NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3101 8.2649 123.5829 52.4208 18.5713 176.5992 3 R 3.9967 8.1395 119.4878 58.7422 30.9837 177.1005 4 R 3.9572 8.3904 118.1892 58.2406 31.4263 181.9676 5 R 4.4089 8.1100 124.0724 56.5887 30.3403 177.5434 6 R 4.2576 8.4921 119.6406 59.5326 30.5202 177.3119 7 A 3.5752 8.1962 113.3911 52.3841 15.1335 176.7261 8 E 3.7775 8.5835 123.5214 57.5319 29.9624 177.7521 9 V 3.5486 8.3388 122.8280 62.7483 31.4954 175.5216 10 R 3.8597 8.4922 127.6804 56.9125 30.2628 175.7617 11 Q 4.4217 8.2789 124.6279 55.0069 30.5699 174.6429 12 L 4.6014 7.9464 118.7033 52.6721 45.1110 176.2663 13 Q 3.9909 8.8772 122.8300 55.5625 28.7136 174.3948 14 P 4.2342 0.0000 0.0000 61.9875 32.3624 175.7590 15 D 4.4388 8.2930 120.2350 54.9867 41.4755 176.6742 16 L 4.6852 8.6187 125.2725 54.8218 41.8291 177.3035 17 V 4.2586 9.2483 118.9744 63.1741 33.5218 175.6834 18 Y 4.4328 8.3012 113.5161 56.3151 40.0702 175.0379 19 G 4.3767 8.5277 107.0108 45.6080 0.0000 173.7212 20 D 4.6881 7.6186 116.6131 52.3788 44.6651 174.9534 21 V 3.6081 8.6570 120.3993 65.0103 32.3889 178.2299 22 L 3.8573 8.5034 120.5806 58.6337 42.1737 179.0107 23 V 3.1398 8.2880 117.5356 66.2417 31.0898 177.5083 24 T 3.7046 7.8141 108.2417 65.1874 68.5966 175.1646 25 A 3.8988 8.1281 123.4260 55.0963 18.0507 179.1287 26 F 4.2417 8.0891 117.5696 61.5924 39.6681 177.2062 27 I 3.2037 7.4655 119.5984 63.7531 36.7740 177.8065 28 N 4.0448 8.2562 117.3517 56.6543 38.3146 177.2443 29 K 3.6396 7.4436 117.6148 59.7874 32.2806 178.8077 30 I 3.9744 7.6933 117.5664 61.6517 37.1063 175.7386 31 M 4.1234 8.1430 121.8968 54.8855 32.0122 175.0237 32 R 4.4706 8.3462 126.4686 55.7262 32.0686 175.4619 33 D 4.6767 9.5196 122.3226 55.1628 38.3601 175.9299 34 G 3.9339 7.7046 108.1685 45.6962 0.0000 175.4157 35 K 4.1947 7.2168 120.5144 56.5741 30.1024 176.4874 36 K 4.0673 8.2689 125.6505 58.8226 32.2657 176.6630 37 N 4.1347 8.3442 116.7036 57.2425 38.6585 175.8925 38 L 3.9333 8.0286 120.4362 58.3199 41.9968 178.8847 39 A 3.8706 7.8126 119.8759 55.0254 18.4616 179.0530 40 A 3.8223 8.0795 118.0755 56.5369 18.5190 179.2439 41 R 3.7464 8.0234 113.1777 59.8926 29.5797 178.5614 42 I 3.8742 8.2333 120.4795 64.1809 37.3047 177.8925 43 F 4.1978 8.2322 121.1709 61.8679 38.9446 176.8335 44 Y 3.9892 7.4954 115.4884 60.7639 37.5346 177.4117 45 D 3.8843 8.2754 119.7100 57.2656 40.8498 178.9944 46 A 4.1217 7.6011 120.2152 55.1416 18.6244 179.3222 47 C 4.1370 7.4178 114.8384 62.8202 27.8917 176.3390 48 K 4.0001 8.7457 121.5926 59.3204 32.1218 178.6330 49 I 4.0200 8.2355 120.6965 63.8479 36.5320 177.3537 50 I 4.2524 7.3699 119.2022 60.5383 37.2672 176.6804 51 Q 4.2683 8.2319 120.2244 56.3277 28.6267 177.2782 52 E 3.8007 9.1889 125.1168 59.8281 30.3046 176.7948 53 K 3.7023 7.7627 117.5468 58.7804 32.4496 175.4543 54 T 4.4388 7.4433 113.8777 59.7972 68.5157 175.5501 55 G 3.9465 8.4840 118.8846 45.9720 0.0000 171.9479 56 Q 4.4157 8.0687 123.2594 55.3856 32.2186 174.4906 57 E 4.6164 8.4066 117.3414 53.8133 30.0529 174.6035 58 P 4.5423 0.0000 0.0000 65.8310 31.4160 177.6723 59 L 3.9594 8.2628 119.2758 57.1830 41.8820 178.5790 60 K 4.2525 9.3557 118.8035 58.7641 32.6108 178.5143 61 V 3.5750 7.8473 118.0244 67.1307 31.2395 176.7451 62 F 3.8653 8.7514 118.7146 61.1313 38.7229 176.3991 63 K 3.6433 8.0216 123.2177 59.4191 32.5843 178.2937 64 Q 4.0524 8.1112 119.6981 58.7570 28.8666 177.3345 65 A 3.8382 8.0166 123.1815 54.3604 18.0777 179.5975 66 V 3.1726 7.0897 115.3790 65.3149 31.3832 177.1612 67 E 4.1837 8.8916 120.2105 58.1050 29.4304 176.9283 68 N 4.7622 7.3412 113.6728 53.4659 38.6216 175.3559 69 V 4.3722 7.5271 115.7143 62.2121 32.5020 175.0280 70 K 4.3424 7.6361 118.4838 54.0884 31.7530 174.7897 71 P 4.5026 0.0000 0.0000 62.7817 32.1280 176.7690 72 R 4.2129 8.7671 122.1506 59.1772 31.1986 176.4057 73 M 5.3068 7.8273 115.6246 53.7909 36.2398 174.3478 74 E 4.8867 8.8570 118.7366 54.6895 33.6003 175.0792 75 V 4.5877 8.3730 113.8345 61.0730 33.0417 175.9516 76 R 4.6231 8.9058 123.8541 54.9899 33.8271 173.5245 77 S 4.9392 8.9750 121.5882 58.9658 63.1985 173.6223 78 R 4.3745 8.1786 128.1538 56.7507 33.1909 174.3206 79 R 4.2370 7.7773 112.6085 56.6790 32.9728 174.5264 80 V 3.9844 7.6765 122.2789 62.8257 34.0968 172.7283 81 G 3.6839 9.5801 110.8024 46.2849 0.0000 174.0610 82 G 3.7894 8.2952 104.2179 45.5852 0.0000 173.6792 83 A 4.6736 7.6888 121.0539 49.7717 22.1272 175.4471 84 N 4.7220 8.6787 118.2860 52.1303 40.9670 173.5634 85 Y 4.8671 7.5820 126.4395 57.2950 41.3644 175.0220 86 Q 4.9955 8.1838 113.4579 55.6292 30.4292 173.0921 87 V 4.0831 8.5559 121.8704 61.8917 33.0142 172.9879 88 P 5.2626 0.0000 0.0000 62.6794 32.8353 175.1465 89 M 4.5336 9.2608 117.3719 54.2554 34.7297 173.4352 90 E 4.1996 8.6842 119.3187 56.6434 30.5061 176.8972 91 V 4.0085 7.9225 123.0417 61.2271 32.8511 176.3278 92 S 4.0431 8.6045 120.8821 58.1344 62.9559 172.6947 93 P 4.2547 0.0000 0.0000 66.5218 30.4457 177.9917 94 R 3.8141 8.0452 118.2095 58.9731 29.7925 177.6038 95 R 3.8654 7.9804 118.6878 59.7611 29.9456 177.9114 96 Q 3.6150 8.8650 116.8362 59.2868 28.6033 179.3129 97 Q 3.7485 8.0025 118.4597 59.6993 28.9737 179.4188 98 S 4.2647 7.7746 113.1644 61.8213 62.9185 176.4153 99 L 3.3020 7.9163 123.2523 56.8872 41.1823 179.5051 100 A 3.8948 8.0899 120.4427 55.0347 18.2512 179.2341 101 L 3.9142 8.5153 118.4714 58.6904 41.8386 179.3563 102 R 3.8634 8.6530 118.5805 59.3209 29.7577 177.9978 103 W 4.6397 8.2362 117.9462 61.2184 29.3070 178.1035 104 L 3.8033 8.4637 116.3045 58.6929 40.9733 179.5294 105 V 3.7414 8.3772 117.8561 66.5244 31.4962 178.7182 106 Q 4.0296 7.9468 116.4444 58.9258 28.9111 178.3442 107 A 4.1448 8.8806 121.9178 55.0936 18.3686 179.0894 108 A 3.9950 8.3049 119.6154 55.7490 18.2759 179.3716 109 N 4.5466 8.3334 110.8931 55.0077 38.5830 176.2314 110 Q 4.4468 8.1470 120.1770 55.9533 30.5250 176.5028 111 R 4.0850 7.3835 118.4472 55.8525 30.5585 175.0138 112 P 4.4783 0.0000 0.0000 63.5721 31.9145 176.5319 113 E 4.0934 8.0055 118.7186 57.2186 30.0319 177.2138 114 R 4.1055 8.5094 119.9630 58.7557 30.6675 177.5185 115 R 4.3876 7.5856 114.8106 54.5960 33.0254 175.4569 116 A 3.8245 8.9943 124.2279 54.0450 17.2189 179.8317 117 A 3.7264 9.0045 122.4675 54.1458 19.3407 180.0437 118 V 3.5394 7.9943 110.5073 65.1095 31.5688 178.8920 119 R 3.9316 8.8411 118.3841 59.1071 29.9488 179.0407 120 I 4.0072 7.6960 118.6735 64.2895 36.8941 177.0802 121 A 4.2543 8.4495 123.4137 54.3744 18.1662 178.8014 122 H 4.0316 8.4336 112.9625 58.8338 29.1694 177.7867 123 E 4.0858 8.1153 120.3683 59.3401 29.3809 178.7272 124 L 4.0595 7.5675 118.1702 57.7845 42.2978 178.6155 125 M 4.2144 8.9978 120.1388 58.5594 32.1221 178.2533 126 D 5.1881 9.4297 120.4425 55.8742 41.1365 178.0116 127 A 4.2210 7.9668 120.7670 53.5572 18.9289 179.2312 128 A 4.0271 7.4435 118.8264 55.3723 18.7340 179.4559 129 E 4.1315 7.9787 116.7532 60.1417 29.5164 177.2966 130 G 3.1276 7.1884 108.3870 45.0333 0.0000 173.5399 131 K 4.4733 8.0597 118.4974 55.9437 33.1691 176.7393 132 G 3.7833 7.8057 109.1532 45.5168 0.0000 175.3825 133 G 3.5956 8.6380 107.6365 47.2340 0.0000 175.8998 134 A 4.0914 7.9495 122.1374 54.5291 18.3198 179.6417 135 V 3.3926 7.7981 117.1494 65.4468 31.5665 178.1332 136 K 3.7817 7.5633 118.6844 59.3438 31.8207 179.0081 137 K 3.3705 7.6685 117.9098 59.1366 31.6052 178.9090 138 K 3.8495 6.7482 117.5767 59.6662 32.5068 177.9810 139 E 4.0623 8.6373 119.0907 59.6359 29.4163 179.1664 140 D 4.2525 8.4822 117.9674 57.2367 41.0831 178.7144 141 V 3.9192 7.8444 113.6644 63.6563 31.3848 175.7477 142 E 4.5396 8.6229 117.5624 57.2462 32.3482 178.3100 143 R 3.9477 7.9534 117.6993 60.0924 30.0196 178.3579 144 M 4.0314 8.1478 117.6037 58.2577 31.7809 178.1451 145 A 4.1007 7.9677 122.2525 54.9022 18.8877 179.0436 146 E 4.1434 8.0815 117.0377 59.0385 29.6887 178.6249 147 A 4.0471 8.2090 119.6741 55.2201 18.6324 178.6930 148 N 4.8643 8.1111 113.5822 53.5659 38.7501 176.9082 149 R 4.0798 7.6360 118.3280 57.9145 30.2233 177.1865 150 A 4.0038 8.3083 121.8464 56.2722 18.9010 179.2367 151 Y 4.4179 8.0345 109.7242 58.3907 37.7006 177.6495 152 A 4.2967 7.9605 125.4290 54.8497 18.4599 179.4628 153 H 4.6796 8.2392 109.4687 56.8038 28.8597 175.3108 154 Y 5.1238 8.1019 117.9360 57.9161 38.0782 175.8298 155 R 4.4406 7.7211 117.5137 56.2681 30.0814 176.6934 156 W 4.8299 8.1539 114.2659 56.8719 28.1793 174.7539 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 2 A 8.26 4.31 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 3 R 8.14 4.00 0.00 1.89 1.96 0.00 3.21 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 4 R 8.39 3.96 0.00 1.80 1.78 0.00 3.22 0.00 0.00 3.22 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 5 R 8.11 4.41 0.00 1.80 1.86 0.00 3.18 0.00 0.00 3.15 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 6 R 8.49 4.26 0.00 1.71 1.82 0.00 3.27 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 7 A 8.20 3.58 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.58 3.78 0.00 1.94 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 2.32 2.39 0.00 9 V 8.34 3.55 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 0.74 0.00 0.00 0.92 0.00 0.00 10 R 8.49 3.86 0.00 1.80 1.83 0.00 3.27 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 11 Q 8.28 4.42 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.47 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 12 L 7.95 4.60 0.00 1.60 1.49 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.88 3.99 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 14 P 0.00 4.23 0.00 2.05 2.06 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 2.06 2.14 0.00 15 D 8.29 4.44 0.00 2.99 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 16 L 8.62 4.69 0.00 1.73 1.69 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.25 4.26 2.47 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 0.55 0.00 0.00 0.71 0.00 0.00 18 Y 8.30 4.43 0.00 3.15 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 19 G 8.53 4.38 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 0.00 20 D 7.62 4.69 0.00 2.72 2.53 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 21 V 8.66 3.61 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 0.89 0.00 0.00 0.96 0.00 0.00 22 L 8.50 3.86 0.00 1.85 2.01 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.29 3.14 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 0.62 0.00 0.00 0.78 0.00 0.00 24 T 7.81 3.70 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 1.30 0.00 0.00 25 A 8.13 3.90 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 26 F 8.09 4.24 0.00 3.16 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 27 I 7.47 3.20 1.81 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 -0.27 0.73 0.00 0.00 28 N 8.26 4.04 0.00 2.80 2.83 0.00 0.00 7.14 8.36 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 29 K 7.44 3.64 0.00 1.75 1.84 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.67 7.81 30 I 7.69 3.97 1.68 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 1.16 0.26 0.81 0.00 0.00 31 M 8.14 4.12 0.00 2.00 1.85 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 2.43 0.00 32 R 8.35 4.47 0.00 1.83 1.72 0.00 3.36 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 33 D 9.52 4.68 0.00 2.90 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 34 G 7.70 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 35 K 7.22 4.19 0.00 1.72 1.91 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.38 7.81 36 K 8.27 4.07 0.00 1.84 1.77 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.46 7.81 37 N 8.34 4.13 0.00 2.80 2.79 0.00 0.00 6.84 6.66 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 38 L 8.03 3.93 0.00 1.79 1.66 0.93 0.91 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 39 A 7.81 3.87 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 40 A 8.08 3.82 1.58 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 0.00 0.00 41 R 8.02 3.75 0.00 1.98 1.95 0.00 3.20 0.00 0.00 3.20 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 42 I 8.23 3.87 1.98 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 1.40 1.76 0.93 0.00 0.00 43 F 8.23 4.20 0.00 2.71 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 44 Y 7.50 3.99 0.00 3.30 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 45 D 8.28 3.88 0.00 2.86 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 46 A 7.60 4.12 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 47 C 7.42 4.14 0.00 3.12 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 48 K 8.75 4.00 0.00 1.78 2.03 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 49 I 8.24 4.02 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.08 0.96 0.00 0.00 50 I 7.37 4.25 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.13 0.98 0.00 0.00 51 Q 8.23 4.27 0.00 2.26 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 52 E 9.19 3.80 0.00 1.93 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 2.30 2.31 0.00 53 K 7.76 3.70 0.00 1.73 2.04 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.51 7.81 54 T 7.44 4.44 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 1.27 0.00 0.00 55 G 8.48 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 0.00 0.00 0.00 56 Q 8.07 4.42 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.90 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 57 E 8.41 4.62 0.00 2.09 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 2.32 2.34 0.00 58 P 0.00 4.54 0.00 2.22 2.35 0.00 3.78 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 59 L 8.26 3.96 0.00 2.22 1.92 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 K 9.36 4.25 0.00 2.03 1.86 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.49 7.81 61 V 7.85 3.58 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 1.17 0.00 0.00 0.97 0.00 0.00 62 F 8.75 3.87 0.00 3.17 2.99 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 63 K 8.02 3.64 0.00 1.98 2.13 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.54 7.81 64 Q 8.11 4.05 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 65 A 8.02 3.84 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 66 V 7.09 3.17 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 0.59 0.00 0.00 0.10 0.00 0.00 67 E 8.89 4.18 0.00 1.97 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 0.00 2.25 2.36 0.00 68 N 7.34 4.76 0.00 2.69 2.82 0.00 0.00 6.72 7.56 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 69 V 7.53 4.37 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 1.10 0.00 0.00 0.98 0.00 0.00 70 K 7.64 4.34 0.00 1.92 1.97 0.00 1.82 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.64 7.81 71 P 0.00 4.50 0.00 2.33 2.44 0.00 3.73 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 72 R 8.77 4.21 0.00 1.81 2.02 0.00 3.12 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 73 M 7.83 5.31 0.00 1.86 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 74 E 8.86 4.89 0.00 2.11 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 0.00 2.20 2.30 0.00 75 V 8.37 4.59 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 0.75 0.00 0.00 0.98 0.00 0.00 76 R 8.91 4.62 0.00 1.95 1.92 0.00 3.21 0.00 0.00 3.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 77 S 8.97 4.94 0.00 3.92 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 78 R 8.18 4.37 0.00 2.04 1.91 0.00 2.63 0.00 0.00 2.68 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.42 0.00 79 R 7.78 4.24 0.00 1.64 1.52 0.00 3.04 0.00 0.00 3.68 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.57 0.00 80 V 7.68 3.98 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.58 0.00 0.00 81 G 9.58 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 82 G 8.30 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 83 A 7.69 4.67 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 84 N 8.68 4.72 0.00 2.62 2.71 0.00 0.00 6.94 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 85 Y 7.58 4.87 0.00 2.84 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 86 Q 8.18 5.00 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.39 6.95 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 87 V 8.56 4.08 2.34 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 1.16 0.00 0.00 1.19 0.00 0.00 88 P 0.00 5.26 0.00 2.20 2.11 0.00 3.98 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 89 M 9.26 4.53 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 90 E 8.68 4.20 0.00 1.80 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 2.34 0.00 91 V 7.92 4.01 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 0.68 0.00 0.00 1.00 0.00 0.00 92 S 8.60 4.04 0.00 3.85 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 93 P 0.00 4.25 0.00 2.27 2.29 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 94 R 8.05 3.81 0.00 1.91 1.93 0.00 3.23 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 95 R 7.98 3.87 0.00 1.85 2.00 0.00 3.26 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 96 Q 8.87 3.61 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.42 0.00 0.00 0.00 0.00 0.00 2.49 2.69 0.00 97 Q 8.00 3.75 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 98 S 7.77 4.26 0.00 4.01 4.06 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 99 L 7.92 3.30 0.00 1.38 0.50 0.78 0.31 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 0.00 100 A 8.09 3.89 1.26 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 0.00 101 L 8.52 3.91 0.00 1.74 1.86 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.65 3.86 0.00 1.81 1.74 0.00 3.05 0.00 0.00 3.15 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 103 W 8.24 4.64 0.00 3.63 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 0.00 104 L 8.46 3.80 0.00 2.03 1.86 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.38 3.74 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 1.10 0.00 0.00 1.13 0.00 0.00 106 Q 7.95 4.03 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 107 A 8.88 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.30 3.99 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 N 8.33 4.55 0.00 2.86 2.90 0.00 0.00 7.06 7.30 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 0.00 110 Q 8.15 4.45 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.72 0.00 111 R 7.38 4.08 0.00 1.80 2.05 0.00 3.32 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 112 P 0.00 4.48 0.00 2.19 2.17 0.00 3.81 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 2.00 2.00 0.00 113 E 8.01 4.09 0.00 1.96 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 2.31 2.22 0.00 114 R 8.51 4.11 0.00 1.80 1.98 0.00 3.37 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 115 R 7.59 4.39 0.00 1.80 1.90 0.00 3.21 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 116 A 8.99 3.82 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 0.00 117 A 9.00 3.73 1.44 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 0.00 0.00 0.00 118 V 7.99 3.54 2.01 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 1.00 0.00 0.00 0.99 0.00 0.00 119 R 8.84 3.93 0.00 1.86 2.13 0.00 3.36 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.99 0.00 120 I 7.70 4.01 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.44 1.38 0.00 0.00 121 A 8.45 4.25 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 0.00 122 H 8.43 4.03 0.00 3.14 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.12 4.09 0.00 2.22 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 2.51 2.42 0.00 124 L 7.57 4.06 0.00 2.13 1.81 1.13 1.33 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 0.00 125 M 9.00 4.21 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.60 0.00 126 D 9.43 5.19 0.00 2.64 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 0.00 127 A 7.97 4.22 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 0.00 128 A 7.44 4.03 1.44 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 0.00 0.00 0.00 129 E 7.98 4.13 0.00 2.02 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 0.00 2.40 2.37 0.00 130 G 7.19 3.13 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 0.00 0.00 0.00 0.00 131 K 8.06 4.47 0.00 1.82 1.87 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.34 7.81 132 G 7.81 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 0.00 133 G 8.64 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.95 4.09 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 0.00 135 V 7.80 3.39 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 1.10 0.00 0.00 0.96 0.00 0.00 136 K 7.56 3.78 0.00 1.94 1.74 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.59 7.81 137 K 7.67 3.37 0.00 1.18 0.74 0.00 1.37 0.00 0.00 0.82 0.00 0.00 2.20 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 0.92 7.81 138 K 6.75 3.85 0.00 1.89 2.02 0.00 2.00 0.00 0.00 1.73 0.00 0.00 3.41 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.69 1.67 7.81 139 E 8.64 4.06 0.00 2.15 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 0.00 2.31 2.43 0.00 140 D 8.48 4.25 0.00 2.71 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 0.00 141 V 7.84 3.92 2.28 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 1.10 0.00 0.00 0.91 0.00 0.00 142 E 8.62 4.54 0.00 2.20 1.91 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 2.24 2.41 0.00 143 R 7.95 3.95 0.00 1.97 1.98 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 144 M 8.15 4.03 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.78 0.00 145 A 7.97 4.10 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 0.00 146 E 8.08 4.14 0.00 2.34 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 0.00 2.31 2.46 0.00 147 A 8.21 4.05 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 0.00 148 N 8.11 4.86 0.00 2.87 2.94 0.00 0.00 6.71 7.13 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 0.00 149 R 7.64 4.08 0.00 1.92 1.97 0.00 3.42 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 150 A 8.31 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.03 4.42 0.00 3.05 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 0.00 152 A 7.96 4.30 1.39 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 0.00 153 H 8.24 4.68 0.00 3.29 3.37 0.00 5.49 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 0.00 154 Y 8.10 5.12 0.00 3.23 2.99 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 0.00 155 R 7.72 4.44 0.00 1.92 2.22 0.00 3.30 0.00 0.00 3.44 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 156 W 8.15 4.83 0.00 3.53 2.96 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