NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4532 8.1927 115.3061 58.2027 64.6645 175.3026 2 W 4.0858 8.4238 129.3451 58.8424 30.3515 176.2199 3 S 4.2007 8.6087 115.2548 62.1845 62.7967 176.2432 4 E 4.0845 8.1399 121.6949 60.7978 29.5405 180.7138 5 K 4.0154 8.6354 119.9809 59.2576 32.0402 179.3299 6 A 3.7548 7.6878 120.8829 54.8893 18.1563 179.5537 7 F 4.3113 8.2601 119.5163 61.4826 39.5549 177.7244 8 S 3.5861 8.3955 114.1112 61.0134 62.8444 176.3128 9 A 3.8504 7.9388 124.5550 54.8112 18.0662 179.5092 10 S 3.9539 7.8289 111.5927 61.4397 62.5417 176.1902 11 K 3.7111 7.8637 121.4466 59.5105 31.8289 178.7165 12 L 3.7919 7.5789 119.9822 58.4209 42.0016 178.7082 13 D 4.2791 7.7764 118.1227 57.4992 40.6898 178.6918 14 D 4.3092 7.9365 118.6492 57.3133 40.3065 178.6966 15 A 4.0918 8.0723 121.2964 55.0545 18.2430 179.8653 16 I 3.6406 7.7030 118.1630 64.4255 37.1928 178.2985 17 A 4.5162 8.3062 122.7319 54.7392 17.9667 179.5830 18 A 3.9648 8.2235 118.3263 54.4193 18.4040 179.0836 19 K 4.0118 7.3575 116.1207 58.4221 32.9295 177.8282 20 F 4.8427 8.2498 115.7044 58.7313 40.9310 175.2694 21 G 3.8835 8.4507 103.5775 44.4805 0.0000 172.8140 22 S 4.7795 8.2601 111.5284 56.9515 61.4382 172.8487 23 L 4.6843 7.3907 121.4386 51.8810 44.2256 175.0332 24 P 4.3853 0.0000 0.0000 62.7399 32.4643 175.0295 25 I 4.8873 8.2049 123.4007 59.1444 40.8148 174.0785 26 Q 4.6978 8.4801 125.3701 54.3381 32.5753 173.7213 27 E 4.8624 8.6608 118.9484 55.8525 30.7345 176.1084 28 S 4.8451 8.7662 117.6798 56.8950 65.4322 173.8969 29 T 4.2534 8.8029 114.8179 62.3402 69.3904 174.2539 30 A 4.6258 8.2289 124.8971 52.3619 19.9860 176.5694 31 I 4.8587 7.7087 118.8848 61.1800 40.4423 174.8965 32 Q 4.6573 9.1213 126.6260 54.1576 31.0273 174.6484 33 I 4.8627 8.4302 124.4886 59.4013 40.0687 174.9214 34 K 4.6735 9.2626 127.1049 54.5832 34.2544 175.2925 35 A 5.0574 8.4689 125.3506 49.4874 22.5058 173.7668 36 P 4.1683 0.0000 0.0000 63.9800 32.2689 177.3308 37 E 4.2381 9.1960 122.9390 59.9231 30.5457 175.8351 38 I 5.4793 7.9649 117.6044 57.5598 38.8681 176.1275 39 A 4.8209 8.3433 126.6602 50.6794 23.1721 176.1911 40 E 4.1032 8.7847 117.0930 55.6710 30.6761 177.5200 41 N 4.4469 8.5397 117.3899 54.1791 37.7078 176.3140 42 G 3.7619 8.5608 111.2718 44.9403 0.0000 172.8759 43 A 4.4073 7.3762 121.5624 50.2717 21.3741 177.3558 44 F 4.7219 8.5274 118.1463 57.1309 39.7660 175.8510 45 V 4.3317 8.8200 126.2955 60.4726 32.7708 173.3104 46 P 4.9297 0.0000 0.0000 62.8965 32.1501 175.8693 47 V 4.6774 9.0638 123.8914 61.2852 35.0052 174.1037 48 T 5.1494 8.9531 123.6812 61.7018 72.1196 172.9632 49 V 4.9562 8.7586 125.4102 61.1005 34.5840 174.1698 50 A 5.2622 9.0279 128.1352 50.8212 23.1919 174.2818 51 T 5.0330 8.0501 109.9222 60.8941 70.5573 173.6474 52 S 4.7156 8.3017 120.4816 57.9625 64.1009 174.2882 53 I 3.6177 7.3642 122.5636 61.0918 37.0972 173.8196 54 P 4.3010 0.0000 0.0000 65.8922 31.0477 178.4266 55 G 4.0587 7.8876 104.8543 45.5384 0.0000 172.7289 56 A 4.5565 7.7044 124.1655 52.3821 18.4615 178.3704 57 T 4.8208 8.7901 112.5042 60.9539 71.1805 173.5898 58 N 5.5630 8.0075 121.0766 52.4668 43.0153 172.6543 59 I 5.0802 9.3009 126.9484 59.7873 40.3095 174.6404 60 S 5.2155 9.3947 123.0882 56.6648 66.6489 173.1568 61 I 4.9773 8.6523 124.1156 59.5668 39.9437 174.5068 62 F 5.3672 9.8379 126.1368 55.7472 42.6134 174.7178 63 T 4.8353 9.3590 113.9132 59.2733 69.9888 172.9784 64 P 4.2675 0.0000 0.0000 65.1120 32.0616 178.1193 65 A 4.0239 8.0429 121.5537 55.1729 18.5073 177.7651 66 N 4.5613 7.8944 111.4938 53.1040 39.3648 174.9766 67 F 4.1832 9.1006 123.5696 61.0334 39.4379 175.3545 68 S 4.4961 8.0050 115.5833 55.8849 62.8261 171.4951 69 P 5.0118 0.0000 0.0000 65.1722 32.7086 175.9495 70 M 4.1652 8.0547 120.6329 55.1451 31.9483 176.0292 71 V 4.2392 8.3666 126.3042 63.8683 33.5691 175.5717 72 A 4.5556 7.2228 118.9184 50.9656 22.3313 175.1468 73 S 4.9758 8.6264 114.9318 56.4710 65.8882 172.8500 74 F 4.9457 9.5871 129.1700 56.7104 41.6918 173.1509 75 D 5.2931 8.3388 126.4456 52.9380 42.3027 176.4395 76 V 4.2829 8.0696 120.9731 59.9332 35.0633 174.1806 77 L 4.1164 8.3929 122.4060 54.0699 42.1631 175.5473 78 P 4.5702 0.0000 0.0000 63.8109 32.1840 175.4754 79 R 3.8606 8.4978 114.5225 58.5635 26.5455 176.8498 80 M 4.6558 7.9265 112.3960 53.9663 34.0412 176.4915 81 K 3.8297 8.2394 116.7110 56.8174 28.7113 173.3044 82 P 4.6005 0.0000 0.0000 62.9784 33.2711 176.5949 83 E 4.9312 8.4401 122.1314 54.7029 32.9474 174.2728 84 V 4.2571 8.6844 125.8574 61.1037 34.7120 174.2638 85 S 5.3532 8.5123 122.7698 56.9377 66.3427 172.8461 86 L 4.6732 8.5741 121.9932 54.8513 44.3775 174.0166 87 R 5.2537 8.4495 115.6025 54.5059 31.8709 174.5557 88 M 5.0236 9.0198 123.2126 53.6658 34.1845 175.9470 89 R 4.7065 8.7860 122.8874 56.8505 30.8781 173.5289 90 M 4.6488 8.3241 121.0155 53.5209 35.2043 175.7000 91 A 4.2218 8.9930 129.6044 53.8061 19.9537 177.5269 92 K 4.6705 7.5148 114.5484 52.4666 35.5786 179.7466 93 T 4.1274 8.4227 113.9436 63.1503 67.7264 172.7657 94 E 4.7492 8.5981 125.7361 54.8858 33.6130 173.8287 95 N 5.1614 8.6808 118.7165 52.6550 40.0037 174.5153 96 L 4.6815 9.0638 124.2709 53.7016 43.8912 175.7579 97 V 4.7842 8.9222 123.4983 61.1636 34.4314 174.0770 98 V 4.8875 8.9723 128.7293 61.2297 33.7493 174.2899 99 V 5.0227 9.0465 127.8328 61.1156 34.3082 174.0786 100 V 4.8781 9.0585 127.9478 61.1964 34.2067 173.6979 101 Q 4.9080 9.0063 129.2863 54.5665 31.0284 174.0655 102 A 4.9208 8.1618 127.5621 50.0629 22.5743 175.8311 103 G 3.7688 9.0300 110.2151 47.1552 0.0000 174.8580 104 G 4.1829 8.6246 108.5764 45.2836 0.0000 172.7943 105 K 4.5409 7.8940 117.5292 54.0816 36.7239 175.5425 106 L 4.9380 7.9344 122.4807 53.2311 44.3769 175.1045 107 Y 5.1509 8.7896 120.0112 56.1574 41.7350 174.5950 108 R 5.2588 9.1369 122.9663 54.7161 33.8110 173.8939 109 A 5.2257 8.9211 125.5183 50.5659 23.0732 175.3889 110 V 5.0059 8.2497 118.3532 60.2143 35.1201 174.8197 111 R 4.6397 8.8829 122.0325 55.0182 33.6696 173.3873 112 E 4.6417 8.8485 127.0650 55.3466 31.3029 175.6093 113 V 4.3450 8.5213 127.9292 61.4500 34.2742 175.3576 114 K 4.4185 8.5754 131.9366 54.3192 33.1133 174.6194 115 V 4.3528 8.1383 121.3664 61.7448 31.6679 175.3106 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 8.19 4.45 0.00 3.93 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 2 W 8.42 4.09 0.00 3.58 3.12 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 3 S 8.61 4.20 0.00 4.14 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 0.00 4 E 8.14 4.08 0.00 1.99 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 2.32 1.98 0.00 5 K 8.64 4.02 0.00 1.57 1.61 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.54 7.81 6 A 7.69 3.75 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.26 4.31 0.00 3.04 3.17 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 0.00 0.00 0.00 0.00 8 S 8.40 3.59 0.00 3.99 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 9 A 7.94 3.85 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 10 S 7.83 3.95 0.00 4.08 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 11 K 7.86 3.71 0.00 1.68 1.67 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 0.68 7.81 12 L 7.58 3.79 0.00 1.74 1.73 0.67 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.78 4.28 0.00 2.84 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 14 D 7.94 4.31 0.00 2.82 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 15 A 8.07 4.09 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 16 I 7.70 3.64 1.88 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.02 0.98 0.00 0.00 17 A 8.31 4.52 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 18 A 8.22 3.96 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 19 K 7.36 4.01 0.00 1.62 1.80 0.00 1.32 0.00 0.00 1.42 0.00 0.00 2.81 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.55 0.21 7.81 20 F 8.25 4.84 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 3.88 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 0.00 0.00 0.00 22 S 8.26 4.78 0.00 3.87 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 23 L 7.39 4.68 0.00 1.58 1.48 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.39 0.00 1.97 1.90 0.00 3.46 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 2.04 2.03 0.00 25 I 8.20 4.89 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 0.84 0.00 0.00 26 Q 8.48 4.70 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.03 2.33 0.00 27 E 8.66 4.86 0.00 1.89 1.93 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 2.28 2.25 0.00 28 S 8.77 4.85 0.00 4.01 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 29 T 8.80 4.25 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 1.22 0.00 0.00 30 A 8.23 4.63 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 31 I 7.71 4.86 1.89 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 1.36 0.72 0.94 0.00 0.00 32 Q 9.12 4.66 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 33 I 8.43 4.86 1.88 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 1.36 0.63 0.92 0.00 0.00 34 K 9.26 4.67 0.00 1.63 1.70 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.48 7.81 35 A 8.47 5.06 1.18 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 0.00 0.00 36 P 0.00 4.17 0.00 2.06 2.11 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 37 E 9.20 4.24 0.00 1.66 1.95 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 2.31 1.89 0.00 38 I 7.96 5.48 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 1.23 2.32 0.91 0.00 0.00 39 A 8.34 4.82 1.20 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 40 E 8.78 4.10 0.00 1.91 1.84 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 2.31 1.87 0.00 41 N 8.54 4.45 0.00 2.73 2.67 0.00 0.00 6.76 7.51 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 42 G 8.56 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 0.00 0.00 0.00 43 A 7.38 4.41 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 44 F 8.53 4.72 0.00 2.97 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 45 V 8.82 4.33 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 1.00 0.00 0.00 0.95 0.00 0.00 46 P 0.00 4.93 0.00 2.12 2.05 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 47 V 9.06 4.68 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 0.97 0.00 0.00 0.98 0.00 0.00 48 T 8.95 5.15 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 1.28 0.00 0.00 49 V 8.76 4.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.93 0.00 0.00 50 A 9.03 5.26 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 51 T 8.05 5.03 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 1.23 0.00 0.00 52 S 8.30 4.72 0.00 3.85 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 53 I 7.36 3.62 1.73 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.33 0.61 0.00 0.00 54 P 0.00 4.30 0.00 2.15 2.07 0.00 3.47 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 55 G 7.89 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 0.00 0.00 0.00 56 A 7.70 4.56 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.79 4.82 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 58 N 8.01 5.56 0.00 2.86 2.86 0.00 0.00 6.97 7.76 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 59 I 9.30 5.08 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.79 1.00 0.00 0.00 60 S 9.39 5.22 0.00 4.15 3.45 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 61 I 8.65 4.98 1.80 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 1.25 0.84 0.92 0.00 0.00 62 F 9.84 5.37 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 63 T 9.36 4.84 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 1.24 0.00 0.00 64 P 0.00 4.27 0.00 2.21 2.17 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 65 A 8.04 4.02 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 66 N 7.89 4.56 0.00 2.76 2.83 0.00 0.00 6.81 7.45 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 67 F 9.10 4.18 0.00 2.95 3.12 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 68 S 8.01 4.50 0.00 3.85 3.85 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 69 P 0.00 5.01 0.00 2.29 2.27 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.77 0.00 70 M 8.05 4.17 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.22 0.00 71 V 8.37 4.24 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 0.78 0.00 0.00 0.93 0.00 0.00 72 A 7.22 4.56 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.63 4.98 0.00 3.72 3.64 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 74 F 9.59 4.95 0.00 3.05 3.07 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 75 D 8.34 5.29 0.00 2.43 2.43 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 76 V 8.07 4.28 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 0.78 0.00 0.00 0.93 0.00 0.00 77 L 8.39 4.12 0.00 1.64 1.63 0.91 1.02 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 78 P 0.00 4.57 0.00 2.18 2.05 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 79 R 8.50 3.86 0.00 2.00 2.11 0.00 3.15 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.75 0.00 80 M 7.93 4.66 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 81 K 8.24 3.83 0.00 2.10 1.81 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 0.97 7.81 82 P 0.00 4.60 0.00 2.32 2.51 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 83 E 8.44 4.93 0.00 1.90 1.74 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 2.11 2.36 0.00 84 V 8.68 4.26 1.74 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 0.82 0.00 0.00 -0.14 0.00 0.00 85 S 8.51 5.35 0.00 3.69 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 86 L 8.57 4.67 0.00 1.71 1.69 0.93 0.51 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 87 R 8.45 5.25 0.00 2.06 1.89 0.00 3.09 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.15 0.00 88 M 9.02 5.02 0.00 2.14 2.22 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 2.49 0.00 89 R 8.79 4.71 0.00 1.62 1.76 0.00 3.10 0.00 0.00 3.88 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.08 0.00 90 M 8.32 4.65 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.71 0.00 91 A 8.99 4.22 1.25 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 92 K 7.51 4.67 0.00 1.72 1.51 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 0.97 7.81 93 T 8.42 4.13 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 1.22 0.00 0.00 94 E 8.60 4.75 0.00 1.98 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 2.19 2.30 0.00 95 N 8.68 5.16 0.00 2.62 2.79 0.00 0.00 6.94 7.85 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 96 L 9.06 4.68 0.00 1.58 1.61 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.92 4.78 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 0.94 0.00 0.00 0.94 0.00 0.00 98 V 8.97 4.89 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 0.95 0.00 0.00 0.98 0.00 0.00 99 V 9.05 5.02 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 0.78 0.00 0.00 0.99 0.00 0.00 100 V 9.06 4.88 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 1.01 0.00 0.00 1.00 0.00 0.00 101 Q 9.01 4.91 0.00 1.81 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 102 A 8.16 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 0.00 103 G 9.03 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 0.00 104 G 8.62 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 0.00 0.00 0.00 105 K 7.89 4.54 0.00 1.67 1.17 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.35 7.81 106 L 7.93 4.94 0.00 1.34 1.25 0.82 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.79 5.15 0.00 2.90 2.79 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 0.00 108 R 9.14 5.26 0.00 1.81 1.93 0.00 3.02 0.00 0.00 3.11 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 109 A 8.92 5.23 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 0.00 110 V 8.25 5.01 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 0.75 0.00 0.00 0.97 0.00 0.00 111 R 8.88 4.64 0.00 1.87 1.76 0.00 3.23 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 112 E 8.85 4.64 0.00 2.11 1.83 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 2.26 2.43 0.00 113 V 8.52 4.35 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 0.94 0.00 0.00 0.94 0.00 0.00 114 K 8.58 4.42 0.00 1.48 1.67 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.75 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.37 1.10 7.81 115 V 8.14 4.35 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 1.13 0.00 0.00 1.00 0.00 0.00