NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4105 8.2649 122.4680 52.2571 18.6613 176.1671 2 M 4.2151 8.4391 122.6505 53.9845 34.0018 175.3644 3 K 5.3499 8.9464 122.1837 55.0040 37.6418 174.5031 4 A 5.2691 9.0685 123.3205 51.2219 23.5849 175.0908 5 V 5.0862 8.6476 116.8294 61.2554 35.4442 173.2096 6 C 4.9791 9.1841 122.2774 58.2883 35.3139 172.5801 7 V 4.7091 8.5655 126.4398 61.4049 33.1199 174.0781 8 L 4.7770 9.2607 129.8814 53.7939 43.1163 176.2603 9 K 4.8619 9.2892 122.6817 55.3676 36.9432 176.2598 10 G 3.8977 7.9701 108.2005 46.0927 0.0000 172.4568 11 D 4.6181 8.8350 118.5168 55.3018 42.1863 177.3519 12 G 4.3022 7.6222 109.1517 44.7022 0.0000 172.3689 13 P 4.3671 0.0000 0.0000 64.3752 32.1158 176.7552 14 V 4.6720 7.8702 120.0821 62.4179 31.9196 175.0500 15 Q 4.8035 8.3125 124.6767 55.2154 32.4267 173.3889 16 G 4.2756 8.2309 106.0355 46.4254 0.0000 172.1538 17 T 5.2225 8.1593 115.9505 61.5689 71.9956 173.5034 18 I 4.8562 9.0052 126.8335 59.8042 40.4906 174.0974 19 H 5.3868 9.3919 124.4401 54.1989 31.1951 173.8384 20 F 5.3932 9.2465 121.1831 55.7960 42.3192 174.1961 21 E 5.1638 9.0415 122.8288 54.8644 33.5540 173.5742 22 Q 4.8671 9.0458 127.4310 54.3483 31.7278 176.0728 23 K 3.9655 9.0852 126.1303 59.3930 32.5680 176.4559 24 A 4.5460 7.7797 118.9136 50.9471 21.9886 176.7802 25 S 4.0588 8.6740 115.7810 61.4498 62.7928 176.4177 26 G 4.0320 7.8086 104.6041 44.8867 0.0000 172.5035 27 E 4.1956 8.1051 121.0216 54.8840 30.2911 174.5549 28 P 4.6578 0.0000 0.0000 62.6828 32.5153 175.8827 29 V 4.4872 8.7427 122.4140 61.4551 33.7682 174.5582 30 V 4.6433 8.8726 128.7848 61.6243 33.0899 174.4879 31 L 5.1060 9.1234 128.6963 53.5678 44.0005 175.7733 32 S 5.4146 8.4275 115.5141 56.6390 67.2980 174.6763 33 G 3.7709 7.4381 106.2648 45.0476 0.0000 171.1135 34 Q 4.9651 8.0910 120.0226 54.7259 33.0670 174.6072 35 I 5.0515 8.6976 126.4451 59.6803 40.6792 174.7086 36 T 4.8517 9.2208 116.0152 60.5528 72.2260 175.0087 37 G 3.9965 9.0007 109.1820 45.3004 0.0000 173.8250 38 L 4.2497 7.6684 120.1984 53.9928 42.5071 176.5365 39 T 4.3735 8.1158 111.1099 60.7884 69.7647 174.2500 40 E 4.0968 8.5979 124.3821 57.9758 30.2281 175.3423 41 G 3.7193 8.7019 110.1268 43.9849 0.0000 172.4751 42 Q 4.7972 8.2959 117.3316 56.0295 29.8913 175.8191 43 H 5.0298 9.2795 119.5423 53.5766 33.0385 173.2472 44 G 4.1540 9.0369 110.5528 47.2037 0.0000 172.4265 45 F 5.4618 9.0659 125.2381 56.9224 42.0674 172.8187 46 H 5.3115 8.7962 122.7045 53.7056 33.4543 172.9768 47 V 4.4017 8.3348 121.2123 62.5766 32.0557 175.3589 48 H 5.0379 9.4243 125.8245 54.6343 30.5652 176.3350 49 Q 3.7843 9.0512 122.0400 58.7776 28.9139 175.9303 50 Y 4.8890 8.3367 116.7385 55.3626 40.8114 176.9639 51 G 4.1233 8.3519 112.2678 44.3705 0.0000 173.9971 52 D 4.8036 7.9214 117.6348 52.5464 42.8408 174.5491 53 N 5.2975 8.8012 125.1312 52.6589 39.4366 175.5247 54 T 4.0619 8.2508 109.4461 63.1800 69.2419 174.2095 55 Q 4.6100 8.5051 124.3634 55.3992 30.2766 175.6295 56 G 3.9954 7.7979 109.8956 47.2897 0.0000 176.7940 57 C 4.3166 8.5125 120.2077 61.4246 28.7080 175.7262 58 T 3.9625 7.7337 117.6864 66.3208 67.7316 175.7945 59 S 4.5350 7.8342 112.1725 59.0029 63.5677 175.2838 60 A 4.4338 7.3788 126.9372 54.5210 18.3578 178.9366 61 G 3.7460 8.0393 105.0537 44.8500 0.0000 170.8279 62 P 4.7805 0.0000 0.0000 61.3462 33.9200 175.1246 63 H 4.4564 8.5331 117.6009 55.9827 29.5995 175.5612 64 F 4.2544 9.1628 125.4749 58.4638 40.2556 174.6302 65 N 4.8643 8.0232 125.3602 51.1102 38.7772 172.6121 66 P 4.0627 0.0000 0.0000 65.3510 32.0299 177.5040 67 H 4.6931 7.7440 112.1034 54.6908 29.2206 175.0885 68 S 3.6105 7.3784 113.8258 59.6893 60.5898 170.9569 69 K 4.5696 8.1413 118.9047 55.0459 34.5301 176.3375 70 K 4.6755 8.5061 118.3309 55.1022 35.0526 175.8701 71 H 4.0775 9.0106 122.7796 56.7961 30.9686 174.6594 72 G 4.2121 8.2880 111.3224 44.7715 0.0000 172.1455 73 G 4.0830 8.8474 108.9473 43.6137 0.0000 173.1723 74 P 4.3309 0.0000 0.0000 64.4515 31.2886 177.4771 75 A 4.4863 7.8912 117.9543 51.9957 19.0194 176.2399 76 D 4.9047 7.6247 116.9440 53.2423 42.7340 177.0299 77 E 3.9719 8.6929 121.5239 59.6110 29.3437 177.8916 78 E 4.2414 7.9690 122.4644 55.8650 28.4117 175.6470 79 R 4.7540 7.6332 117.7645 55.0000 32.5638 175.1399 80 H 4.4567 8.5709 116.5576 55.4311 29.5350 176.8340 81 V 3.4712 8.1067 121.5070 65.9826 31.5155 177.2054 82 G 3.9431 8.0514 106.4364 46.0301 0.0000 173.4616 83 D 5.0787 7.8411 121.4026 54.0356 38.7069 176.4734 84 L 4.6195 8.2395 119.9359 54.2292 43.7294 177.8986 85 G 4.1444 8.0200 109.9743 45.6691 0.0000 175.7590 86 N 5.6681 8.7713 118.3786 51.1657 42.1076 172.5005 87 V 4.4911 8.5496 113.6725 59.8493 35.7475 174.6790 88 T 5.0134 8.2679 118.3436 61.8325 71.4978 172.8187 89 A 4.7398 8.9760 128.8100 50.5380 21.4484 177.6659 90 G 4.0225 8.6301 111.2565 44.2448 0.0000 174.4961 91 K 4.1429 8.6667 117.5985 59.4623 32.2581 178.4761 92 D 4.4093 8.1465 118.1387 56.5996 40.9212 178.3998 93 G 4.2590 8.8440 106.3451 43.9885 0.0000 172.2808 94 V 4.6628 7.4358 119.9272 61.2570 33.7578 174.2630 95 A 5.1221 8.9393 129.6682 49.2132 21.1414 174.9255 96 N 4.8499 8.6912 120.2331 53.6940 39.6297 175.1615 97 V 4.0879 8.7527 124.9647 61.5951 33.6379 175.0323 98 S 4.7941 8.2860 122.0969 57.6678 64.8610 173.1606 99 I 4.7395 8.7067 127.8157 59.7518 41.9132 173.6911 100 E 5.1366 8.8680 126.5389 54.4462 31.9990 174.3096 101 D 4.9739 9.1685 126.0816 52.8087 44.2183 176.3116 102 R 4.2324 8.8822 123.1799 57.2406 31.1591 177.7280 103 V 3.9910 8.5658 117.8431 64.7121 32.0364 176.6258 104 I 4.1337 7.7447 111.1562 60.8595 38.4101 174.7094 105 S 4.6868 8.5743 114.7260 57.1083 65.4317 174.3256 106 L 4.6522 8.7283 124.0745 54.7669 41.7964 177.5503 107 S 4.5802 7.8174 110.8701 59.1880 66.7754 176.4464 108 G 4.0286 7.8256 112.9356 45.4328 0.0000 173.9333 109 E 4.3861 8.8042 120.8415 57.5560 30.4161 176.2441 110 H 5.1508 7.9513 116.1211 55.5382 29.2975 174.1988 111 S 4.6653 8.2165 115.3160 58.4097 62.6549 173.7259 112 I 3.9081 8.4467 120.6916 60.6547 38.2169 175.7296 113 I 3.7159 6.8278 122.4121 62.9936 37.3539 176.4189 114 G 3.8206 9.4972 113.7896 45.1904 0.0000 172.7263 115 R 4.9364 7.5452 119.0652 54.6932 33.7039 174.4760 116 T 5.0541 7.8893 114.8321 62.4524 71.4171 173.7666 117 M 4.7458 8.5776 125.8820 54.3304 33.8343 175.6557 118 V 5.0354 8.7079 116.9228 59.4105 35.8554 174.8444 119 V 4.9899 8.4790 123.7906 60.6564 33.6002 174.8231 120 H 5.2876 9.0891 121.2176 54.0534 30.9003 174.5943 121 E 4.2024 9.1980 121.6272 58.9395 30.0509 176.5637 122 K 4.6979 8.6302 117.5955 53.8958 36.2850 175.1911 123 Q 4.4373 8.4270 122.5216 56.1338 29.6931 174.8264 124 D 4.7963 9.2108 127.4098 53.9712 41.7894 175.4495 125 D 4.6721 9.3873 125.3645 52.7493 39.5781 176.6766 126 L 3.6591 9.8343 118.8510 56.1830 39.7019 175.4894 127 G 3.9742 8.7084 103.5977 47.1809 0.0000 174.7412 128 K 4.6206 8.0417 117.2057 55.8341 33.1710 177.5364 129 G 3.8721 8.2888 108.1480 44.7554 0.0000 176.5827 130 G 3.9899 8.3111 107.4918 45.4081 0.0000 172.2964 131 N 5.0482 7.2606 114.9037 50.3730 40.1316 174.1393 132 E 4.1021 8.5214 117.5362 58.9749 30.2029 178.3949 133 E 4.0376 8.3144 118.4679 59.3070 29.4192 178.7323 134 S 4.0885 8.4558 113.4320 61.7575 62.4875 176.1505 135 T 4.1438 7.6818 109.4408 63.1673 68.3876 175.6999 136 K 4.2148 7.7113 119.9292 57.8742 33.3952 176.9394 137 T 4.0260 7.9198 106.6232 60.1716 70.2144 175.2540 138 G 3.7997 8.1087 110.2651 45.8788 0.0000 173.7450 139 N 4.3091 7.8775 114.5448 53.9793 36.7344 176.0212 140 A 3.8903 7.5829 120.3829 53.0937 19.1125 179.7596 141 G 3.6915 7.3770 103.2755 44.2558 0.0000 173.1631 142 S 4.4417 8.6198 114.5088 58.5257 64.8702 173.7810 143 R 4.4909 8.3412 119.3805 55.0982 29.8907 176.5439 144 L 4.3556 8.8488 125.5242 57.2466 43.0964 177.0779 145 A 4.8326 7.7382 117.8885 51.3650 22.8617 174.7240 146 C 5.4061 8.4354 113.8583 58.6937 33.8554 172.7409 147 G 4.5614 8.0839 103.1887 46.0641 0.0000 172.7477 148 V 4.3679 8.3363 122.2904 62.2695 32.7843 175.5995 149 I 4.0557 9.3386 130.3085 61.1505 37.9776 175.2884 150 G 4.4182 8.7229 114.1704 43.7224 0.0000 171.9615 151 I 4.2396 8.4388 121.9386 61.6161 37.4742 175.4311 152 A 4.9154 8.5138 128.4009 49.8640 22.1773 176.3742 153 Q 4.1346 8.4823 115.7440 56.4520 29.0794 175.8970 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.41 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 2 M 8.44 4.22 0.00 2.01 2.01 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 2.63 2.59 0.00 3 K 8.95 5.35 0.00 1.69 1.70 0.00 1.66 0.00 0.00 1.98 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.46 7.81 4 A 9.07 5.27 1.07 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 0.00 0.00 5 V 8.65 5.09 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 0.74 0.00 0.00 0.92 0.00 0.00 6 C 9.18 4.98 0.00 3.27 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 7 V 8.57 4.71 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 0.96 0.00 0.00 0.94 0.00 0.00 8 L 9.26 4.78 0.00 1.72 1.61 1.06 0.19 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 9 K 9.29 4.86 0.00 1.62 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.38 7.81 10 G 7.97 3.90 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 0.00 0.00 0.00 11 D 8.83 4.62 0.00 2.68 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 12 G 7.62 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.37 0.00 2.17 2.18 0.00 3.51 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 14 V 7.87 4.67 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.91 0.00 0.00 15 Q 8.31 4.80 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 16 G 8.23 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.16 5.22 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 1.14 0.00 0.00 18 I 9.01 4.86 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.47 0.50 0.00 0.00 19 H 9.39 5.39 0.00 3.05 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 9.25 5.39 0.00 2.95 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 21 E 9.04 5.16 0.00 2.08 1.77 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 2.23 2.29 0.00 22 Q 9.05 4.87 0.00 2.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 23 K 9.09 3.97 0.00 1.80 1.87 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81 24 A 7.78 4.55 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 25 S 8.67 4.06 0.00 3.87 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 26 G 7.81 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 27 E 8.11 4.20 0.00 2.07 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 2.34 2.34 0.00 28 P 0.00 4.66 0.00 2.03 2.00 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 29 V 8.74 4.49 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1.05 0.00 0.00 30 V 8.87 4.64 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 0.90 0.00 0.00 0.95 0.00 0.00 31 L 9.12 5.11 0.00 1.47 1.25 1.04 0.63 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 32 S 8.43 5.41 0.00 3.81 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 33 G 7.44 3.77 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 0.00 0.00 0.00 34 Q 8.09 4.97 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 35 I 8.70 5.05 1.78 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 1.27 0.43 0.88 0.00 0.00 36 T 9.22 4.85 4.22 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 0.00 0.00 0.00 1.19 0.00 0.00 37 G 9.00 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 38 L 7.67 4.25 0.00 1.85 1.44 0.80 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.12 4.37 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 40 E 8.60 4.10 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 41 G 8.70 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 42 Q 8.30 4.80 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 43 H 9.28 5.03 0.00 3.00 3.34 0.00 5.64 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 44 G 9.04 4.15 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 0.00 0.00 0.00 45 F 9.07 5.46 0.00 2.99 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 46 H 8.80 5.31 0.00 3.03 2.92 0.00 5.85 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.33 4.40 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.91 0.00 0.00 48 H 9.42 5.04 0.00 3.05 3.45 0.00 5.67 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 9.05 3.78 0.00 1.90 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.62 0.00 0.00 0.00 0.00 0.00 1.63 2.27 0.00 50 Y 8.34 4.89 0.00 3.17 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 51 G 8.35 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 0.00 0.00 0.00 52 D 7.92 4.80 0.00 2.61 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 53 N 8.80 5.30 0.00 2.68 2.73 0.00 0.00 7.38 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 54 T 8.25 4.06 4.22 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 0.00 0.00 0.00 1.21 0.00 0.00 55 Q 8.51 4.61 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.73 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 56 G 7.80 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 57 C 8.51 4.32 0.00 2.98 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 58 T 7.73 3.96 4.46 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 1.25 0.00 0.00 59 S 7.83 4.53 0.00 4.16 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 60 A 7.38 4.43 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 61 G 8.04 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.78 0.00 2.02 1.96 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 63 H 8.53 4.46 0.00 2.88 3.17 0.00 5.73 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 64 F 9.16 4.25 0.00 2.93 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 65 N 8.02 4.86 0.00 2.65 2.43 0.00 0.00 7.16 7.71 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 66 P 0.00 4.06 0.00 1.51 1.88 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.91 0.00 67 H 7.74 4.69 0.00 3.09 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.38 3.61 0.00 3.97 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.14 4.57 0.00 1.85 1.90 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.51 7.81 70 K 8.51 4.68 0.00 1.72 1.67 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.45 7.81 71 H 9.01 4.08 0.00 3.25 3.24 0.00 5.77 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 72 G 8.29 4.21 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 0.00 73 G 8.85 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.33 0.00 2.07 2.18 0.00 3.73 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.25 0.00 75 A 7.89 4.49 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 76 D 7.62 4.90 0.00 2.79 2.57 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 0.00 0.00 0.00 0.00 77 E 8.69 3.97 0.00 1.94 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 2.26 0.00 78 E 7.97 4.24 0.00 1.97 1.88 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 2.37 2.22 0.00 79 R 7.63 4.75 0.00 1.92 1.78 0.00 2.80 0.00 0.00 2.66 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 80 H 8.57 4.46 0.00 3.48 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.11 3.47 1.56 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 0.78 0.00 0.00 0.38 0.00 0.00 82 G 8.05 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 83 D 7.84 5.08 0.00 2.85 2.75 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 0.00 0.00 0.00 84 L 8.24 4.62 0.00 1.73 1.84 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.02 4.14 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 0.00 0.00 0.00 86 N 8.77 5.67 0.00 2.59 2.70 0.00 0.00 6.56 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 87 V 8.55 4.49 1.79 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 -0.01 0.00 0.00 0.76 0.00 0.00 88 T 8.27 5.01 4.21 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 1.20 0.00 0.00 89 A 8.98 4.74 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 90 G 8.63 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 0.00 0.00 0.00 91 K 8.67 4.14 0.00 1.75 1.89 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.63 7.81 92 D 8.15 4.41 0.00 2.65 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 93 G 8.84 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.44 4.66 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 0.93 0.00 0.00 0.91 0.00 0.00 95 A 8.94 5.12 1.13 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 96 N 8.69 4.85 0.00 2.58 2.73 0.00 0.00 7.04 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 97 V 8.75 4.09 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 0.62 0.00 0.00 0.65 0.00 0.00 98 S 8.29 4.79 0.00 3.83 3.66 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 0.00 0.00 0.00 0.00 99 I 8.71 4.74 1.94 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.44 0.99 0.00 0.00 100 E 8.87 5.14 0.00 1.94 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 0.00 2.19 2.29 0.00 101 D 9.17 4.97 0.00 2.84 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.88 4.23 0.00 1.86 1.98 0.00 3.43 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 103 V 8.57 3.99 2.23 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 0.80 0.00 0.00 0.95 0.00 0.00 104 I 7.74 4.13 1.95 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.80 1.02 0.00 0.00 105 S 8.57 4.69 0.00 3.91 3.76 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 0.00 106 L 8.73 4.65 0.00 1.80 1.65 0.99 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.82 4.58 0.00 3.91 3.90 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 0.00 108 G 7.83 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 0.00 109 E 8.80 4.39 0.00 2.00 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 0.00 2.32 2.35 0.00 110 H 7.95 5.15 0.00 3.24 3.44 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.22 4.67 0.00 4.00 3.76 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 0.00 112 I 8.45 3.91 1.68 0.00 0.00 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 1.47 0.30 0.92 0.00 0.00 113 I 6.83 3.72 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.80 0.88 0.00 0.00 114 G 9.50 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 0.00 115 R 7.55 4.94 0.00 1.69 1.86 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.26 0.00 116 T 7.89 5.05 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 1.25 0.00 0.00 117 M 8.58 4.75 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.76 0.00 118 V 8.71 5.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.74 0.00 0.00 119 V 8.48 4.99 2.33 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 0.89 0.00 0.00 1.04 0.00 0.00 120 H 9.09 5.29 0.00 3.20 3.57 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.20 4.20 0.00 2.03 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 2.36 2.34 0.00 122 K 8.63 4.70 0.00 1.71 1.68 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.36 7.81 123 Q 8.43 4.44 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 124 D 9.21 4.80 0.00 2.84 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 0.00 125 D 9.39 4.67 0.00 2.93 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 0.00 126 L 9.83 3.66 0.00 1.84 1.83 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.71 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 0.00 0.00 0.00 128 K 8.04 4.62 0.00 1.76 1.78 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.50 7.81 129 G 8.29 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.31 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 0.00 131 N 7.26 5.05 0.00 2.86 2.82 0.00 0.00 6.85 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 0.00 132 E 8.52 4.10 0.00 2.02 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 2.32 0.00 133 E 8.31 4.04 0.00 2.01 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 0.00 2.39 2.31 0.00 134 S 8.46 4.09 0.00 4.01 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 0.00 135 T 7.68 4.14 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 1.27 0.00 0.00 136 K 7.71 4.21 0.00 1.80 1.80 0.00 1.56 0.00 0.00 1.89 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.51 7.81 137 T 7.92 4.03 4.14 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 1.14 0.00 0.00 138 G 8.11 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 0.00 139 N 7.88 4.31 0.00 2.98 2.90 0.00 0.00 6.92 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 0.00 140 A 7.58 3.89 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 0.00 141 G 7.38 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 0.00 142 S 8.62 4.44 0.00 3.95 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 0.00 143 R 8.34 4.49 0.00 1.69 1.85 0.00 3.18 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 144 L 8.85 4.36 0.00 1.63 1.70 0.98 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.74 4.83 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 0.00 146 C 8.44 5.41 0.00 3.05 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 0.00 147 G 8.08 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.34 4.37 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 0.95 0.00 0.00 149 I 9.34 4.06 1.79 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.33 0.35 0.00 0.00 150 G 8.72 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.44 4.24 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.51 4.92 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 0.00 153 Q 8.48 4.13 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00