NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1347 8.1727 122.0453 56.2778 34.1081 174.1217 2 V 4.5579 8.1358 127.0168 60.5952 32.3210 174.4278 3 F 4.4855 10.0356 128.7646 57.6574 40.2180 174.7949 4 E 4.2931 9.2889 120.7831 55.4117 31.2234 176.6773 5 R 3.2390 8.9090 120.2354 60.8175 29.8962 179.4369 6 C 4.3401 7.9769 115.4146 59.6405 35.6164 175.7879 7 E 3.8759 8.0574 120.8669 59.0954 29.3293 178.4752 8 L 3.3890 7.8991 120.1223 57.8334 42.0678 178.5047 9 A 3.9244 7.7434 120.7435 55.5372 18.2453 179.9307 10 R 3.8833 7.9623 116.3271 59.4563 29.9624 179.4402 11 T 3.8374 7.6985 115.4933 66.5659 68.5843 176.6827 12 L 3.8238 8.2886 121.1421 57.5918 41.6268 179.4418 13 K 3.8996 8.1280 119.6094 59.6148 31.9145 178.7894 14 R 3.9624 7.9611 117.7779 58.9290 29.9825 177.4329 15 L 4.4288 7.2810 116.6832 54.1764 41.6890 177.1975 16 G 3.9215 7.7576 106.8016 46.4347 0.0000 175.0506 17 M 3.9326 7.8032 121.4846 57.0121 32.2219 175.2910 18 D 4.6063 8.0600 117.4528 55.8300 41.0638 175.5057 19 G 3.9327 9.4551 115.3347 45.8527 0.0000 171.2740 20 Y 4.2224 8.4012 121.9019 58.5742 39.0017 176.3425 21 R 3.5990 9.0121 126.1937 57.2091 27.8260 177.2989 22 G 3.8211 8.1017 104.1719 45.5097 0.0000 174.2177 23 I 3.9964 7.6555 122.3230 59.3711 37.5530 175.9552 24 S 4.6513 8.3085 120.3384 57.6500 64.0073 174.9694 25 L 4.1896 8.6699 123.0915 58.5573 41.7298 179.0311 26 A 4.1413 8.2407 120.0928 55.5181 18.2241 179.2499 27 N 4.4442 8.0491 114.8867 56.3959 38.6114 177.7348 28 W 4.2620 8.0464 119.8484 60.0288 29.1197 178.3784 29 M 4.1930 8.4996 118.9220 58.5095 31.4096 177.9766 30 C 3.2281 8.1601 118.7292 59.0005 41.6439 175.3742 31 L 3.9813 8.1742 121.7405 58.2801 41.8706 178.7394 32 A 4.2355 8.3561 120.7827 55.0081 18.2602 179.4788 33 K 2.8244 8.1232 118.0471 59.3547 32.0625 179.1863 34 W 4.3090 7.7025 117.3609 59.2490 29.0524 178.3474 35 E 4.3697 8.5659 118.9966 58.7066 29.2058 177.8780 36 S 4.5162 7.7963 108.6552 56.9110 65.0949 174.1642 37 G 3.2719 8.1865 108.7662 47.1626 0.0000 173.5362 38 Y 3.6654 7.6506 112.9527 58.6460 35.4702 168.7087 39 N 5.2736 7.7146 119.4655 52.0230 40.0314 175.6376 40 T 4.2154 8.9029 117.5044 64.1554 69.2540 176.4930 41 R 4.2180 8.3125 119.6314 56.9044 30.7761 176.5482 42 A 4.2608 7.5295 119.8176 53.0141 19.2714 176.7564 43 T 5.0608 8.2997 110.7110 60.1897 72.3781 172.8559 44 N 4.9250 8.8298 122.3140 52.1934 42.3631 172.3353 45 Y 4.7293 8.7367 127.5553 57.1468 40.9642 173.8722 46 N 4.8196 8.6336 124.5270 51.1030 38.7920 175.1566 47 A 3.7844 8.3778 127.4586 54.8623 18.8905 179.1458 48 G 3.8040 8.0935 104.0109 48.2160 0.0000 173.8053 49 D 4.7272 7.5376 115.5903 51.4716 40.5327 175.4770 50 R 3.6944 7.8249 113.6577 56.8384 28.8188 174.7471 51 S 4.9651 7.3670 110.0356 57.7922 67.5233 173.5583 52 T 5.0571 8.9269 115.5730 61.9890 72.8505 172.9905 53 D 5.3435 9.1540 125.5464 53.3976 43.0782 175.0401 54 Y 4.8994 9.0453 120.7519 57.4517 41.4215 177.3770 55 G 4.3727 9.1762 112.2954 46.1687 0.0000 173.4534 56 I 4.1866 8.2342 116.8982 62.9825 37.9383 177.5351 57 F 4.7771 7.9265 115.6167 56.5136 40.0322 175.2193 58 Q 3.5479 7.8277 119.2024 57.0155 26.4851 173.7457 59 I 4.4891 8.2275 119.0147 60.5818 39.4162 176.8043 60 N 5.2426 9.1487 126.4397 53.5808 39.5887 175.8129 61 S 4.5677 9.1884 121.0680 61.0792 63.3905 175.5591 62 R 3.8044 8.8598 122.2421 58.6501 30.3665 177.7811 63 Y 4.4623 7.9012 114.0699 57.1712 40.6480 176.6961 64 W 5.0162 8.3809 119.0543 57.4103 31.5462 173.7237 65 C 5.6670 8.2313 111.5141 53.7121 45.7187 172.8947 66 N 5.0399 9.0560 119.1462 51.9931 40.2556 174.7139 67 D 4.8813 8.6403 123.5560 52.1691 40.4018 178.2973 68 G 4.0451 8.3315 107.5404 46.3626 0.0000 174.7542 69 K 4.3954 8.0691 116.6587 56.7092 32.9449 176.0229 70 T 4.5419 7.7302 118.0193 61.4897 69.1701 172.4010 71 P 4.2917 0.0000 0.0000 64.3366 31.7312 176.0986 72 G 3.9769 8.7428 109.6807 46.2292 0.0000 172.9592 73 A 4.4279 7.2575 118.6935 51.1537 19.8254 177.6004 74 V 4.3634 8.4357 112.2134 59.3064 35.7930 176.0336 75 N 4.9505 8.0700 117.8189 51.7901 37.5949 174.3394 76 A 3.9036 8.5623 124.9300 55.0750 19.0932 178.6800 77 C 4.5250 8.5716 111.1549 57.6822 41.0166 173.0619 78 H 4.1457 7.8479 116.4578 56.6400 26.3876 174.2416 79 L 4.8392 8.2683 117.3192 52.8445 46.3632 176.6893 80 S 4.6397 8.3735 115.5244 58.0195 63.2865 176.0250 81 C 4.0645 8.7559 124.4414 59.6865 40.2438 176.4559 82 S 3.9182 7.9573 115.0243 61.1966 61.6896 175.9083 83 A 4.0299 7.8744 122.6524 54.5462 17.8393 177.9685 84 L 4.4343 7.7238 116.3047 55.1593 41.6925 177.6742 85 L 5.0812 7.9152 117.2840 54.5189 42.4341 176.7407 86 Q 4.3617 7.8414 117.7594 55.3599 29.5663 175.9596 87 D 4.3539 8.5103 119.7692 57.1425 41.1058 176.7135 88 N 4.5512 8.0201 118.2077 53.2318 39.0052 174.4957 89 I 4.2465 8.4513 119.2246 61.1087 37.9070 177.0185 90 A 3.9484 8.2133 125.0768 55.9627 18.1867 180.1896 91 D 4.2653 8.0735 116.5509 57.3171 40.9358 178.6222 92 A 4.1031 7.9791 120.9083 55.1857 18.3712 179.7109 93 V 3.4014 8.2664 116.9394 66.0433 31.5941 178.0923 94 A 3.8267 8.1706 120.7883 55.2346 18.0981 178.8651 95 C 4.2076 8.3591 116.7839 59.6945 38.1254 175.5423 96 A 3.9858 8.3150 122.8421 55.1541 17.5974 179.8115 97 K 3.8000 7.7223 116.1999 59.3755 32.4333 179.1500 98 R 4.0822 7.7922 119.0437 59.4779 29.8645 178.5958 99 V 2.5513 7.5692 118.0031 65.7475 31.1720 177.8397 100 V 3.9367 7.4722 108.3530 62.5519 31.6876 177.8002 101 R 4.2359 7.7047 117.2477 56.8835 30.4363 176.2576 102 D 4.7783 7.3733 119.6879 52.4652 42.1753 175.4648 103 P 4.2374 0.0000 0.0000 66.1471 31.4983 178.3924 104 Q 4.0214 8.1898 116.3559 56.7732 29.9719 177.5192 105 G 3.6801 7.7452 106.8013 46.1689 0.0000 176.1584 106 I 3.5508 7.7342 121.1691 63.1525 37.8828 177.4398 107 R 4.3056 7.4505 117.2253 57.3813 30.0229 177.3304 108 A 3.8932 7.7357 122.0263 54.3550 18.7366 178.1071 109 W 4.7042 8.0033 116.6467 55.6363 29.9100 177.2015 110 N 4.4768 9.1261 121.7731 56.3729 37.9371 177.1685 111 A 4.0361 8.2683 121.7739 54.6648 18.4530 179.3742 112 W 3.9265 8.3696 126.8183 60.6327 30.6167 178.3800 113 R 3.6797 8.2038 116.1069 59.4323 29.6966 178.3263 114 N 4.3932 8.0564 114.7069 55.4940 38.6381 176.1558 115 R 4.2488 7.7035 114.9179 55.7140 32.0023 175.1808 116 C 4.5183 7.2906 114.1693 57.9964 42.8815 174.3213 117 Q 3.1710 6.5922 119.8521 57.1845 28.6778 175.5546 118 N 4.1999 8.7066 120.1470 54.0927 36.2119 173.7515 119 R 4.5365 7.3213 115.5809 54.0830 32.9479 176.0713 120 D 4.5692 8.3656 119.1798 54.1281 39.8868 175.5166 121 V 4.5581 8.1285 117.6966 61.1288 32.2864 178.4803 122 R 4.0394 8.1789 122.4735 59.3573 29.9474 178.8062 123 Q 4.0068 8.1477 115.3562 59.2479 28.4386 178.3594 124 Y 4.1305 7.7012 115.1162 60.0074 38.3112 176.7630 125 V 4.3652 7.7993 111.0515 60.8214 33.2496 175.5636 126 Q 4.2284 7.4426 120.5213 57.2564 28.6808 176.9128 127 G 3.9953 8.9943 111.5144 45.6468 0.0000 174.5905 128 C 4.3720 7.8967 115.7718 57.4323 40.5040 174.0790 129 G 3.8407 8.1955 107.1257 46.6735 0.0000 174.0263 130 V 4.0050 7.8589 118.0567 61.0799 32.0640 175.8335 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 K 8.17 4.13 0.00 2.00 1.57 0.00 1.20 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.86 1.11 7.81 2 V 8.14 4.56 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 0.91 0.00 0.00 0.94 0.00 0.00 3 F 10.04 4.49 0.00 2.84 2.80 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 4 E 9.29 4.29 0.00 1.93 1.86 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 2.30 2.25 0.00 5 R 8.91 3.24 0.00 1.91 1.88 0.00 3.38 0.00 0.00 3.45 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 6 C 7.98 4.34 0.00 2.99 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 7 E 8.06 3.88 0.00 2.06 2.25 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 2.62 2.43 0.00 8 L 7.90 3.39 0.00 1.27 1.31 -0.20 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.74 3.92 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 10 R 7.96 3.88 0.00 1.88 1.98 0.00 3.13 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 11 T 7.70 3.84 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 12 L 8.29 3.82 0.00 1.71 1.57 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.13 3.90 0.00 1.90 1.94 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.96 3.96 0.00 2.06 1.99 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.28 4.43 0.00 1.63 1.55 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.76 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 17 M 7.80 3.93 0.00 1.44 2.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.24 0.00 18 D 8.06 4.61 0.00 2.67 2.68 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 19 G 9.46 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 0.00 0.00 0.00 20 Y 8.40 4.22 0.00 3.36 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 21 R 9.01 3.60 0.00 1.91 1.85 0.00 3.37 0.00 0.00 3.04 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.47 0.00 22 G 8.10 3.82 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 0.00 0.00 0.00 23 I 7.66 4.00 1.71 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.55 -0.28 0.00 0.00 24 S 8.31 4.65 0.00 4.06 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 25 L 8.67 4.19 0.00 2.03 1.81 0.98 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 26 A 8.24 4.14 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.05 4.44 0.00 2.74 2.76 0.00 0.00 7.02 7.53 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 28 W 8.05 4.26 0.00 3.54 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 29 M 8.50 4.19 0.00 2.17 2.36 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.89 0.00 30 C 8.16 3.23 0.00 2.56 3.18 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 31 L 8.17 3.98 0.00 1.89 1.86 0.68 -0.26 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 32 A 8.36 4.24 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.12 2.82 0.00 1.60 1.61 0.00 0.63 0.00 0.00 1.09 0.00 0.00 2.65 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.00 0.32 7.81 34 W 7.70 4.31 0.00 3.44 3.26 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 35 E 8.57 4.37 0.00 2.02 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 2.58 2.44 0.00 36 S 7.80 4.52 0.00 4.07 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 37 G 8.19 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 0.00 0.00 0.00 38 Y 7.65 3.67 0.00 3.34 3.02 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 39 N 7.71 5.27 0.00 2.78 2.86 0.00 0.00 7.01 7.04 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 40 T 8.90 4.22 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 41 R 8.31 4.22 0.00 2.01 2.05 0.00 3.19 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 42 A 7.53 4.26 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 43 T 8.30 5.06 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 1.29 0.00 0.00 44 N 8.83 4.92 0.00 2.84 2.65 0.00 0.00 6.70 7.32 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 45 Y 8.74 4.73 0.00 3.00 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 46 N 8.63 4.82 0.00 2.59 2.59 0.00 0.00 6.66 8.62 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 47 A 8.38 3.78 1.34 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 0.00 0.00 48 G 8.09 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 49 D 7.54 4.73 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 50 R 7.82 3.69 0.00 2.24 2.22 0.00 3.02 0.00 0.00 3.19 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 51 S 7.37 4.97 0.00 3.86 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 52 T 8.93 5.06 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 0.64 0.00 0.00 53 D 9.15 5.34 0.00 2.65 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 54 Y 9.05 4.90 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 55 G 9.18 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 56 I 8.23 4.19 1.71 0.00 0.00 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 0.90 0.34 0.18 0.00 0.00 57 F 7.93 4.78 0.00 3.19 3.02 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 58 Q 7.83 3.55 0.00 2.51 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.77 0.00 0.00 0.00 0.00 0.00 2.52 2.68 0.00 59 I 8.23 4.49 2.15 0.00 0.00 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 1.46 1.12 1.11 0.00 0.00 60 N 9.15 5.24 0.00 3.11 3.08 0.00 0.00 6.97 7.63 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 61 S 9.19 4.57 0.00 4.08 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 0.00 62 R 8.86 3.80 0.00 1.53 1.43 0.00 2.57 0.00 0.00 2.80 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 63 Y 7.90 4.46 0.00 1.76 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 0.00 0.00 0.00 64 W 8.38 5.02 0.00 3.53 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 65 C 8.23 5.67 0.00 3.05 3.09 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 66 N 9.06 5.04 0.00 2.84 2.70 0.00 0.00 7.09 8.88 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 67 D 8.64 4.88 0.00 2.88 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 68 G 8.33 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 0.00 0.00 0.00 69 K 8.07 4.40 0.00 1.92 1.93 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.48 7.81 70 T 7.73 4.54 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 1.19 0.00 0.00 71 P 0.00 4.29 0.00 2.01 2.00 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.74 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 73 A 7.26 4.43 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 74 V 8.44 4.36 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.84 0.00 0.00 75 N 8.07 4.95 0.00 2.78 2.63 0.00 0.00 6.75 8.07 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 76 A 8.56 3.90 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 77 C 8.57 4.52 0.00 3.38 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 78 H 7.85 4.15 0.00 3.31 3.36 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.27 4.84 0.00 1.69 1.50 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.37 4.64 0.00 3.83 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 81 C 8.76 4.06 0.00 2.30 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 82 S 7.96 3.92 0.00 3.86 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 83 A 7.87 4.03 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.72 4.43 0.00 1.97 1.83 1.09 0.53 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 85 L 7.92 5.08 0.00 1.76 1.71 1.11 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.84 4.36 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.51 4.35 0.00 2.61 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 88 N 8.02 4.55 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.45 4.25 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.00 1.03 0.00 0.00 90 A 8.21 3.95 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 91 D 8.07 4.27 0.00 2.75 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 92 A 7.98 4.10 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 93 V 8.27 3.40 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 0.81 0.00 0.00 0.87 0.00 0.00 94 A 8.17 3.83 1.34 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 0.00 0.00 95 C 8.36 4.21 0.00 3.17 3.31 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 96 A 8.32 3.99 0.74 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 0.00 0.00 97 K 7.72 3.80 0.00 1.58 1.24 0.00 1.33 0.00 0.00 0.88 0.00 0.00 2.41 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.30 0.98 7.81 98 R 7.79 4.08 0.00 1.99 2.14 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.98 0.00 99 V 7.57 2.55 1.76 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 -0.30 0.00 0.00 -0.62 0.00 0.00 100 V 7.47 3.94 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 1.05 0.00 0.00 1.43 0.00 0.00 101 R 7.70 4.24 0.00 2.09 2.06 0.00 3.25 0.00 0.00 3.41 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.09 0.00 102 D 7.37 4.78 0.00 2.97 2.64 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 0.00 103 P 0.00 4.24 0.00 2.02 2.12 0.00 3.69 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 2.03 2.13 0.00 104 Q 8.19 4.02 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.86 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.75 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 0.00 0.00 0.00 106 I 7.73 3.55 0.97 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.12 -0.72 0.00 0.00 107 R 7.45 4.31 0.00 2.07 2.01 0.00 3.20 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.54 0.00 108 A 7.74 3.89 0.69 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 0.00 109 W 8.00 4.70 0.00 3.55 3.26 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 0.00 110 N 9.13 4.48 0.00 2.91 2.94 0.00 0.00 6.99 7.08 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 0.00 111 A 8.27 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.37 3.93 0.00 3.52 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 3.68 0.00 2.01 1.99 0.00 3.36 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.02 0.00 114 N 8.06 4.39 0.00 2.54 2.72 0.00 0.00 6.91 7.20 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 0.00 115 R 7.70 4.25 0.00 0.93 0.81 0.00 2.21 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.21 0.00 116 C 7.29 4.52 0.00 1.62 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 6.59 3.17 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 118 N 8.71 4.20 0.00 2.80 2.82 0.00 0.00 6.88 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 0.00 119 R 7.32 4.54 0.00 1.84 1.80 0.00 3.24 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 120 D 8.37 4.57 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 0.00 121 V 8.13 4.56 2.41 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 1.02 0.00 0.00 1.06 0.00 0.00 122 R 8.18 4.04 0.00 1.89 2.02 0.00 3.16 0.00 0.00 3.41 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 123 Q 8.15 4.01 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.91 0.00 0.00 0.00 0.00 0.00 2.11 1.53 0.00 124 Y 7.70 4.13 0.00 3.20 3.15 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 0.00 125 V 7.80 4.37 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 1.06 0.00 0.00 1.07 0.00 0.00 126 Q 7.44 4.23 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.54 2.45 0.00 127 G 8.99 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 0.00 0.00 0.00 0.00 128 C 7.90 4.37 0.00 3.10 3.14 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 0.00 0.00 0.00 0.00 129 G 8.20 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 0.00 0.00 0.00 130 V 7.86 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00