NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3826 8.3344 116.7946 58.4567 64.1568 174.2388 2 M 4.0972 8.3598 124.1806 54.6711 29.6833 174.3463 3 Q 3.8700 8.2154 122.2533 57.3637 30.4628 175.8898 4 D 4.7111 7.6381 124.0566 51.9529 41.5041 174.6362 5 P 4.4141 0.0000 0.0000 65.5798 32.2957 178.7111 6 I 3.6720 8.1510 120.0526 64.1747 36.8554 177.7383 7 A 3.9476 7.7824 120.5494 55.6589 18.1409 179.2259 8 D 4.5405 7.6133 116.9134 57.2584 40.3941 178.9928 9 M 4.1429 8.0516 118.3618 58.5131 32.1535 178.2176 10 L 4.0452 7.6600 118.9884 57.3304 41.8913 179.2657 11 T 3.7631 8.1041 110.0882 65.0250 68.9089 176.7087 12 R 3.9077 8.3660 122.2545 58.8326 30.1211 179.1288 13 I 3.6887 7.3966 118.3801 64.2521 36.9680 178.7699 14 R 3.8614 7.8663 116.9671 59.5003 29.2644 178.6672 15 N 4.4512 8.9827 117.4391 55.3287 38.7223 177.5533 16 G 3.7342 8.2169 107.5932 47.9392 0.0000 175.9826 17 Q 4.3120 7.9990 118.9669 57.7306 28.7345 177.8489 18 A 4.4913 7.5126 119.6885 52.2902 19.2508 177.3126 19 A 4.5593 8.1490 120.1341 51.0901 19.5237 176.7225 20 N 4.4423 8.5498 111.2419 53.6538 36.1583 174.4894 21 K 3.9546 7.7680 118.6783 56.5878 32.5880 178.0351 22 A 4.2572 8.7933 126.7031 55.2587 18.8827 175.9871 23 A 5.1815 6.8627 115.4839 53.5995 22.8057 175.9931 24 V 4.2489 8.0336 110.9374 61.7653 34.8999 172.0485 25 T 5.1658 8.3479 117.1327 60.4481 70.2719 172.9982 26 M 4.4436 7.5870 119.6621 53.7812 34.6926 172.6639 27 P 4.7139 0.0000 0.0000 63.1374 31.8310 176.1528 28 S 4.5670 8.7985 120.4926 58.0184 64.3115 173.6940 29 S 4.6020 8.7713 110.7636 57.2208 64.6221 178.6790 30 K 4.5131 7.6459 124.7100 58.9111 33.0836 177.8376 31 L 3.8857 7.8388 120.1771 58.2819 42.0941 178.5410 32 K 3.7982 7.3583 115.7021 59.7818 32.1640 179.0862 33 V 3.6428 8.2953 118.4375 65.7280 31.4876 177.6086 34 A 3.9703 8.0931 120.3809 55.6750 18.2402 179.6754 35 I 3.5647 8.1597 118.0652 64.3562 37.0684 178.1522 36 A 3.6081 7.7382 121.7044 55.4790 17.8122 179.0045 37 N 4.3085 7.7065 114.7708 56.7476 38.5282 177.7723 38 V 3.8220 7.7575 119.7198 65.0804 31.1551 178.2338 39 L 4.3358 7.7878 119.4443 57.2842 41.5499 179.2332 40 K 4.0457 8.2063 119.7587 59.3947 32.1703 178.5140 41 E 4.2435 8.7147 116.7079 57.8746 29.3698 177.8590 42 E 4.4014 7.4031 116.3535 54.4807 31.4113 175.9445 43 G 3.6887 7.5812 107.2030 46.5595 0.0000 173.7839 44 F 5.2656 8.2029 114.1893 57.0235 42.0123 176.4579 45 I 4.6112 7.6886 110.4850 59.4670 39.8375 174.7694 46 E 4.1553 8.9668 125.1490 58.4180 29.8470 176.4530 47 D 4.6849 8.0390 116.6983 54.5899 46.1521 173.9436 48 F 5.4690 8.3294 114.0850 55.9115 41.2512 174.0311 49 K 3.9173 8.7151 116.5728 55.5257 35.3827 174.7369 50 V 4.3576 8.6273 128.7081 61.4542 31.2228 174.5318 51 E 4.6166 9.9874 126.8172 53.5561 31.6552 175.1206 52 G 4.7196 8.4103 114.0682 44.2423 0.0000 173.4501 53 D 5.1379 7.5976 128.5185 52.5726 38.0313 179.9833 54 T 3.9738 8.8505 113.4512 63.7311 67.2265 173.8956 55 K 4.4521 8.2164 121.7280 53.7808 31.7350 171.7688 56 P 4.3993 0.0000 0.0000 62.8286 32.7545 176.6012 57 E 4.6930 8.7342 125.8428 55.6851 33.2782 175.3784 58 L 4.7976 8.1876 119.9326 54.3904 44.2270 173.4165 59 E 4.3126 8.9349 125.1056 55.7508 31.1477 174.7886 60 L 5.2592 9.0040 129.4021 53.4428 45.3769 175.1065 61 T 4.8299 8.8355 117.9106 61.0098 70.3502 175.0261 62 L 4.7125 8.5498 126.4544 54.3477 43.1586 176.1209 63 K 4.7606 7.8261 119.6610 55.2730 34.9527 175.1117 64 Y 4.9195 8.9537 123.8421 56.3759 42.2838 174.0052 65 F 5.1825 7.9427 123.1178 57.5489 38.2719 177.0259 66 Q 3.0765 8.3511 112.0283 58.6583 28.0105 177.0027 67 G 3.9308 7.9728 108.2018 47.4784 0.0000 174.8306 68 K 4.4423 7.6590 118.2448 54.6610 34.0195 177.5211 69 A 4.6845 8.2850 123.5032 52.4251 17.8249 178.1849 70 V 4.3385 8.1440 105.1450 61.2754 33.8484 175.8838 71 V 4.1343 7.4730 113.1791 59.1871 31.5251 174.8660 72 E 4.0114 8.8804 126.9450 58.4436 29.4261 177.3087 73 S 4.5836 6.9403 110.8939 57.8093 65.5903 175.8270 74 I 4.3005 8.2505 126.4448 57.8964 39.3592 173.4809 75 Q 4.6103 7.4437 129.3257 53.5444 32.0145 174.5420 76 R 4.2517 8.3929 124.1609 56.7146 30.6147 176.0582 77 V 4.2269 8.8808 120.1509 64.2296 34.1740 176.1040 78 S 4.5648 7.8895 111.8465 57.8118 62.2208 173.5714 79 R 3.9123 7.9443 114.6867 54.9134 29.6819 174.0252 80 P 4.4047 0.0000 0.0000 62.9635 32.1232 176.2218 81 G 4.0066 8.6322 103.1724 45.0519 0.0000 173.6914 82 L 5.6626 6.7766 129.3884 55.2473 45.6703 174.7109 83 R 4.0889 7.9741 117.5838 56.6630 30.8641 176.6915 84 I 4.5916 8.0765 123.2574 59.9583 39.0119 174.4505 85 Y 4.8028 8.3648 120.2850 56.5566 41.7914 174.1753 86 K 4.6582 8.3387 119.1006 55.7718 36.5451 175.5747 87 R 4.7031 7.8754 117.4853 54.0049 32.4794 177.5735 88 K 4.0517 8.9855 120.5512 58.6439 32.1686 176.9041 89 D 4.8419 7.6106 116.8000 52.8920 40.3370 176.8041 90 E 4.7802 8.0012 116.7155 56.9560 31.6972 173.6908 91 L 4.8776 7.9257 122.6429 51.6089 46.0275 174.3582 92 P 4.5044 0.0000 0.0000 62.8468 32.0954 175.6810 93 K 4.1247 8.2548 117.9646 55.9764 34.1958 172.6992 94 V 2.9804 7.8191 126.0866 63.2997 31.1914 171.4246 95 M 3.3143 9.3690 126.4222 56.1861 29.6710 176.8397 96 A 3.3929 9.1272 116.2126 53.5017 16.2483 178.3450 97 G 4.1995 8.5893 109.9579 47.5027 0.0000 176.0840 98 L 4.0133 7.3954 118.1525 56.8508 41.7578 177.5437 99 G 4.7663 7.8689 105.5991 44.7118 0.0000 171.8238 100 I 5.3857 8.0191 109.5793 58.0496 41.3627 174.8169 101 A 5.1081 8.4157 122.9628 48.8171 21.7533 175.6373 102 V 3.8863 8.4799 114.7934 63.2111 32.9329 175.8847 103 V 4.6682 8.8575 124.8203 60.8092 34.4714 174.5591 104 S 4.5213 8.9846 124.8551 58.9094 63.0540 173.6497 105 T 4.7682 8.8525 119.2206 60.0399 70.8893 175.8410 106 S 4.2145 8.7794 115.2797 60.3393 62.4986 174.4663 107 K 4.3758 8.4947 118.0312 55.6788 32.2563 174.8705 108 G 3.9614 7.0746 105.8086 43.3110 0.0000 173.9098 109 V 4.0695 7.9087 120.4456 62.4586 30.7901 175.1268 110 M 4.6754 8.3012 129.2961 54.1966 35.5564 174.5857 111 T 4.9575 8.1600 109.5554 60.4148 71.8887 175.0492 112 D 4.3654 8.2954 120.8092 56.8015 39.1081 178.8245 113 R 3.8807 7.8849 119.2590 58.7186 30.1558 177.9091 114 A 4.0729 8.1828 120.0872 54.6816 18.1759 179.4257 115 A 3.8885 8.1050 119.7378 55.2897 18.4783 179.6258 116 R 3.8553 7.2263 115.2691 59.9219 30.2723 178.3145 117 Q 3.9659 7.7727 116.8357 59.8591 28.9964 178.3701 118 A 4.1703 7.5327 121.5187 53.6163 18.5425 178.4628 119 G 3.9106 8.0987 103.9382 45.4116 0.0000 173.3414 120 L 4.5564 7.6835 120.3875 53.9430 43.3210 177.5787 121 G 3.9049 8.5422 106.4947 45.5926 0.0000 175.4798 122 G 3.6674 7.4188 102.0229 47.0683 0.0000 174.2545 123 E 4.3861 8.0416 119.5537 54.4669 33.0816 175.0795 124 I 4.0849 8.6057 128.2388 61.8534 38.4141 175.1787 125 I 4.4381 8.7387 128.4761 61.9736 40.5190 175.2803 126 C 4.9838 7.1054 114.9560 58.0950 31.0593 171.1476 127 Y 5.3965 7.3241 116.8145 55.4977 41.5828 174.3711 128 V 4.6093 8.6991 111.3742 58.6948 37.2105 175.5841 129 A 4.3135 8.1250 121.5645 52.5907 18.4510 177.7585 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 S 8.33 4.38 0.00 3.88 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 2 M 8.36 4.10 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 3 Q 8.22 3.87 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.64 0.00 0.00 0.00 0.00 0.00 2.53 2.30 0.00 4 D 7.64 4.71 0.00 2.61 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 5 P 0.00 4.41 0.00 2.24 2.27 0.00 3.75 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 6 I 8.15 3.67 2.03 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 1.41 0.66 0.86 0.00 0.00 7 A 7.78 3.95 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 8 D 7.61 4.54 0.00 2.87 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 9 M 8.05 4.14 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 10 L 7.66 4.05 0.00 1.77 1.74 0.80 0.58 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 11 T 8.10 3.76 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 1.23 0.00 0.00 12 R 8.37 3.91 0.00 1.85 2.04 0.00 3.10 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 13 I 7.40 3.69 1.99 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.01 0.81 0.00 0.00 14 R 7.87 3.86 0.00 1.97 2.20 0.00 2.73 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 15 N 8.98 4.45 0.00 2.70 2.92 0.00 0.00 7.07 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 16 G 8.22 3.73 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 0.00 0.00 0.00 17 Q 8.00 4.31 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 18 A 7.51 4.49 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 19 A 8.15 4.56 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 20 N 8.55 4.44 0.00 2.83 2.78 0.00 0.00 7.30 7.61 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 21 K 7.77 3.95 0.00 1.84 1.95 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.65 1.58 7.81 22 A 8.79 4.26 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 23 A 6.86 5.18 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 24 V 8.03 4.25 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 0.59 0.00 0.00 0.94 0.00 0.00 25 T 8.35 5.17 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 1.22 0.00 0.00 26 M 7.59 4.44 0.00 2.15 2.11 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 2.33 2.29 0.00 27 P 0.00 4.71 0.00 2.10 2.14 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 28 S 8.80 4.57 0.00 3.95 4.18 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 29 S 8.77 4.60 0.00 3.97 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 30 K 7.65 4.51 0.00 1.83 1.77 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.50 7.81 31 L 7.84 3.89 0.00 1.78 1.61 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.36 3.80 0.00 2.02 1.86 0.00 1.83 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.45 7.81 33 V 8.30 3.64 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 1.25 0.00 0.00 1.04 0.00 0.00 34 A 8.09 3.97 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 35 I 8.16 3.56 1.76 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 1.40 1.16 0.83 0.00 0.00 36 A 7.74 3.61 -0.04 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 0.00 0.00 37 N 7.71 4.31 0.00 2.97 2.89 0.00 0.00 6.73 8.02 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 38 V 7.76 3.82 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 0.92 0.00 0.00 0.98 0.00 0.00 39 L 7.79 4.34 0.00 1.85 1.78 0.87 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.21 4.05 0.00 1.98 2.05 0.00 1.97 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.59 7.81 41 E 8.71 4.24 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 2.38 2.60 0.00 42 E 7.40 4.40 0.00 2.03 1.57 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 2.39 2.52 0.00 43 G 7.58 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 44 F 8.20 5.27 0.00 3.03 2.86 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 45 I 7.69 4.61 2.05 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 1.51 0.51 0.94 0.00 0.00 46 E 8.97 4.16 0.00 2.21 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 2.43 2.49 0.00 47 D 8.04 4.68 0.00 2.82 2.54 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 48 F 8.33 5.47 0.00 3.19 2.94 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 49 K 8.72 3.92 0.00 1.68 1.75 0.00 1.58 0.00 0.00 1.94 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.23 1.22 7.81 50 V 8.63 4.36 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 1.08 0.00 0.00 1.03 0.00 0.00 51 E 9.99 4.62 0.00 1.94 1.89 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 2.30 2.39 0.00 52 G 8.41 4.72 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 53 D 7.60 5.14 0.00 2.80 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.85 3.97 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 1.21 0.00 0.00 55 K 8.22 4.45 0.00 1.73 1.72 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.48 7.81 56 P 0.00 4.40 0.00 2.13 2.21 0.00 3.71 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 57 E 8.73 4.69 0.00 2.19 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 2.29 2.26 0.00 58 L 8.19 4.80 0.00 1.73 1.65 0.94 1.37 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 59 E 8.93 4.31 0.00 2.32 1.87 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 2.34 2.29 0.00 60 L 9.00 5.26 0.00 1.82 1.64 1.03 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.84 4.83 4.31 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 1.26 0.00 0.00 62 L 8.55 4.71 0.00 2.00 1.77 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.83 4.76 0.00 1.85 1.75 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.49 7.81 64 Y 8.95 4.92 0.00 3.07 2.87 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 65 F 7.94 5.18 0.00 2.92 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 0.00 0.00 0.00 0.00 66 Q 8.35 3.08 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 2.10 2.45 0.00 67 G 7.97 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 68 K 7.66 4.44 0.00 1.96 1.85 0.00 1.61 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.56 7.81 69 A 8.29 4.68 0.99 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 70 V 8.14 4.34 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 0.86 0.00 0.00 1.03 0.00 0.00 71 V 7.47 4.13 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 0.57 0.00 0.00 0.82 0.00 0.00 72 E 8.88 4.01 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 2.32 2.29 0.00 73 S 6.94 4.58 0.00 3.91 3.65 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 74 I 8.25 4.30 1.53 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 0.98 1.95 0.75 0.00 0.00 75 Q 7.44 4.61 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 76 R 8.39 4.25 0.00 1.79 1.78 0.00 3.36 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 77 V 8.88 4.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 78 S 7.89 4.56 0.00 3.99 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 79 R 7.94 3.91 0.00 1.94 1.95 0.00 3.09 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 1.60 1.66 0.00 80 P 0.00 4.40 0.00 2.24 2.25 0.00 3.83 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 2.07 1.95 0.00 81 G 8.63 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 6.78 5.66 0.00 1.82 1.68 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 83 R 7.97 4.09 0.00 2.16 1.92 0.00 3.30 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 84 I 8.08 4.59 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.75 0.93 0.00 0.00 85 Y 8.36 4.80 0.00 2.82 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 86 K 8.34 4.66 0.00 1.71 1.99 0.00 1.91 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.41 7.81 87 R 7.88 4.70 0.00 2.07 1.82 0.00 3.15 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 88 K 8.99 4.05 0.00 1.90 1.86 0.00 1.61 0.00 0.00 1.29 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.36 7.81 89 D 7.61 4.84 0.00 2.80 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 90 E 8.00 4.78 0.00 1.97 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 2.13 2.19 0.00 91 L 7.93 4.88 0.00 1.61 1.49 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.50 0.00 2.15 2.05 0.00 3.70 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 1.99 1.95 0.00 93 K 8.25 4.12 0.00 1.65 1.78 0.00 1.79 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.48 7.81 94 V 7.82 2.98 2.26 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 1.08 0.00 0.00 0.93 0.00 0.00 95 M 9.37 3.31 0.00 2.21 2.08 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 2.62 2.51 0.00 96 A 9.13 3.39 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.59 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 0.00 0.00 0.00 0.00 98 L 7.40 4.01 0.00 1.70 1.78 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.87 4.77 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 0.00 100 I 8.02 5.39 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.00 1.11 0.00 0.00 101 A 8.42 5.11 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 0.00 102 V 8.48 3.89 2.05 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 0.64 0.00 0.00 0.92 0.00 0.00 103 V 8.86 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 0.98 0.00 0.00 0.97 0.00 0.00 104 S 8.98 4.52 0.00 3.91 3.71 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 0.00 105 T 8.85 4.77 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 1.30 0.00 0.00 106 S 8.78 4.21 0.00 3.87 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 0.00 107 K 8.49 4.38 0.00 1.79 1.79 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.50 7.81 108 G 7.07 3.96 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 0.00 0.00 0.00 109 V 7.91 4.07 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 0.79 0.00 0.00 0.91 0.00 0.00 110 M 8.30 4.68 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 111 T 8.16 4.96 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 1.23 0.00 0.00 112 D 8.30 4.37 0.00 3.00 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 0.00 113 R 7.88 3.88 0.00 1.91 1.95 0.00 3.20 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 114 A 8.18 4.07 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 0.00 115 A 8.10 3.89 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 0.00 116 R 7.23 3.86 0.00 1.89 2.04 0.00 3.20 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 1.83 1.81 0.00 117 Q 7.77 3.97 0.00 2.08 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 118 A 7.53 4.17 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 0.00 119 G 8.10 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 0.00 120 L 7.68 4.56 0.00 1.69 1.63 0.93 0.91 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 0.00 121 G 8.54 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 0.00 122 G 7.42 3.67 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 0.00 0.00 0.00 123 E 8.04 4.39 0.00 1.72 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 0.00 1.88 1.47 0.00 124 I 8.61 4.08 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.76 0.89 0.00 0.00 125 I 8.74 4.44 1.82 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 1.36 0.60 0.85 0.00 0.00 126 C 7.11 4.98 0.00 3.13 3.03 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 0.00 127 Y 7.32 5.40 0.00 3.07 3.03 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 0.00 128 V 8.70 4.61 1.06 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 0.40 0.00 0.00 0.63 0.00 0.00 129 A 8.12 4.31 1.30 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