NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.6430 8.3301 115.5601 58.8116 65.1038 172.3387 3 A 4.5727 8.2185 117.8385 50.2372 23.1308 174.4920 4 F 5.4022 10.7344 127.1734 56.8983 41.6520 172.6993 5 I 4.7691 8.9517 128.6567 59.5791 39.5695 175.2330 6 T 5.0623 8.1367 117.0733 59.9085 72.0914 173.1180 7 F 5.1525 9.1944 121.4168 55.9022 41.8676 174.5099 8 E 5.1707 10.1151 122.4294 54.1182 33.9365 175.1310 9 G 4.1941 8.1970 111.6093 45.6890 0.0000 170.9378 10 P 5.2440 0.0000 0.0000 60.7325 33.2596 175.6276 11 E 4.1308 8.8017 117.6528 57.9605 29.8281 177.2026 12 G 3.9080 8.8893 109.7980 46.6188 0.0000 174.9021 13 S 4.3671 8.2018 112.5491 57.6275 63.8094 174.9335 14 G 3.8850 8.1533 109.6064 46.3417 0.0000 175.0320 15 K 3.8349 7.7374 120.9466 59.8356 32.1527 178.7690 16 T 3.8010 7.8953 115.0823 67.1178 68.4271 176.5001 17 T 3.8715 7.8330 116.9275 66.4945 68.4232 176.7742 18 V 3.5559 8.1106 120.4607 66.1228 31.5749 177.9570 19 I 3.1738 8.0603 118.7459 63.9397 37.6941 177.6240 20 N 4.4050 8.0122 117.0539 56.3532 38.4949 177.3432 21 E 4.0285 8.2396 120.1190 59.3301 29.5309 179.5679 22 V 3.7685 8.2046 118.7019 65.9652 31.1206 177.4144 23 Y 4.3176 8.3447 119.5687 61.2525 38.4982 177.4567 24 H 3.8445 8.0958 117.5426 59.5085 29.8544 176.9960 25 R 4.0147 7.9236 119.4062 58.9906 29.9223 178.8933 26 L 4.2608 8.3011 118.9692 57.5510 41.4477 179.4000 27 V 3.6658 7.6572 117.6537 65.9120 31.3378 177.9412 28 K 4.1486 7.5479 117.1908 58.3682 31.9486 177.2401 29 D 4.7439 8.0334 115.3666 53.8656 42.3961 174.9252 30 Y 4.8102 7.5328 115.2363 56.3650 42.1432 174.8524 31 D 4.9076 8.6284 122.2623 53.2405 40.5898 174.8235 32 V 5.3379 8.1696 122.0751 59.4218 35.0050 174.7179 33 I 5.1217 8.7669 114.6424 58.3839 41.5214 173.4725 34 M 4.9277 7.9532 121.1070 54.1233 35.1168 173.9955 35 T 4.7141 8.5630 117.9360 60.8706 72.1544 172.2795 36 R 4.8648 8.2835 124.4973 54.2822 33.3487 174.1409 37 E 3.9313 9.0921 125.9078 56.7169 30.1336 174.9985 38 P 4.4944 0.0000 0.0000 62.1686 31.5499 176.5414 39 G 3.7153 9.4062 105.9653 46.8856 0.0000 175.2909 40 G 3.9358 8.4226 105.8736 44.3079 0.0000 174.9577 41 V 3.6741 7.8138 120.2667 62.1088 32.0375 174.1695 42 P 4.2377 0.0000 0.0000 66.2890 31.3230 178.5471 43 T 4.0260 8.0048 107.8134 64.7330 68.6519 176.5233 44 G 3.6108 8.0171 108.1131 47.6377 0.0000 175.4752 45 E 4.0180 8.5237 121.3608 59.0879 29.2457 179.2353 46 E 3.9656 8.3339 118.1176 59.4981 29.8270 179.2195 47 I 3.7921 7.7656 119.7711 64.3742 37.1515 178.5010 48 R 3.5573 7.9433 119.5663 59.0952 29.8271 178.3344 49 K 3.8643 8.3272 119.8538 59.5679 31.8495 178.7667 50 I 3.6756 7.2823 118.9934 64.1553 37.1569 178.3198 51 V 3.6614 7.3272 118.5963 65.9778 31.3054 178.0076 52 L 4.0284 7.8509 117.3342 57.1436 41.4528 178.3239 53 E 4.5577 7.8126 116.2744 55.1375 30.0131 176.5924 54 G 3.6856 7.4942 109.0584 45.2958 0.0000 173.4171 55 N 4.6864 8.1314 118.8476 52.0201 40.3349 173.4689 56 D 4.3625 8.7555 127.0393 55.1740 39.7404 173.4264 57 M 4.1553 8.0163 116.4584 54.6455 33.3091 175.4657 58 D 4.3969 8.7315 124.4457 54.9156 42.8079 177.3651 59 I 4.1131 8.3334 126.9857 63.8063 38.0311 178.3434 60 R 3.9768 8.5086 119.2534 59.2398 29.8586 179.0818 61 T 3.8566 8.0618 115.2078 66.5718 68.4112 176.2180 62 E 3.9746 8.3463 120.2394 59.5224 29.5808 179.2908 63 A 4.1924 8.3018 120.7163 55.6874 18.4352 179.6627 64 M 4.0881 8.3475 117.2135 58.3743 31.8791 179.0835 65 L 3.9477 8.1154 119.3353 57.8292 41.7267 179.5527 66 F 4.1329 8.4743 117.6470 60.2937 38.7875 177.6665 67 A 4.0596 8.2912 120.5530 55.0131 18.1677 179.5752 68 A 3.9972 8.2511 119.4493 55.3336 18.4677 179.8113 69 S 4.0489 8.4149 112.0454 61.4222 62.4534 176.2490 70 R 3.9918 8.4668 121.8699 59.6214 29.8537 178.5244 71 R 3.9617 8.1843 118.4194 59.3552 29.9942 178.2430 72 E 3.9936 8.2515 118.5576 59.7587 29.5025 178.8421 73 H 4.1711 8.3445 118.2529 58.9780 29.9088 177.1691 74 L 3.8139 8.0317 122.1640 58.4118 41.8401 179.4692 75 V 3.8130 8.1135 111.1703 63.7074 31.5787 177.8425 76 L 4.3900 8.0007 117.2140 55.0052 41.9592 176.7199 77 K 4.2942 7.5454 117.1726 57.6351 34.4082 178.0146 78 V 3.4201 7.6914 117.7176 66.0037 31.3396 177.9641 79 I 3.5498 8.0309 119.7139 64.0093 36.8573 176.7249 80 P 4.1828 0.0000 0.0000 65.4855 31.2555 178.5421 81 A 4.1753 7.7008 119.4819 55.0902 18.2648 179.7247 82 L 3.9781 7.9383 117.6277 57.7964 41.4487 179.8299 83 K 4.0727 8.0817 117.6801 58.8682 32.0213 178.2576 84 E 4.3563 7.6086 116.9472 56.2796 29.5963 177.3909 85 G 3.9484 8.0007 107.6696 45.1770 0.0000 174.0105 86 K 4.5593 7.7521 118.8465 55.8379 34.0010 176.0430 87 V 4.3346 8.7705 123.1362 62.0634 33.2494 174.8068 88 V 4.8407 9.1455 128.1000 61.2072 34.0614 173.9546 89 L 5.2162 8.8293 128.7159 53.6999 43.6087 175.1885 90 C 5.2773 9.2968 124.2117 57.6322 34.6817 172.5020 91 D 4.8292 8.8216 126.8068 54.1817 40.2276 174.3806 92 R 4.7746 10.1323 125.7186 56.6795 31.6032 176.1457 93 Y 4.7083 9.0686 123.2166 55.7413 41.8544 176.3108 94 I 3.5556 7.9025 108.6077 64.4183 37.2366 177.9035 95 D 4.5130 8.2653 119.8393 57.1629 40.6300 178.7697 96 S 4.4620 8.3004 116.9176 61.2417 62.8520 176.7882 97 S 4.6539 7.9894 118.6751 61.0089 62.5345 176.6134 98 L 3.9890 8.1160 121.3309 57.8422 41.4006 179.5005 99 A 3.6154 8.0254 120.8757 55.1728 17.9642 179.2013 100 Y 3.7982 8.3481 115.5397 61.1989 38.1487 178.3149 101 Q 4.2192 8.3543 118.8851 58.8052 28.9916 178.9827 102 G 3.4735 7.9801 106.1487 48.6769 0.0000 174.5770 103 Y 4.1236 8.5350 120.7810 59.2312 37.7633 177.6961 104 A 3.8374 8.2506 124.5133 55.6057 18.7044 179.2716 105 R 4.2279 8.5467 112.3931 56.8946 30.3624 177.5816 106 G 3.9283 7.9354 105.6443 46.3757 0.0000 175.1946 107 I 3.7291 7.6798 123.2215 63.6781 37.4847 175.8114 108 G 4.2485 8.3195 107.7140 44.5770 0.0000 174.8288 109 V 3.3766 8.3872 126.0728 65.1046 31.2992 178.4776 110 E 3.9342 7.9575 119.0874 58.6936 29.3201 179.0416 111 E 3.9265 7.9979 118.1715 59.5950 29.6768 179.5181 112 V 3.6501 7.8886 118.1684 65.7331 31.4357 178.0210 113 R 3.9256 8.2844 118.7119 59.2908 29.9689 178.3611 114 A 4.1783 8.1549 120.6476 55.0151 18.3573 179.4066 115 L 3.9170 7.8961 118.8755 58.3640 42.2365 178.8231 116 N 4.2730 8.5822 116.8534 56.5242 38.5559 177.2104 117 E 3.9335 8.4948 120.0658 59.2837 29.3117 179.1737 118 F 3.9078 8.0593 119.4474 61.2859 39.5559 176.7906 119 A 4.2112 8.0488 119.5458 54.5857 18.4667 178.8343 120 I 3.9531 7.9393 110.1177 60.3388 39.1773 174.9179 121 N 3.9462 8.7884 118.9277 54.6072 37.2951 174.4450 122 G 4.0532 7.8818 104.3122 45.7286 0.0000 173.1251 123 L 4.3842 7.5836 122.4332 54.1036 40.5235 175.2563 124 Y 4.7202 8.1071 120.6116 55.3430 39.7341 174.0941 125 P 4.0454 0.0000 0.0000 62.7062 31.9463 176.7242 126 D 4.5754 8.7356 122.1019 56.8980 41.6815 176.7323 127 L 4.3683 7.1489 119.0237 53.7514 45.9402 174.4185 128 T 4.7621 8.4100 121.9414 61.6948 72.0444 172.8832 129 I 4.4888 8.3066 128.3698 60.4767 38.8256 174.1205 130 Y 5.0110 8.9184 129.2943 55.9501 40.5727 174.7846 131 L 4.1684 8.2840 128.7441 53.8628 41.4992 176.1841 132 N 4.1369 8.7288 124.1617 52.4432 38.5843 173.3109 133 V 4.8405 7.6347 124.2806 59.2784 34.0868 176.1517 134 S 4.3651 9.3565 117.8405 57.6572 64.1558 175.1087 135 A 4.0390 8.5763 123.1883 55.3994 18.0272 180.0509 136 E 3.9067 8.0644 116.5270 59.6477 29.6201 179.6095 137 V 3.6995 7.7727 118.0378 65.8200 31.5545 178.2086 138 G 3.8345 8.2715 105.5905 47.8792 0.0000 175.4962 139 R 3.8351 8.1440 121.2517 59.3726 30.0711 178.5299 140 E 3.9778 8.1555 118.2650 59.2837 29.3379 179.3711 141 R 3.8460 8.3443 119.1852 59.3690 29.9241 178.6602 142 I 3.7006 7.6921 118.6709 64.4840 37.1976 178.1738 143 I 3.8458 7.6682 119.4265 64.2038 36.9952 177.9109 144 K 4.0637 8.4451 119.8782 59.2149 31.9718 177.4323 145 N 4.7267 7.8634 114.5772 54.8854 39.8909 175.3061 *150 N 4.6778 8.2838 117.6504 53.5780 39.2996 172.7493 151 R 4.7505 8.2804 115.0575 54.6998 34.6137 173.6855 152 L 4.7490 8.0271 118.3213 52.8163 44.0892 177.0715 153 D 4.5024 8.3374 120.5306 54.2815 43.2945 177.2991 154 Q 3.9923 8.6311 125.3058 59.0787 29.1015 178.3656 155 E 3.9513 10.0858 121.1862 59.2991 29.7367 178.5042 156 D 4.4408 8.0736 118.4173 57.4306 40.9974 178.4147 157 L 4.0866 8.1175 119.4754 58.0394 41.6520 179.9147 158 K 4.0664 8.1422 118.2069 59.3474 31.9258 179.2811 159 F 4.1522 8.3592 121.1511 61.3066 39.3228 176.5963 160 H 4.1376 8.9326 118.3876 59.4940 29.6472 177.0802 161 E 3.8915 8.2223 120.2202 59.3248 29.1611 179.5735 162 K 3.8437 7.8573 118.5745 59.2023 32.0742 179.5454 163 V 2.9734 7.3472 118.5552 65.8381 31.3561 178.1630 164 I 3.7818 7.4184 119.4138 64.3733 36.8879 177.9800 165 E 3.9319 8.2683 120.3670 59.1157 29.3628 179.1850 166 G 2.4881 7.8597 105.9495 47.6229 0.0000 175.3393 167 Y 3.7733 7.5309 119.3368 60.5788 37.5351 178.6647 168 Q 3.8617 7.6565 118.1699 58.9251 28.8828 178.3206 169 E 3.9596 7.3895 118.7035 59.0910 29.7247 178.4581 170 I 3.7109 7.1964 119.0017 63.2721 37.6093 176.7024 171 I 3.4266 6.6722 119.3738 60.1685 37.8789 175.6708 *176 Q 4.3482 8.4901 124.4558 56.1326 30.8249 176.2128 177 R 3.9570 7.8503 117.8791 58.8351 31.1946 176.6979 178 F 5.0019 8.1059 116.2818 56.7434 40.4797 175.8123 179 K 4.5978 8.9220 120.9877 54.9816 35.5673 175.6925 180 S 5.1688 8.8545 121.3625 57.5547 64.5959 173.8649 181 V 4.3571 8.4915 122.9488 60.8211 34.9854 174.2129 182 N 4.6932 8.8001 125.7445 53.5880 39.1106 174.1416 183 A 4.4120 8.4937 127.5709 52.3460 18.5975 177.7659 184 D 4.4072 8.8242 117.7415 56.6172 41.2839 177.0794 185 Q 4.2699 7.3422 116.7489 54.4900 29.7191 174.6450 186 P 4.4556 0.0000 0.0000 62.4297 33.2161 177.5991 187 L 3.9914 8.5098 120.0660 58.0650 41.5088 179.3595 188 E 3.9224 8.2313 118.6455 59.6949 29.4148 178.6856 189 N 4.4201 8.0847 115.7643 56.1170 38.7183 177.4980 190 V 3.5768 7.6716 119.5712 65.7657 31.5474 178.2872 191 V 3.6141 8.1776 118.4049 65.9906 31.3828 177.4238 192 E 4.0074 8.1586 118.9933 59.6442 29.4900 178.5331 193 D 4.3988 8.4121 118.9327 57.7397 40.8910 179.0630 194 T 3.9109 8.1224 116.1909 66.6686 68.4207 176.1255 195 Y 4.1581 8.5360 121.8831 61.0435 38.8700 178.3157 196 Q 3.9036 8.5385 119.0519 59.1955 28.8320 178.9712 197 T 3.8891 7.9228 116.8706 66.6461 68.3736 176.8819 198 I 3.7317 7.8041 121.7551 64.2053 37.0655 178.5147 199 I 3.5069 7.6221 120.8559 64.1803 36.6913 178.2363 200 K 3.8434 7.8117 119.1686 59.6885 32.2544 177.8807 201 Y 4.0805 7.7621 119.1259 60.7794 38.5822 177.9601 202 L 3.9402 8.0907 118.7373 57.0510 41.7293 178.2998 203 E 4.4288 7.9811 116.1450 56.4339 29.7527 177.9736 204 K 4.0080 7.5205 121.5457 59.4448 32.6014 177.4422 *205 I 3.9720 7.5426 119.5539 60.0887 36.1822 177.3073 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 S 8.33 4.64 0.00 4.09 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 3 A 8.22 4.57 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 4 F 10.73 5.40 0.00 2.92 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 5 I 8.95 4.77 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.55 0.56 0.00 0.00 6 T 8.14 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 0.41 0.00 0.00 7 F 9.19 5.15 0.00 2.97 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 8 E 10.12 5.17 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.71 0.00 9 G 8.20 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 0.00 0.00 0.00 10 P 0.00 5.24 0.00 2.26 2.23 0.00 3.27 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 11 E 8.80 4.13 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 12 G 8.89 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 0.00 0.00 0.00 13 S 8.20 4.37 0.00 3.96 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 14 G 8.15 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 15 K 7.74 3.83 0.00 1.91 1.86 0.00 1.96 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.59 7.81 16 T 7.90 3.80 4.23 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 1.19 0.00 0.00 17 T 7.83 3.87 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 1.23 0.00 0.00 18 V 8.11 3.56 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 1.22 0.00 0.00 0.97 0.00 0.00 19 I 8.06 3.17 1.19 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.09 0.83 0.00 0.00 20 N 8.01 4.41 0.00 2.96 2.88 0.00 0.00 7.02 6.96 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 21 E 8.24 4.03 0.00 2.14 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 2.32 2.42 0.00 22 V 8.20 3.77 2.29 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 1.30 0.00 0.00 1.15 0.00 0.00 23 Y 8.34 4.32 0.00 3.02 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 24 H 8.10 3.84 0.00 3.20 3.47 0.00 6.00 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.92 4.01 0.00 2.07 1.63 0.00 2.96 0.00 0.00 2.84 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.83 0.00 26 L 8.30 4.26 0.00 2.02 1.92 1.09 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.66 3.67 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 0.74 0.00 0.00 0.41 0.00 0.00 28 K 7.55 4.15 0.00 1.84 1.83 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.55 7.81 29 D 8.03 4.74 0.00 2.47 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 0.00 0.00 0.00 0.00 30 Y 7.53 4.81 0.00 2.93 2.85 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 0.00 0.00 0.00 31 D 8.63 4.91 0.00 2.87 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 32 V 8.17 5.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.22 0.00 0.00 33 I 8.77 5.12 1.89 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 1.13 1.32 1.00 0.00 0.00 34 M 7.95 4.93 0.00 0.77 0.57 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 35 T 8.56 4.71 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 1.35 0.00 0.00 36 R 8.28 4.86 0.00 1.83 1.67 0.00 3.37 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 37 E 9.09 3.93 0.00 2.02 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 2.32 2.38 0.00 38 P 0.00 4.49 0.00 2.24 2.30 0.00 3.87 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 39 G 9.41 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.42 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 41 V 7.81 3.67 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 1.13 0.00 0.00 1.03 0.00 0.00 42 P 0.00 4.24 0.00 2.19 2.13 0.00 3.66 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 43 T 8.00 4.03 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 44 G 8.02 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 0.00 0.00 0.00 45 E 8.52 4.02 0.00 2.16 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 0.00 2.34 2.56 0.00 46 E 8.33 3.97 0.00 2.04 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 2.58 2.49 0.00 47 I 7.77 3.79 1.82 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 1.38 1.23 0.89 0.00 0.00 48 R 7.94 3.56 0.00 1.95 2.05 0.00 3.19 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 49 K 8.33 3.86 0.00 1.92 1.98 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.47 7.81 50 I 7.28 3.68 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.77 0.86 0.00 0.00 51 V 7.33 3.66 1.81 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 1.25 0.00 0.00 0.48 0.00 0.00 52 L 7.85 4.03 0.00 1.65 1.74 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 53 E 7.81 4.56 0.00 1.93 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 2.27 2.51 0.00 54 G 7.49 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 55 N 8.13 4.69 0.00 2.64 2.70 0.00 0.00 6.98 8.47 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 56 D 8.76 4.36 0.00 2.80 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.02 4.16 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 58 D 8.73 4.40 0.00 2.83 2.55 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 0.00 0.00 0.00 0.00 59 I 8.33 4.11 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.34 0.93 0.00 0.00 60 R 8.51 3.98 0.00 2.09 1.96 0.00 3.18 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 61 T 8.06 3.86 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 1.19 0.00 0.00 62 E 8.35 3.97 0.00 2.34 2.29 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 2.41 2.61 0.00 63 A 8.30 4.19 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 64 M 8.35 4.09 0.00 2.05 2.12 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 2.74 2.54 0.00 65 L 8.12 3.95 0.00 1.64 1.48 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 66 F 8.47 4.13 0.00 3.31 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 67 A 8.29 4.06 1.47 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 0.00 0.00 0.00 68 A 8.25 4.00 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 69 S 8.41 4.05 0.00 3.86 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 0.00 70 R 8.47 3.99 0.00 2.03 2.26 0.00 3.08 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 71 R 8.18 3.96 0.00 2.08 2.07 0.00 3.36 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 72 E 8.25 3.99 0.00 2.25 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 0.00 2.51 2.48 0.00 73 H 8.34 4.17 0.00 3.23 3.56 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.03 3.81 0.00 2.08 1.82 0.85 0.99 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 75 V 8.11 3.81 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 0.81 0.00 0.00 1.04 0.00 0.00 76 L 8.00 4.39 0.00 1.70 1.71 0.96 0.81 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 77 K 7.55 4.29 0.00 1.69 1.74 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.35 7.81 78 V 7.69 3.42 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 0.23 0.00 0.00 0.65 0.00 0.00 79 I 8.03 3.55 1.84 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 1.39 0.38 0.85 0.00 0.00 80 P 0.00 4.18 0.00 2.11 2.07 0.00 3.57 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.11 0.00 81 A 7.70 4.18 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 82 L 7.94 3.98 0.00 1.77 1.68 0.62 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.08 4.07 0.00 1.87 1.86 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.60 7.81 84 E 7.61 4.36 0.00 2.06 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 2.33 2.47 0.00 85 G 8.00 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 86 K 7.75 4.56 0.00 1.93 1.78 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.79 1.41 7.81 87 V 8.77 4.33 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 1.00 0.00 0.00 0.97 0.00 0.00 88 V 9.15 4.84 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 1.00 0.00 0.00 0.90 0.00 0.00 89 L 8.83 5.22 0.00 1.52 1.65 1.07 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 90 C 9.30 5.28 0.00 3.16 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.82 4.83 0.00 2.67 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 92 R 10.13 4.77 0.00 2.12 2.10 0.00 3.21 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 93 Y 9.07 4.71 0.00 2.88 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.90 3.56 1.74 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 1.58 0.70 0.19 0.00 0.00 95 D 8.27 4.51 0.00 3.26 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 96 S 8.30 4.46 0.00 4.18 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 0.00 97 S 7.99 4.65 0.00 4.08 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 98 L 8.12 3.99 0.00 1.90 1.85 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.03 3.62 0.24 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 0.00 0.00 0.00 100 Y 8.35 3.80 0.00 3.19 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 0.00 101 Q 8.35 4.22 0.00 2.42 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 102 G 7.98 3.47 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 0.00 0.00 0.00 0.00 103 Y 8.54 4.12 0.00 3.07 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 0.00 104 A 8.25 3.84 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 0.00 105 R 8.55 4.23 0.00 2.13 2.09 0.00 3.51 0.00 0.00 3.54 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.87 0.00 106 G 7.94 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 0.00 0.00 0.00 107 I 7.68 3.73 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 1.25 0.69 0.90 0.00 0.00 108 G 8.32 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 0.00 109 V 8.39 3.38 1.04 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 0.56 0.00 0.00 0.90 0.00 0.00 110 E 7.96 3.93 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 111 E 8.00 3.93 0.00 2.18 1.97 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 2.37 2.40 0.00 112 V 7.89 3.65 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 1.02 0.00 0.00 0.96 0.00 0.00 113 R 8.28 3.93 0.00 2.08 2.10 0.00 3.20 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 114 A 8.15 4.18 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 0.00 115 L 7.90 3.92 0.00 1.79 1.86 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 116 N 8.58 4.27 0.00 2.90 2.75 0.00 0.00 7.08 7.43 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 0.00 117 E 8.49 3.93 0.00 2.21 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 2.46 2.67 0.00 118 F 8.06 3.91 0.00 3.18 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 0.00 119 A 8.05 4.21 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 0.00 120 I 7.94 3.95 1.98 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.42 0.72 0.00 0.00 121 N 8.79 3.95 0.00 2.63 2.72 0.00 0.00 7.20 7.92 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 0.00 122 G 7.88 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 0.00 123 L 7.58 4.38 0.00 1.61 1.78 0.95 0.70 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 0.00 124 Y 8.11 4.72 0.00 3.03 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 0.00 125 P 0.00 4.05 0.00 1.71 1.32 0.00 3.79 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 1.94 1.61 0.00 126 D 8.74 4.58 0.00 2.56 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 0.00 127 L 7.15 4.37 0.00 0.60 0.77 0.62 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.41 4.76 3.47 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 1.30 0.00 0.00 129 I 8.31 4.49 1.13 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.31 0.79 0.00 0.00 130 Y 8.92 5.01 0.00 3.08 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 8.28 4.17 0.00 1.29 1.46 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 132 N 8.73 4.14 0.00 2.80 2.78 0.00 0.00 6.64 7.89 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 0.00 133 V 7.63 4.84 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 0.78 0.00 0.00 1.02 0.00 0.00 134 S 9.36 4.37 0.00 4.12 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 0.00 135 A 8.58 4.04 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 0.00 136 E 8.06 3.91 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 137 V 7.77 3.70 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 1.10 0.00 0.00 0.97 0.00 0.00 138 G 8.27 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 0.00 139 R 8.14 3.84 0.00 2.00 2.15 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 140 E 8.16 3.98 0.00 2.18 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 2.52 2.46 0.00 141 R 8.34 3.85 0.00 2.04 2.02 0.00 3.36 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 142 I 7.69 3.70 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.82 0.92 0.00 0.00 143 I 7.67 3.85 2.01 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 1.41 0.65 0.97 0.00 0.00 144 K 8.45 4.06 0.00 1.83 2.07 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 145 N 7.86 4.73 0.00 2.73 2.81 0.00 0.00 6.97 7.74 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 *150 N 8.28 4.68 0.00 2.69 2.67 0.00 0.00 6.94 7.65 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 0.00 151 R 8.28 4.75 0.00 1.77 1.77 0.00 3.23 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 152 L 8.03 4.75 0.00 1.62 1.57 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.34 4.50 0.00 2.71 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 0.00 154 Q 8.63 3.99 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 155 E 10.09 3.95 0.00 2.15 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 2.32 2.38 0.00 156 D 8.07 4.44 0.00 2.93 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 0.00 157 L 8.12 4.09 0.00 1.89 1.77 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 158 K 8.14 4.07 0.00 2.06 1.91 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.66 7.81 159 F 8.36 4.15 0.00 3.10 3.28 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 0.00 160 H 8.93 4.14 0.00 3.42 3.59 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 E 8.22 3.89 0.00 2.21 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 2.33 2.63 0.00 162 K 7.86 3.84 0.00 1.67 1.66 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.61 7.81 163 V 7.35 2.97 1.82 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 0.35 0.00 0.00 -0.16 0.00 0.00 164 I 7.42 3.78 1.91 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 1.37 0.75 0.90 0.00 0.00 165 E 8.27 3.93 0.00 2.08 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 2.24 2.26 0.00 166 G 7.86 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Y 7.53 3.77 0.00 2.99 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 0.00 0.00 0.00 168 Q 7.66 3.86 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.98 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 169 E 7.39 3.96 0.00 1.79 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 170 I 7.20 3.71 1.71 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.45 0.87 0.00 0.00 171 I 6.67 3.43 1.37 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 -0.30 -0.36 0.58 0.00 0.00 *176 Q 8.49 4.35 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.10 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 177 R 7.85 3.96 0.00 1.77 1.65 0.00 3.10 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.33 0.00 178 F 8.11 5.00 0.00 2.91 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 K 8.92 4.60 0.00 1.57 1.64 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.48 7.81 180 S 8.85 5.17 0.00 3.80 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 V 8.49 4.36 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.92 0.00 0.00 182 N 8.80 4.69 0.00 2.80 2.71 0.00 0.00 7.09 8.15 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 0.00 183 A 8.49 4.41 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 0.00 184 D 8.82 4.41 0.00 2.86 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 0.00 185 Q 7.34 4.27 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 186 P 0.00 4.46 0.00 2.29 1.97 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 187 L 8.51 3.99 0.00 1.68 1.73 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 188 E 8.23 3.92 0.00 2.03 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 2.38 2.42 0.00 189 N 8.08 4.42 0.00 2.99 2.98 0.00 0.00 6.73 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 V 7.67 3.58 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.99 0.00 0.00 191 V 8.18 3.61 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 1.06 0.00 0.00 1.08 0.00 0.00 192 E 8.16 4.01 0.00 2.16 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 0.00 2.35 2.48 0.00 193 D 8.41 4.40 0.00 3.02 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 0.00 194 T 8.12 3.91 4.51 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 1.38 0.00 0.00 195 Y 8.54 4.16 0.00 3.02 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 0.00 196 Q 8.54 3.90 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.83 2.63 0.00 197 T 7.92 3.89 4.36 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 1.16 0.00 0.00 198 I 7.80 3.73 1.89 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 1.38 0.79 0.80 0.00 0.00 199 I 7.62 3.51 1.66 0.00 0.00 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 0.69 0.12 0.91 0.00 0.00 200 K 7.81 3.84 0.00 1.82 2.02 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 201 Y 7.76 4.08 0.00 3.10 3.05 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 0.00 202 L 8.09 3.94 0.00 1.47 1.61 0.07 1.03 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 0.00 203 E 7.98 4.43 0.00 1.97 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 2.56 2.53 0.00 204 K 7.52 4.01 0.00 1.68 1.71 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.63 7.81 *205 I 7.54 3.97 1.87 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 1.27 0.49 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.