NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5764 8.1076 122.4745 52.1096 20.6159 175.1626 2 S 5.1933 8.4844 113.2224 55.4917 66.7945 170.4506 3 Y 4.9723 9.4240 118.8994 56.0954 42.0581 174.7544 4 K 5.1468 8.6214 118.1399 55.0216 35.6243 176.1271 5 V 4.6085 8.3710 114.7570 60.3013 36.7546 173.1759 6 N 5.2639 8.6776 119.9111 52.6003 39.8680 174.7276 7 I 4.5791 8.7555 123.8187 58.5645 40.5059 173.5918 8 P 4.8227 0.0000 0.0000 62.9996 31.8545 176.0595 9 A 4.4385 8.4087 121.5181 51.1932 21.5139 177.0921 10 G 3.7756 8.2198 105.6758 43.9746 0.0000 171.1425 11 P 4.2154 0.0000 0.0000 62.2183 31.6908 175.6574 12 L 4.2497 7.7477 121.1654 52.7263 43.5741 176.5328 13 W 4.7452 8.8717 123.6759 57.6538 29.7925 176.7691 14 S 4.8197 7.4033 111.9216 56.3648 65.9158 175.4295 15 N 4.6554 8.9690 120.9141 56.8489 38.8966 176.8373 16 A 3.9914 8.0744 121.8019 55.1991 18.4224 179.1012 17 E 3.8262 8.1458 117.4451 59.2910 29.7252 178.6831 18 A 3.2973 7.4861 120.7900 55.1742 17.9050 179.7030 19 Q 4.2616 8.0726 115.4534 58.7561 28.7683 178.3519 20 Q 4.1675 7.1723 117.1765 57.8577 29.4558 177.7296 21 V 3.7786 7.8314 119.4752 64.8388 31.5643 178.0208 22 G 2.3895 7.7122 106.0665 47.1388 0.0000 173.8044 23 P 4.2885 0.0000 0.0000 65.0235 31.2882 178.9242 24 K 3.9369 7.7502 116.9831 59.2654 31.5390 179.3873 25 I 3.6647 7.7163 119.9839 64.1181 37.0318 178.2015 26 A 4.0173 8.1613 121.5974 55.2592 18.2690 179.4521 27 A 3.9458 8.1879 119.0788 55.3690 18.2111 179.7409 28 A 3.9282 7.7107 117.5708 54.4036 18.3359 177.9664 29 H 4.7242 7.3930 112.5530 55.2230 29.2813 174.2841 30 Q 3.4232 7.9116 116.2436 57.1838 26.7905 173.0107 31 G 4.3235 8.3255 104.5241 44.8362 0.0000 171.8340 32 N 5.2157 8.7145 116.3166 50.9985 41.9532 174.2864 33 F 5.0205 9.0344 126.8662 58.7904 39.6319 175.0355 34 T 3.9046 8.1633 116.1940 62.3408 68.9845 175.8110 35 G 3.4913 5.7741 109.7273 44.7069 0.0000 173.3597 36 Q 4.6611 7.3094 119.2894 54.8705 30.3860 174.9982 37 W 5.1996 8.1609 118.4030 56.7064 31.0228 172.9843 38 T 3.5487 8.4981 112.3869 61.2457 70.7520 172.1629 39 T 4.6845 8.1041 123.6175 63.0025 68.7601 174.9337 40 V 4.1997 8.7665 119.0677 61.6711 33.8921 176.2560 41 V 4.2696 7.4507 119.7438 60.6284 34.4375 174.2594 42 E 3.9863 9.1776 128.1722 58.3596 29.6024 176.4274 43 S 4.0239 8.2568 121.2791 59.2674 61.3764 172.8232 44 A 4.7454 8.1433 119.7802 53.0991 23.5252 177.4423 45 M 4.6405 7.6498 113.2342 54.7345 35.6739 173.9994 46 S 5.2599 8.7642 120.5174 56.9528 67.9118 173.2595 47 V 4.8563 9.1755 114.3413 59.7732 35.9268 175.1102 48 V 5.0790 8.7574 115.9035 59.5521 35.3758 174.5919 49 E 4.8116 9.5411 126.7282 56.0080 30.9446 175.3938 50 V 4.9206 9.0139 126.8812 61.0406 35.1030 173.6231 51 E 4.6190 9.3485 129.5619 55.4590 30.7012 175.0691 52 L 4.9068 8.7398 127.2625 52.9885 45.1299 175.4509 53 Q 4.7640 8.3625 119.5974 54.8685 29.6587 176.3987 54 V 3.9140 8.7871 123.7507 65.2859 31.8132 176.0087 55 E 4.6711 8.0524 118.9265 54.1800 31.6472 174.2366 56 N 4.7892 8.9140 124.1606 52.4097 39.5689 174.5067 57 T 4.5788 9.7264 112.6095 59.1374 71.6619 173.1516 58 G 4.2470 7.7854 109.0454 44.2430 0.0000 172.5038 59 I 4.0917 7.6173 111.8020 60.9955 38.6729 175.1291 60 H 4.8662 7.8309 119.4593 54.2898 31.1814 173.5300 61 E 5.8526 8.1984 116.6157 54.6302 33.0418 174.3976 62 F 5.1126 9.0352 122.6511 57.0607 42.9153 172.9621 63 K 5.1956 7.9271 124.9094 54.5999 34.3856 175.1581 64 T 4.2266 7.7876 115.8449 61.6881 71.0401 171.1180 65 D 5.4018 8.3940 123.8083 52.8980 43.4255 176.1946 66 V 4.5866 8.1586 114.3168 58.9890 36.4825 174.9109 67 L 4.4052 8.7314 121.7873 55.5488 41.8266 177.0502 68 A 4.5623 8.7423 122.4554 50.7653 20.5552 177.0331 69 G 3.8940 8.2801 103.6856 43.7632 0.0000 171.2062 70 P 4.0609 0.0000 0.0000 62.2290 31.6331 175.7086 71 L 4.3027 7.9226 122.8229 52.6054 43.4595 176.6189 72 W 4.7174 8.5589 123.4745 57.9801 29.8889 176.8710 73 S 4.8769 7.4330 111.9714 56.2019 66.2002 174.7583 74 N 4.6750 9.0409 120.9042 56.9303 38.4166 176.8522 75 D 4.3644 8.1485 120.0942 57.4181 40.9982 178.2407 76 E 3.9332 8.2860 119.5298 58.9448 29.5331 178.6063 77 A 3.3483 7.7629 121.1059 55.1029 18.0187 179.7280 78 Q 3.9806 8.0288 115.2950 58.4447 28.7554 178.5432 79 K 4.0786 7.2521 119.0378 59.0941 32.6419 178.2636 80 L 4.2553 8.2201 119.0711 56.1754 41.8231 179.0143 81 G 2.4974 7.9462 106.8345 47.1625 0.0000 173.7058 82 P 4.3660 0.0000 0.0000 65.2544 31.5159 178.8251 83 Q 3.9665 7.8680 116.2393 58.9533 28.5152 178.5897 84 I 3.7298 7.8085 120.0229 64.2598 37.3420 177.9791 85 A 4.1913 8.5886 121.7713 55.2203 18.1408 179.5432 86 A 4.1280 8.2807 119.6114 55.1476 18.2361 179.4891 87 S 4.2696 7.8867 110.6094 60.2804 63.1663 174.4468 88 Y 4.5254 7.9769 119.3518 57.1991 38.3389 175.5118 89 G 3.9933 8.7626 107.8306 46.2502 0.0000 173.1834 90 A 4.6664 7.9063 120.8109 50.9443 22.5624 175.4755 91 E 4.8253 8.4628 117.0288 54.8567 32.4292 175.5750 92 F 5.1731 8.7161 125.0579 57.9290 39.9110 175.6359 93 T 3.9057 8.0855 115.7559 62.1729 68.9622 175.6715 94 G 3.3294 5.7974 109.4965 44.8062 0.0000 173.6022 95 Q 4.6358 7.2499 119.4393 55.0227 30.2971 175.0306 96 W 5.2098 8.2691 117.7780 56.3974 30.7257 173.4195 97 R 3.8575 8.5179 115.2952 55.3516 32.4868 173.9325 98 T 4.5853 8.2435 118.4494 63.5330 68.6822 174.5618 99 I 4.1606 8.5266 119.5725 61.4552 39.5892 175.9749 100 V 4.1518 7.4942 121.2732 60.3073 32.6984 173.3999 101 E 3.9362 8.8635 127.3024 57.9402 29.6223 177.2702 102 G 4.2638 9.0125 112.3565 46.3095 0.0000 173.2054 103 V 4.3491 8.3427 117.6712 64.0026 33.6877 175.3790 104 M 4.8545 7.7516 118.5507 54.1072 35.9854 173.2575 105 S 5.2666 8.6548 119.8805 56.9270 67.9044 173.1300 106 V 5.1236 9.0629 113.8453 59.6727 36.1124 174.8797 107 I 5.1555 8.2736 115.3385 59.1860 41.2463 174.1130 108 Q 4.9485 9.5195 126.4296 54.9156 30.3231 174.7151 109 I 4.9737 8.7276 120.0120 58.9197 41.4770 174.3064 110 K 4.7670 8.8704 124.1309 54.9484 34.7961 174.6878 111 Y 4.9904 9.4423 126.0025 57.7375 39.8879 174.8005 112 T 5.3344 8.8030 118.8112 61.7469 71.7265 173.9529 113 F 4.6262 8.6660 121.0180 57.1890 38.2567 174.3559 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 A 8.11 4.58 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 2 S 8.48 5.19 0.00 4.01 3.83 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 3 Y 9.42 4.97 0.00 3.03 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 4 K 8.62 5.15 0.00 1.63 1.70 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.67 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.28 1.40 7.81 5 V 8.37 4.61 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 0.83 0.00 0.00 0.93 0.00 0.00 6 N 8.68 5.26 0.00 2.62 2.77 0.00 0.00 6.74 7.45 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 7 I 8.76 4.58 1.83 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.74 0.00 0.00 8 P 0.00 4.82 0.00 1.92 1.97 0.00 3.58 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 9 A 8.41 4.44 1.09 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 10 G 8.22 3.78 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 0.00 11 P 0.00 4.22 0.00 0.85 1.70 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.04 0.00 12 L 7.75 4.25 0.00 1.26 0.90 0.45 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 W 8.87 4.75 0.00 3.30 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 14 S 7.40 4.82 0.00 4.10 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 15 N 8.97 4.66 0.00 3.17 3.05 0.00 0.00 6.79 8.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.07 3.99 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 17 E 8.15 3.83 0.00 2.04 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 0.00 2.10 2.24 0.00 18 A 7.49 3.30 -0.39 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 19 Q 8.07 4.26 0.00 2.03 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.75 2.65 0.00 20 Q 7.17 4.17 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 21 V 7.83 3.78 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 0.83 0.00 0.00 0.84 0.00 0.00 22 G 7.71 2.39 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 23 P 0.00 4.29 0.00 2.13 2.14 0.00 3.41 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 24 K 7.75 3.94 0.00 1.80 1.76 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.39 7.81 25 I 7.72 3.66 1.87 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 1.51 1.14 0.89 0.00 0.00 26 A 8.16 4.02 1.45 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 27 A 8.19 3.95 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 28 A 7.71 3.93 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 29 H 7.39 4.72 0.00 3.16 3.32 0.00 5.81 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.91 3.42 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 31 G 8.33 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 32 N 8.71 5.22 0.00 2.60 2.70 0.00 0.00 7.09 8.39 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 33 F 9.03 5.02 0.00 3.00 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 34 T 8.16 3.90 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 1.21 0.00 0.00 35 G 5.77 3.49 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 0.00 0.00 0.00 36 Q 7.31 4.66 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.56 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 37 W 8.16 5.20 0.00 3.73 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 38 T 8.50 3.55 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 1.15 0.00 0.00 39 T 8.10 4.68 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 1.24 0.00 0.00 40 V 8.77 4.20 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 0.62 0.00 0.00 0.95 0.00 0.00 41 V 7.45 4.27 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 0.99 0.00 0.00 0.93 0.00 0.00 42 E 9.18 3.99 0.00 1.98 1.94 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 2.34 2.36 0.00 43 S 8.26 4.02 0.00 4.39 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 0.00 44 A 8.14 4.75 1.29 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 45 M 7.65 4.64 0.00 2.09 1.83 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.61 0.00 46 S 8.76 5.26 0.00 3.91 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 47 V 9.18 4.86 2.12 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 0.76 0.00 0.00 1.01 0.00 0.00 48 V 8.76 5.08 2.21 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 0.50 0.00 0.00 0.94 0.00 0.00 49 E 9.54 4.81 0.00 2.18 1.90 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 2.30 2.27 0.00 50 V 9.01 4.92 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 0.91 0.00 0.00 1.07 0.00 0.00 51 E 9.35 4.62 0.00 1.99 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 2.20 2.22 0.00 52 L 8.74 4.91 0.00 0.42 1.26 0.85 0.61 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 53 Q 8.36 4.76 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.05 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 54 V 8.79 3.91 2.17 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 0.75 0.00 0.00 1.08 0.00 0.00 55 E 8.05 4.67 0.00 1.97 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 0.00 2.22 2.33 0.00 56 N 8.91 4.79 0.00 2.88 3.01 0.00 0.00 6.95 7.54 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 57 T 9.73 4.58 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 1.25 0.00 0.00 58 G 7.79 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 59 I 7.62 4.09 1.72 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.10 0.84 0.00 0.00 60 H 7.83 4.87 0.00 1.43 2.43 0.00 5.78 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.20 5.85 0.00 2.04 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 2.17 2.19 0.00 62 F 9.04 5.11 0.00 3.42 3.25 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 63 K 7.93 5.20 0.00 1.46 1.53 0.00 1.82 0.00 0.00 2.21 0.00 0.00 2.62 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.19 7.81 64 T 7.79 4.23 4.00 0.00 0.00 0.00 0.00 0.00 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 65 D 8.39 5.40 0.00 2.60 2.52 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 66 V 8.16 4.59 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 0.64 0.00 0.00 -0.00 0.00 0.00 67 L 8.73 4.41 0.00 1.67 1.68 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.74 4.56 1.19 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 0.00 0.00 0.00 69 G 8.28 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 0.00 0.00 0.00 70 P 0.00 4.06 0.00 1.29 1.88 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 71 L 7.92 4.30 0.00 1.30 0.87 0.47 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 72 W 8.56 4.72 0.00 3.35 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 73 S 7.43 4.88 0.00 4.12 4.05 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 0.00 0.00 0.00 74 N 9.04 4.68 0.00 3.16 3.06 0.00 0.00 6.92 8.49 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 75 D 8.15 4.36 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 76 E 8.29 3.93 0.00 2.04 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 2.16 2.27 0.00 77 A 7.76 3.35 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.03 3.98 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.90 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 79 K 7.25 4.08 0.00 1.84 1.94 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.44 7.81 80 L 8.22 4.26 0.00 1.43 1.51 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.95 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 0.00 0.00 0.00 82 P 0.00 4.37 0.00 2.17 2.18 0.00 3.60 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 2.19 2.42 0.00 83 Q 7.87 3.97 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 84 I 7.81 3.73 1.84 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.49 1.00 0.00 0.00 85 A 8.59 4.19 1.46 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 86 A 8.28 4.13 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 87 S 7.89 4.27 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 88 Y 7.98 4.53 0.00 3.10 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 89 G 8.76 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 90 A 7.91 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 8.46 4.83 0.00 1.96 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 2.28 2.27 0.00 92 F 8.72 5.17 0.00 2.98 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 93 T 8.09 3.91 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 1.18 0.00 0.00 94 G 5.80 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 0.00 0.00 0.00 95 Q 7.25 4.64 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.64 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 96 W 8.27 5.21 0.00 3.68 3.25 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 97 R 8.52 3.86 0.00 1.58 1.72 0.00 2.65 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 0.00 98 T 8.24 4.59 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 1.26 0.00 0.00 99 I 8.53 4.16 1.86 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 1.21 0.59 0.90 0.00 0.00 100 V 7.49 4.15 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 1.08 0.00 0.00 0.93 0.00 0.00 101 E 8.86 3.94 0.00 1.96 1.92 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 2.36 2.49 0.00 102 G 9.01 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 0.00 0.00 0.00 0.00 103 V 8.34 4.35 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 0.80 0.00 0.00 0.98 0.00 0.00 104 M 7.75 4.85 0.00 2.11 1.80 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 105 S 8.65 5.27 0.00 3.88 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 0.00 106 V 9.06 5.12 2.17 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 0.82 0.00 0.00 0.99 0.00 0.00 107 I 8.27 5.16 2.06 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.69 0.76 0.00 0.00 108 Q 9.52 4.95 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.06 0.00 109 I 8.73 4.97 1.60 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.11 0.72 0.00 0.00 110 K 8.87 4.77 0.00 1.72 1.65 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.37 1.40 7.81 111 Y 9.44 4.99 0.00 3.40 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 0.00 112 T 8.80 5.33 4.47 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 1.26 0.00 0.00 113 F 8.67 4.63 0.00 3.08 3.11 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