.4294 174.9219 117 V 4.7039 9.0607 127.4785 61.7074 33.4908 173.8198 118 Y 4.8928 9.0795 126.2685 56.6162 40.0748 174.8831 119 V 4.8271 8.4489 124.1641 61.4397 33.2198 175.2689 120 L 4.2260 8.9035 128.5515 56.2875 40.4806 175.2827 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 7 E 8.44 4.23 0.00 1.93 2.03 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 2.18 2.30 0.00 8 L 7.76 4.09 0.00 1.71 1.50 0.88 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.25 4.72 0.00 1.79 1.55 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.33 7.81 10 V 9.11 4.44 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 0.84 0.00 0.00 0.79 0.00 0.00 11 T 9.09 4.57 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 12 Q 8.83 5.10 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.91 0.00 0.00 0.00 0.00 0.00 2.53 2.08 0.00 13 P 0.00 4.43 0.00 2.20 2.21 0.00 3.99 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 2.03 2.02 0.00 14 E 7.36 4.68 0.00 2.02 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 0.00 2.27 2.31 0.00 15 K 8.64 4.43 0.00 1.72 1.89 0.00 1.70 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.41 7.81 16 S 7.86 5.32 0.00 4.21 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 17 V 9.15 4.68 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 0.73 0.00 0.00 0.95 0.00 0.00 18 S 8.74 5.37 0.00 3.69 3.72 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 19 V 8.89 4.57 2.06 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 0.80 0.00 0.00 0.91 0.00 0.00 20 A 8.90 5.04 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 21 A 8.56 4.14 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 22 G 9.46 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 23 D 8.08 4.99 0.00 2.77 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 24 S 8.35 5.22 0.00 3.83 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 25 T 8.70 4.61 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 1.07 0.00 0.00 26 V 8.21 4.56 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 0.88 0.00 0.00 0.86 0.00 0.00 27 L 8.52 4.60 0.00 0.83 1.42 0.10 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.73 5.66 0.00 2.72 2.80 0.00 0.00 7.01 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 29 C 8.75 5.28 0.00 3.08 3.35 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 30 T 9.27 5.43 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 1.25 0.00 0.00 31 L 8.74 5.33 0.00 1.60 1.76 0.68 0.38 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 32 T 8.46 4.29 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 33 S 7.77 4.63 0.00 3.77 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 34 L 8.50 4.52 0.00 1.70 1.72 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.57 4.64 0.00 1.59 1.53 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.46 0.00 2.06 2.02 0.00 3.69 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00 37 V 7.95 3.49 0.91 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 0.87 0.00 0.00 0.70 0.00 0.00 38 G 8.24 4.89 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 0.00 0.00 0.00 39 P 0.00 4.92 0.00 2.17 2.23 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 40 I 8.67 4.91 1.69 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 0.05 0.75 0.00 0.00 41 K 9.40 5.26 0.00 1.88 1.44 0.00 1.42 0.00 0.00 1.47 0.00 0.00 2.59 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.32 1.41 7.81 42 W 9.33 5.47 0.00 3.40 3.29 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 43 Y 9.57 5.36 0.00 3.04 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 44 R 9.14 4.39 0.00 1.36 1.67 0.00 3.01 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.75 0.00 45 G 9.85 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 0.00 0.00 0.00 0.00 46 V 7.55 4.18 1.93 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 0.54 0.00 0.00 0.91 0.00 0.00 47 G 8.28 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 48 Q 8.47 3.98 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.98 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 49 S 7.91 4.41 0.00 4.00 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 50 R 7.52 4.11 0.00 2.21 1.87 0.00 2.44 0.00 0.00 2.78 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 0.00 51 L 8.67 4.74 0.00 1.83 1.62 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.83 4.15 0.00 1.75 1.59 0.57 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.66 4.42 2.26 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.29 1.05 0.00 0.00 54 Y 7.51 4.54 0.00 3.05 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 55 S 7.48 5.01 0.00 3.52 3.63 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 56 F 9.82 4.66 0.00 3.35 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 57 T 8.55 3.85 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 58 G 8.14 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 0.00 0.00 0.00 59 E 8.50 4.30 0.00 2.19 2.24 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 2.39 2.56 0.00 60 H 8.45 4.70 0.00 3.20 3.28 0.00 5.68 0.00 0.00 0.00 0.00 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.20 4.85 0.00 3.01 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 62 P 0.00 3.01 0.00 1.61 0.93 0.00 3.65 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 63 R 7.65 3.81 0.00 1.64 1.84 0.00 3.13 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 64 V 7.97 4.40 2.24 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 1.07 0.00 0.00 0.96 0.00 0.00 65 T 8.67 5.12 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 1.26 0.00 0.00 66 N 8.19 5.08 0.00 2.83 2.91 0.00 0.00 5.84 7.68 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 67 V 8.34 4.45 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 0.89 0.00 0.00 0.97 0.00 0.00 68 S 8.27 4.78 0.00 3.99 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 69 D 8.73 4.37 0.00 2.74 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 70 A 8.67 4.63 1.28 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 0.00 0.00 71 T 8.34 4.38 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 1.26 0.00 0.00 72 K 7.67 4.36 0.00 1.85 1.81 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.70 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.36 1.41 7.81 73 R 8.53 4.01 0.00 1.77 1.97 0.00 3.14 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 74 N 7.74 4.88 0.00 2.62 2.55 0.00 0.00 7.22 6.71 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 75 N 8.87 4.43 0.00 2.74 2.84 0.00 0.00 7.12 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 76 M 8.61 4.46 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 77 D 7.50 5.15 0.00 2.59 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 78 F 8.91 4.16 0.00 2.77 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 79 S 8.55 4.98 0.00 3.85 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 80 I 8.25 4.61 1.23 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.41 0.24 0.00 0.00 81 R 8.13 4.84 0.00 1.68 1.68 0.00 3.12 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.63 0.00 82 I 8.55 4.35 1.66 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.26 0.83 0.00 0.00 83 S 8.60 4.90 0.00 3.68 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 84 N 8.45 4.30 0.00 2.80 2.83 0.00 0.00 7.31 7.68 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 85 V 7.66 3.97 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 0.77 0.00 0.00 0.94 0.00 0.00 86 T 8.69 4.99 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 87 P 0.00 4.25 0.00 2.22 2.18 0.00 3.61 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 2.13 2.11 0.00 88 E 7.66 4.15 0.00 2.15 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 2.34 2.32 0.00 89 D 8.22 4.62 0.00 2.87 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 90 A 7.71 4.34 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 91 G 7.22 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 0.00 0.00 0.00 92 T 8.00 4.95 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 0.85 0.00 0.00 93 Y 8.95 5.18 0.00 3.16 3.27 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 94 Y 9.58 5.11 0.00 3.02 2.83 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 0.00 0.00 0.00 0.00 95 C 8.80 4.11 0.00 1.23 2.35 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 96 V 8.61 4.75 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 0.56 0.00 0.00 1.07 0.00 0.00 97 K 8.79 4.71 0.00 1.68 1.56 0.00 1.56 0.00 0.00 1.44 0.00 0.00 2.85 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.25 1.33 7.81 98 F 9.21 5.18 0.00 3.14 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 99 Q 9.27 4.78 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.22 0.00 100 K 9.11 3.96 0.00 1.80 1.81 0.00 2.09 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.84 1.65 7.81 101 G 8.08 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 0.00 0.00 0.00 102 P 0.00 4.40 0.00 2.08 2.15 0.00 3.71 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 2.06 2.12 0.00 103 S 7.52 4.68 0.00 3.78 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 0.00 104 E 8.51 4.27 0.00 2.01 1.87 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 2.34 2.25 0.00 105 P 0.00 4.70 0.00 2.19 2.06 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 106 D 8.42 4.71 0.00 2.49 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 0.00 107 T 8.68 4.57 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 1.22 0.00 0.00 108 E 8.91 3.52 0.00 1.79 1.70 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 1.95 1.55 0.00 109 I 8.20 4.14 1.83 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 1.10 0.91 0.82 0.00 0.00 110 Q 7.31 4.41 0.00 1.98 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 111 S 8.49 4.91 0.00 3.76 3.63 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 0.00 112 G 8.88 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 0.00 0.00 0.00 113 G 8.73 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 0.00 0.00 0.00 114 G 8.82 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 0.00 115 T 8.44 4.80 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 1.26 0.00 0.00 116 E 9.24 4.64 0.00 1.99 1.74 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 1.76 1.75 0.00 117 V 9.06 4.70 2.23 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 0.88 0.00 0.00 0.60 0.00 0.00 118 Y 9.08 4.89 0.00 2.94 2.81 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 0.00 119 V 8.45 4.83 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 0.85 0.00 0.00 1.02 0.00 0.00 120 L 8.90 4.23 0.00 1.72 1.72 0.83 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00