NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8907 8.2893 118.3402 55.7256 32.7097 174.1793 2 T 4.5789 9.3204 113.2943 59.3796 73.2038 170.4274 3 Q 5.1381 8.6135 122.9058 54.6598 31.2580 175.4402 4 C 4.8026 9.0864 127.6946 58.3591 32.3168 172.5441 5 P 4.4286 0.0000 0.0000 64.6248 31.0661 176.5973 6 R 4.3438 7.7623 118.3700 58.2261 31.2592 176.5588 7 C 4.2645 7.9517 110.9483 58.2950 30.4298 174.2166 8 Q 3.7371 8.1699 117.7953 56.7639 26.9198 173.8531 9 R 4.1937 7.4038 115.7254 56.3177 31.5356 175.6596 10 N 5.2767 8.6522 119.6813 52.5315 39.3652 174.5463 11 L 4.9826 9.3180 123.7345 52.4023 46.2284 176.7183 12 A 4.3737 8.5491 123.7176 51.6884 19.4453 178.4289 13 A 4.1695 8.8770 123.2250 55.5755 18.3591 179.3961 14 D 4.5901 8.0296 112.3020 54.7339 39.9912 176.6103 15 E 4.0535 8.3577 119.7698 56.6859 29.9969 175.7300 16 F 4.9021 7.3568 117.2412 55.6456 41.3646 174.8077 17 Y 4.4763 8.3957 119.4915 57.4881 38.7946 175.7166 18 A 4.4374 8.6610 123.4804 53.6402 20.1432 178.5094 19 G 4.0136 7.7905 107.1053 45.4550 0.0000 173.8717 20 S 4.3847 8.4651 115.4869 58.7883 63.7497 174.6090 21 S 4.2941 7.7051 116.6631 58.4215 63.5063 174.1264 22 K 4.3204 8.5272 122.2088 57.8870 32.9647 177.2859 23 M 4.5043 7.9089 115.2230 54.6097 32.1384 176.1494 24 C 4.2797 8.5261 115.6833 57.7962 31.9067 174.8074 25 K 3.9578 8.7627 121.1606 59.3366 31.4058 180.0375 26 G 3.5915 8.0307 105.5167 48.0121 0.0000 175.2796 27 C 4.2576 8.0976 119.2753 62.7485 28.1772 175.8041 28 M 4.0782 8.5012 119.9848 59.0793 31.7720 178.4141 29 T 3.7964 8.3438 116.2939 66.0920 68.5340 176.5602 30 W 3.4758 8.4577 130.7593 60.2192 30.7437 177.7228 31 Q 3.6596 8.3338 119.8189 59.1912 28.4872 177.8973 32 N 4.2034 8.2008 117.7245 56.2749 38.5187 176.9709 33 L 3.3574 7.5336 121.6132 58.1198 41.9906 179.3198 34 S 3.6291 7.0509 114.8714 61.4073 62.6824 176.0688 35 Y 3.9075 7.7731 122.1730 60.7172 38.5500 177.7690 36 N 4.2540 8.6610 117.5919 56.1176 38.5912 177.2007 37 A 4.1251 8.1092 122.3057 55.1975 18.4085 178.9475 38 N 4.0896 7.8654 115.4664 56.9395 38.7791 176.9082 39 K 3.7333 7.5224 119.2176 58.8945 32.3266 177.6045 40 E 4.3304 8.0538 115.9553 55.0298 29.9556 176.1137 41 G 3.8316 7.4752 107.1556 46.8665 0.0000 173.3565 42 H 4.9576 8.0344 115.8186 53.9072 30.2907 175.8070 43 A 4.2880 8.5212 123.4106 52.1954 20.0344 176.3518 44 N 5.4832 8.5376 117.7596 52.7031 40.6148 174.0409 45 T 4.4181 9.1361 117.4783 62.1710 70.4185 175.3065 46 F 4.3455 8.1665 122.1888 58.1967 39.6105 175.4784 47 T 4.5751 8.2816 114.7122 59.9701 71.9895 175.8389 48 K 2.0000 7.8411 121.2741 58.9145 32.0387 178.3539 49 A 3.8580 7.6478 120.2944 55.6238 18.3230 179.4308 50 T 3.9084 7.7443 111.0069 65.0288 67.3379 176.1723 51 F 3.9604 8.4172 123.0480 61.2980 39.3824 177.1187 52 L 3.7939 8.2680 118.7782 57.7201 41.1358 179.4662 53 A 4.0123 7.7813 119.8700 54.5766 18.3630 179.2429 54 W 4.1609 8.1637 126.4504 60.9219 30.9681 177.4938 55 Y 3.8809 8.3689 118.4639 59.5864 38.6127 177.7805 56 G 3.5240 7.9890 108.0398 46.2546 0.0000 172.7354 57 L 4.8154 7.6978 120.8690 52.3744 45.4564 177.0452 58 S 3.8134 10.7700 115.9135 61.6239 62.2072 176.6404 59 A 4.0972 7.7892 119.9909 53.9976 18.3083 177.6994 60 Q 4.3027 7.7864 113.4528 56.2338 29.9066 175.9983 61 R 4.1545 7.4641 118.6359 55.9186 31.2127 175.4312 62 H 5.2052 8.4201 119.7113 53.7171 33.3867 172.8048 63 C 3.9646 8.9374 122.7672 60.1957 32.0250 174.6138 64 G 3.6922 9.2416 114.5253 46.8085 0.0000 173.7312 65 Y 4.5937 7.7883 117.7381 59.7610 38.8941 177.0796 66 C 4.6838 8.2956 111.3110 57.6911 30.7669 174.7199 67 G 3.9866 8.2150 108.2184 45.3103 0.0000 173.7434 68 I 3.9881 7.6684 120.9568 60.7597 38.7710 175.5494 69 S 4.4782 8.4086 122.7093 57.8615 65.0275 175.0186 70 E 3.8996 8.3555 122.9755 59.5284 29.3199 179.1935 71 A 4.0837 7.9418 120.4668 54.9473 18.3075 179.5800 72 G 3.5169 8.0262 103.5612 47.9404 0.0000 175.4035 73 F 3.9637 8.3421 123.1406 61.1182 39.3575 177.1504 74 T 4.0421 8.0812 115.7157 66.8014 68.1171 176.1010 75 S 4.1920 7.6782 113.3672 59.8784 63.1572 175.3896 76 L 3.9611 7.3374 121.7541 54.5479 42.6511 175.7518 77 H 3.8826 7.3849 115.7486 56.6930 26.9333 174.9653 78 R 4.3203 7.2444 117.7484 55.8731 31.4885 176.2804 79 T 5.1070 8.2039 110.4678 59.6899 71.1287 174.0495 80 N 4.8084 8.8349 122.4154 51.5284 38.4558 174.0328 81 P 4.4480 0.0000 0.0000 64.6765 31.3120 177.9013 82 R 3.9044 8.1037 116.2953 56.8917 30.4520 176.2738 83 G 4.2746 7.5178 106.6458 43.9267 0.0000 172.4027 84 Y 4.8297 8.3874 123.9614 55.9943 40.8046 174.9209 85 H 4.8346 8.8620 121.3882 56.6544 30.5115 174.6271 86 I 4.2879 8.9927 127.9424 61.0604 37.5589 175.9340 87 Q 4.5872 9.3066 122.9808 54.3291 30.4451 174.3675 88 C 5.0048 7.8430 111.4711 56.6767 32.7885 173.1986 89 L 4.3802 8.7230 120.6607 54.0573 42.5401 177.0312 90 G 4.6822 8.5325 109.6333 44.6793 0.0000 171.6817 91 V 5.3707 8.6118 118.7896 60.0869 33.7688 174.6111 92 D 4.9186 9.7311 124.6594 53.0316 43.0444 175.7847 93 R 4.4062 8.7031 125.5168 55.5923 28.8675 176.2014 94 S 4.8321 9.2220 119.6948 60.6596 63.7652 174.8874 95 D 4.5554 8.7503 124.2150 52.9799 40.3904 176.5247 96 S 4.2156 8.6262 121.8305 60.1043 62.6190 174.6694 97 F 4.3769 8.7606 117.7671 59.0612 39.1141 175.3569 98 E 4.6415 7.8719 119.8634 54.6046 31.7457 175.9962 99 G 3.9426 8.0202 108.0406 46.1400 0.0000 172.0103 100 Y 4.8596 8.5861 119.8181 57.5184 39.2614 175.2355 101 S 4.3185 8.3936 116.4818 57.5641 65.7124 174.1391 102 P 3.7730 0.0000 0.0000 65.7189 31.2523 177.9242 103 Q 4.0711 7.9285 117.4032 58.6134 29.2473 176.2239 104 N 4.5951 8.4614 115.2876 54.1987 39.6343 174.2600 105 A 4.9722 7.9638 120.0261 52.1346 19.5404 176.9928 106 R 4.9940 8.9672 120.0760 54.5913 34.4548 173.9151 107 L 4.9221 8.8453 127.9909 55.2484 43.3842 175.2994 108 A 5.1881 9.4504 127.7226 50.1162 23.1340 175.4187 109 C 4.1370 8.6836 115.0841 57.5167 30.8048 174.7256 110 F 4.6009 8.0934 122.4224 61.2925 38.9050 177.7030 111 I 3.8159 7.9633 119.3828 64.7983 37.0882 177.9686 112 C 4.2378 8.2134 117.0945 62.5958 28.0090 175.5134 113 N 4.3768 8.4795 118.8669 56.9463 38.4021 177.2452 114 R 3.8798 7.5374 117.8420 59.0177 30.1251 178.7804 115 I 3.8725 7.6133 118.9018 64.3292 37.4273 177.9834 116 K 4.1306 8.3659 120.5609 58.9705 32.2387 177.1283 117 S 3.3728 8.0866 114.2446 59.8095 62.7935 172.1371 118 N 4.8683 8.5767 112.7988 52.4981 37.5280 175.9743 119 I 3.8427 7.7812 120.3418 63.7609 37.9648 176.2767 120 F 4.9960 7.4579 117.2659 55.8286 40.6562 176.6117 121 S 4.4996 8.6061 119.1702 57.8007 64.9905 175.3549 122 A 4.2038 8.6663 124.5451 55.6505 18.2845 180.2603 123 S 4.1538 8.1412 112.1712 61.5947 63.2357 176.3964 124 E 4.0443 8.2729 122.2406 59.4579 29.1916 179.0054 125 M 3.8129 8.6476 118.5519 58.2977 32.0081 177.8183 126 D 4.5848 8.4058 119.6842 57.5438 41.1223 179.1002 127 V 3.5709 7.4207 117.4399 65.8832 31.4773 177.9638 128 L 4.0109 7.7236 118.8316 57.7282 41.3221 179.5894 129 G 4.0271 8.5684 107.1894 47.4389 0.0000 175.5030 130 E 3.9591 8.0638 120.5973 58.9655 29.2713 179.4050 131 A 3.9271 7.4965 119.6036 55.0035 18.4451 179.6176 132 I 3.1535 7.7695 118.5664 64.4951 37.1241 178.4475 133 S 4.1636 8.2184 114.0782 61.4142 62.1154 176.4935 134 K 3.9728 7.7631 120.9269 59.0957 31.7316 178.8755 135 A 3.8874 7.4568 120.9851 55.1055 18.2448 179.6416 136 W 4.6425 7.6953 116.9901 60.4696 29.0557 178.0819 137 H 4.2815 9.1338 118.5586 59.5369 29.0023 177.4536 138 G 3.6866 8.5446 106.6897 47.6300 0.0000 175.1142 139 R 4.3585 8.1104 117.4077 55.6160 30.4062 176.4350 140 G 3.8819 7.9502 106.7828 46.9534 0.0000 174.0778 141 I 4.5309 8.0047 118.7751 58.9543 40.6866 176.0221 142 A 4.3998 8.4967 126.1115 52.3449 19.1490 175.7555 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 8.29 4.89 0.00 2.06 2.19 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 2.48 2.51 0.00 2 T 9.32 4.58 4.13 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 0.00 0.00 0.00 1.16 0.00 0.00 3 Q 8.61 5.14 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.63 0.00 4 C 9.09 4.80 0.00 3.39 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 5 P 0.00 4.43 0.00 2.25 2.18 0.00 3.95 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 6 R 7.76 4.34 0.00 1.83 2.02 0.00 3.34 0.00 0.00 3.33 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 7 C 7.95 4.26 0.00 3.15 3.17 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 8 Q 8.17 3.74 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 9 R 7.40 4.19 0.00 1.83 1.85 0.00 3.09 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 10 N 8.65 5.28 0.00 2.61 2.80 0.00 0.00 6.74 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 11 L 9.32 4.98 0.00 1.59 1.34 0.67 0.58 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 12 A 8.55 4.37 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 13 A 8.88 4.17 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 14 D 8.03 4.59 0.00 2.75 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 15 E 8.36 4.05 0.00 1.81 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 2.10 2.18 0.00 16 F 7.36 4.90 0.00 3.18 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 17 Y 8.40 4.48 0.00 3.04 2.89 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 18 A 8.66 4.44 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 19 G 7.79 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 0.00 0.00 0.00 20 S 8.47 4.38 0.00 3.94 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 21 S 7.71 4.29 0.00 3.95 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 22 K 8.53 4.32 0.00 1.78 1.91 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.40 7.81 23 M 7.91 4.50 0.00 2.22 2.18 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 2.73 2.63 0.00 24 C 8.53 4.28 0.00 2.69 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 25 K 8.76 3.96 0.00 1.71 1.95 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.59 0.96 7.81 26 G 8.03 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 C 8.10 4.26 0.00 3.21 3.10 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 28 M 8.50 4.08 0.00 2.44 2.31 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 29 T 8.34 3.80 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 1.09 0.00 0.00 30 W 8.46 3.48 0.00 3.18 3.19 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 31 Q 8.33 3.66 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.54 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 32 N 8.20 4.20 0.00 2.82 2.76 0.00 0.00 6.70 6.57 0.00 0.00 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 L 7.53 3.36 0.00 1.14 0.92 0.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.05 3.63 0.00 3.45 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 35 Y 7.77 3.91 0.00 2.97 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 36 N 8.66 4.25 0.00 2.81 2.95 0.00 0.00 6.95 7.10 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 37 A 8.11 4.13 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 38 N 7.87 4.09 0.00 2.67 2.77 0.00 0.00 6.93 6.31 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 39 K 7.52 3.73 0.00 1.24 1.70 0.00 1.79 0.00 0.00 1.50 0.00 0.00 3.15 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.34 7.81 40 E 8.05 4.33 0.00 1.83 1.72 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 2.36 2.48 0.00 41 G 7.48 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 0.00 0.00 0.00 42 H 8.03 4.96 0.00 3.11 3.14 0.00 5.66 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.52 4.29 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 44 N 8.54 5.48 0.00 2.75 2.73 0.00 0.00 6.99 7.70 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 45 T 9.14 4.42 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 1.20 0.00 0.00 46 F 8.17 4.35 0.00 3.56 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 47 T 8.28 4.58 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 1.26 0.00 0.00 48 K 7.84 2.00 0.00 1.16 1.46 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.04 0.21 7.81 49 A 7.65 3.86 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 50 T 7.74 3.91 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 1.54 0.00 0.00 51 F 8.42 3.96 0.00 2.74 2.73 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 52 L 8.27 3.79 0.00 1.63 1.65 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.78 4.01 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 54 W 8.16 4.16 0.00 3.52 3.37 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 55 Y 8.37 3.88 0.00 2.00 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 56 G 7.99 3.52 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 0.00 57 L 7.70 4.82 0.00 1.55 1.41 0.85 0.67 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 58 S 10.77 3.81 0.00 3.87 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 59 A 7.79 4.10 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 60 Q 7.79 4.30 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 61 R 7.46 4.15 0.00 1.62 1.58 0.00 2.37 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.39 0.00 62 H 8.42 5.21 0.00 2.90 3.27 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.94 3.96 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 64 G 9.24 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 65 Y 7.79 4.59 0.00 3.23 3.01 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 66 C 8.30 4.68 0.00 3.23 3.21 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 67 G 8.22 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 68 I 7.67 3.99 1.99 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.21 1.01 0.00 0.00 69 S 8.41 4.48 0.00 3.93 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 70 E 8.36 3.90 0.00 1.98 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 2.27 2.35 0.00 71 A 7.94 4.08 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 72 G 8.03 3.52 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 0.00 73 F 8.34 3.96 0.00 3.11 3.08 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 74 T 8.08 4.04 4.41 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 0.00 0.00 0.00 1.22 0.00 0.00 75 S 7.68 4.19 0.00 3.94 4.02 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 0.00 0.00 0.00 0.00 76 L 7.34 3.96 0.00 1.15 1.41 -0.03 0.62 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 77 H 7.38 3.88 0.00 3.20 3.18 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.24 4.32 0.00 1.89 1.98 0.00 3.16 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.26 0.00 79 T 8.20 5.11 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 1.25 0.00 0.00 80 N 8.83 4.81 0.00 2.88 2.96 0.00 0.00 6.86 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 81 P 0.00 4.45 0.00 2.10 2.21 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.31 0.00 82 R 8.10 3.90 0.00 1.89 1.69 0.00 3.27 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 83 G 7.52 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 84 Y 8.39 4.83 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 85 H 8.86 4.83 0.00 3.21 3.31 0.00 5.74 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.99 4.29 2.11 0.00 0.00 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 1.28 0.92 1.18 0.00 0.00 87 Q 9.31 4.59 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.15 2.27 0.00 88 C 7.84 5.00 0.00 3.29 2.88 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 89 L 8.72 4.38 0.00 1.64 1.62 0.89 0.45 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 90 G 8.53 4.68 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 91 V 8.61 5.37 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 1.01 0.00 0.00 1.23 0.00 0.00 92 D 9.73 4.92 0.00 3.16 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 R 8.70 4.41 0.00 1.56 1.82 0.00 2.73 0.00 0.00 2.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.13 0.00 94 S 9.22 4.83 0.00 4.00 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 0.00 95 D 8.75 4.56 0.00 2.80 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 96 S 8.63 4.22 0.00 3.79 3.61 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 97 F 8.76 4.38 0.00 3.17 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 98 E 7.87 4.64 0.00 2.09 1.85 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 2.31 2.39 0.00 99 G 8.02 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 0.00 100 Y 8.59 4.86 0.00 2.99 3.08 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 0.00 101 S 8.39 4.32 0.00 3.66 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 0.00 102 P 0.00 3.77 0.00 1.91 2.07 0.00 3.28 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.41 0.00 103 Q 7.93 4.07 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 104 N 8.46 4.60 0.00 2.81 2.87 0.00 0.00 7.07 9.28 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 0.00 105 A 7.96 4.97 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 0.00 106 R 8.97 4.99 0.00 2.05 1.86 0.00 3.12 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.60 0.00 107 L 8.85 4.92 0.00 1.65 1.46 1.03 0.70 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 0.00 108 A 9.45 5.19 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 0.00 109 C 8.68 4.14 0.00 1.66 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.09 4.60 0.00 3.16 3.41 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 0.00 0.00 0.00 0.00 111 I 7.96 3.82 2.39 0.00 0.00 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 1.90 1.09 1.22 0.00 0.00 112 C 8.21 4.24 0.00 3.16 3.12 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 0.00 113 N 8.48 4.38 0.00 3.15 2.99 0.00 0.00 7.19 7.16 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 0.00 114 R 7.54 3.88 0.00 1.72 1.82 0.00 2.66 0.00 0.00 2.98 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.78 0.00 115 I 7.61 3.87 1.98 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 1.42 0.55 0.89 0.00 0.00 116 K 8.37 4.13 0.00 1.68 1.98 0.00 1.42 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.44 1.58 7.81 117 S 8.09 3.37 0.00 4.15 3.36 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 0.00 118 N 8.58 4.87 0.00 2.56 2.68 0.00 0.00 5.82 7.81 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 0.00 119 I 7.78 3.84 1.25 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.40 -0.17 0.00 0.00 120 F 7.46 5.00 0.00 2.97 2.89 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 0.00 121 S 8.61 4.50 0.00 4.08 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 0.00 122 A 8.67 4.20 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 0.00 123 S 8.14 4.15 0.00 4.11 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 0.00 124 E 8.27 4.04 0.00 2.35 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 2.40 2.39 0.00 125 M 8.65 3.81 0.00 1.68 1.87 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.47 0.00 126 D 8.41 4.58 0.00 2.99 2.79 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 0.00 127 V 7.42 3.57 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 0.98 0.00 0.00 0.98 0.00 0.00 128 L 7.72 4.01 0.00 1.60 1.48 0.20 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.57 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 0.00 130 E 8.06 3.96 0.00 2.09 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 2.34 2.51 0.00 131 A 7.50 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 0.00 132 I 7.77 3.15 1.86 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 1.14 0.46 0.33 0.00 0.00 133 S 8.22 4.16 0.00 4.11 4.02 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 0.00 0.00 0.00 0.00 134 K 7.76 3.97 0.00 1.92 1.81 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.53 7.81 135 A 7.46 3.89 0.93 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 0.00 136 W 7.70 4.64 0.00 3.51 3.23 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 0.00 137 H 9.13 4.28 0.00 3.34 3.54 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.54 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 0.00 139 R 8.11 4.36 0.00 2.09 2.08 0.00 3.59 0.00 0.00 3.38 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.05 0.00 140 G 7.95 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 0.00 141 I 8.00 4.53 2.06 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.72 0.75 0.00 0.00 142 A 8.50 4.40 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