NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9635 8.3549 109.7381 45.3742 0.0000 172.8145 2 S 3.9483 8.9006 114.6558 60.8862 62.6223 173.7735 3 S 4.2221 8.0410 117.0399 57.8804 61.6782 172.5020 4 G 3.7295 8.3075 116.4738 44.9847 0.0000 171.6645 5 S 4.3827 8.4723 118.9772 57.5983 63.4591 173.4905 6 S 4.6876 8.6495 121.0353 57.7880 63.8385 174.1881 7 G 3.9003 8.9687 114.7128 47.5483 0.0000 171.3088 8 E 3.7821 9.0772 116.2139 57.6573 27.3731 174.4108 9 N 4.0330 8.0847 115.4007 52.5469 40.0726 173.4349 10 P 4.6453 0.0000 0.0000 62.5581 32.7985 174.9075 11 R 4.5061 8.1161 116.5835 56.5426 31.9585 175.1073 12 N 4.1233 8.8349 120.3749 54.9919 35.4361 175.6449 13 V 4.1477 6.9263 110.8456 58.9587 31.9829 176.4034 14 G 3.9155 8.1087 113.3787 43.8145 0.0000 170.4379 15 S 4.0503 8.3319 120.3394 58.4129 62.9407 174.0184 16 L 4.4493 8.1068 124.9242 52.6267 43.4369 175.3334 17 D 4.3559 8.4873 119.1165 54.7870 40.2664 176.7372 18 K 4.2861 8.5180 125.3599 58.1424 33.0849 177.7422 19 T 4.2380 7.7542 108.9751 61.8815 69.2231 174.0985 20 S 4.7058 7.5228 117.8206 56.9975 64.7271 173.0307 21 K 4.4909 8.3273 119.1874 57.9793 34.1690 178.0603 22 N 4.7470 8.3254 116.6389 54.4072 37.3222 174.0208 23 V 5.1235 6.7828 117.4798 58.8454 32.8607 176.2541 24 G 4.1291 8.7019 112.9722 46.0475 0.0000 171.7236 25 T 5.0502 8.5342 115.6196 61.6495 72.2340 174.1642 26 G 4.0263 9.4682 113.7561 44.4444 0.0000 171.1149 27 L 5.3407 8.6532 128.8937 53.0271 43.7913 176.1249 28 V 4.3562 9.0054 120.0596 59.8698 35.1862 175.3328 29 G 4.7128 9.0855 111.9670 43.7815 0.0000 171.0354 30 A 4.9175 8.3110 120.9202 49.4959 20.6797 176.5118 31 P 4.0671 0.0000 0.0000 65.7491 31.1460 177.5951 32 A 4.1166 7.4946 122.3016 54.2672 18.9848 178.7303 33 C 3.6305 7.8617 116.5405 60.2532 32.4367 173.5524 34 G 4.2185 7.4379 106.8565 45.9116 0.0000 171.6943 35 D 5.8500 7.5260 119.1143 51.9151 45.8553 177.0627 36 V 4.4188 8.2809 118.7536 61.6811 34.1891 173.6015 37 M 4.6452 8.6091 128.5705 54.0624 33.3434 174.7452 38 K 4.6595 9.2160 130.1392 54.9968 33.5216 174.5841 39 L 5.1940 9.0554 130.6012 53.7610 44.9594 175.4411 40 Q 5.0726 8.8634 123.6266 54.8357 33.7169 173.4715 41 I 4.9300 8.2070 117.6354 59.0220 41.1630 174.1882 42 Q 4.6375 9.0590 127.0505 54.8052 30.3519 174.2069 43 V 4.3994 8.5087 127.6717 61.7278 33.1303 175.5671 44 D 4.7571 8.3741 127.4479 52.8220 42.9916 176.3483 45 E 4.0819 8.6813 116.8809 59.3643 29.5667 178.5008 46 K 4.0196 7.9269 117.7003 57.7355 32.0416 177.7832 47 G 3.9808 8.2945 107.0348 45.1290 0.0000 172.2855 48 K 4.4372 7.7243 119.7801 53.8575 34.1096 175.4716 49 I 4.0473 8.4112 126.7910 61.6289 36.8792 176.9946 50 V 3.9668 8.2685 119.8460 62.0616 32.7352 176.2610 51 D 5.0876 7.7950 117.8527 52.2749 44.5790 174.5735 52 A 5.1831 8.4880 125.4590 50.5755 22.4472 175.5267 53 R 4.8852 9.2292 120.8384 54.3067 34.2930 174.3528 54 F 5.4018 8.5692 117.1924 55.0125 41.7979 174.3851 55 K 3.8200 8.6632 121.7788 55.4315 34.7015 174.7213 56 T 4.8503 7.5958 123.9749 61.1244 71.6574 174.3055 57 F 4.9566 9.1585 122.3772 57.2190 42.6242 172.3415 58 G 4.2811 9.1358 116.2502 45.1651 0.0000 174.6803 59 C 4.3956 8.7397 121.4599 57.2956 30.4958 174.5506 60 G 3.5884 8.9764 108.6564 48.8075 0.0000 176.3391 61 S 3.9745 8.0721 117.6072 61.0230 62.8466 176.9605 62 A 3.9357 7.8878 123.1757 55.1903 18.3382 179.5886 63 I 3.9825 8.1652 119.7177 64.3710 37.1120 178.0453 64 A 3.9219 8.0807 121.2173 54.4858 18.1987 179.4850 65 S 3.8013 8.0061 111.6362 62.0861 63.1287 177.2784 66 S 3.8985 8.0386 117.9581 60.8479 62.3329 176.6458 67 S 2.7900 6.7595 117.2810 61.1615 62.5742 176.3792 68 L 3.6890 7.6065 123.4703 57.2887 41.7837 178.6473 69 A 3.4875 7.4018 120.7853 55.3746 18.1057 179.5040 70 T 3.9692 8.0551 111.5699 65.0308 67.0387 175.2856 71 E 3.9627 7.3451 119.5388 58.0015 29.7770 177.8197 72 W 4.6750 8.3622 118.4897 59.3246 29.6952 178.5965 73 V 3.8568 7.8751 111.9773 62.7349 31.1392 176.5892 74 K 4.1832 7.0006 118.5620 57.6516 32.3201 176.7441 75 G 4.1156 8.5783 112.6635 45.4885 0.0000 174.0482 76 K 4.3291 7.5816 118.5033 55.7730 33.5103 175.7936 77 T 4.7509 7.8638 110.3475 60.3712 71.9568 175.8101 78 V 3.6343 7.7821 114.6191 64.8997 31.2556 178.9743 79 E 4.0143 8.0473 117.0450 59.2479 29.6467 178.6699 80 E 4.0749 7.8191 117.4528 59.3517 29.5857 178.9853 81 A 4.0134 7.9359 120.7706 55.5214 18.1914 179.4639 82 L 3.9733 7.4884 116.3036 58.3778 41.7016 179.6847 83 T 4.1212 7.8867 109.0485 63.3039 69.1367 175.6042 84 I 3.6362 7.1325 121.7295 61.8952 36.3121 175.3981 85 K 4.6834 8.2626 123.9068 54.5282 34.8526 177.0449 86 N 4.6473 8.6172 118.0330 55.8401 37.5588 177.1426 87 T 3.8799 8.0021 111.8425 65.0614 68.3966 175.3627 88 D 4.4246 8.2135 121.5958 57.0756 40.8673 178.3485 89 I 3.5465 7.3747 117.5984 64.6635 37.1316 177.8668 90 A 3.9116 8.2495 121.0336 55.5200 17.9546 179.7123 91 K 3.8941 7.6451 116.2399 59.4316 32.3836 178.2693 92 E 4.1343 8.2531 118.9202 59.5508 29.7209 178.6268 93 L 4.0572 8.0146 116.5962 55.0074 42.4928 176.4848 94 C 4.0121 7.7520 115.8396 60.4249 25.9970 173.1926 95 L 4.3401 7.5818 118.0498 54.0444 41.6448 174.8470 96 P 4.5488 0.0000 0.0000 61.6695 32.0701 175.3345 97 P 4.3916 0.0000 0.0000 64.6465 31.4556 177.8131 98 V 3.9151 7.7273 118.1712 63.4590 32.2914 176.5487 99 K 4.6614 7.6014 119.7205 56.1933 32.9067 178.9824 100 L 4.0494 8.1730 121.5836 58.0048 42.2013 179.1947 101 H 4.0527 8.4588 114.5350 59.2842 27.9992 176.8017 102 C 3.9545 7.2895 118.0935 62.8801 28.1334 175.5199 103 S 3.9091 7.8251 113.9956 62.1102 61.8550 176.1684 104 M 4.1114 8.0007 118.6682 58.4041 30.8905 177.7171 105 L 3.8710 7.8065 121.1564 58.0500 42.1267 178.7093 106 A 3.8828 7.9314 120.2210 55.1811 18.3461 178.8744 107 E 3.8521 7.7126 115.9435 59.7372 29.8066 178.4328 108 D 4.3528 8.3835 117.7920 57.4743 41.1074 178.3957 109 A 3.9573 7.9700 120.8755 55.4563 18.3478 179.0925 110 I 3.5831 7.7700 118.0799 65.0503 37.1745 178.1698 111 K 3.7980 8.2660 118.1663 59.9036 31.9748 178.9678 112 A 3.9910 8.1012 119.9362 56.1469 18.3034 178.7834 113 A 4.0179 8.1633 119.1136 54.6817 18.2205 179.3938 114 L 3.9570 8.1695 114.9199 58.2005 42.0827 179.3497 115 A 3.9807 8.4802 120.2428 55.5021 17.7254 178.7166 116 D 4.3447 8.6485 114.9458 57.8444 41.1625 178.7558 117 Y 4.1582 8.0538 118.3223 60.6532 38.9794 177.9457 118 K 3.7702 8.4758 119.7524 59.2770 32.1272 178.9757 119 L 4.1749 8.0742 121.0006 57.3843 41.3655 180.0087 120 K 4.2768 7.3022 116.9486 58.8520 31.9885 179.2092 121 Q 4.0021 7.8483 118.4291 58.2386 28.9471 177.6698 122 E 4.5331 8.0020 118.1615 56.7807 30.0243 175.4307 123 S 4.6426 8.3739 114.3527 55.6736 64.1134 174.5469 124 K 4.0406 8.7743 126.1754 59.3274 32.6037 177.5827 125 S 4.6887 7.7403 111.7687 56.0359 65.1190 172.3978 126 G 4.1884 8.0201 113.2435 43.7931 0.0000 171.6931 127 P 4.1120 0.0000 0.0000 64.1686 31.5572 176.2027 128 S 4.7699 7.3085 113.8900 56.7645 64.1352 172.6295 129 S 4.4343 8.8065 121.9262 60.1868 64.6112 174.4356 130 G 4.3630 8.1117 111.5624 46.0190 0.0000 172.7531 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 G 8.35 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 2 S 8.90 3.95 0.00 3.95 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 3 S 8.04 4.22 0.00 3.83 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 4 G 8.31 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 5 S 8.47 4.38 0.00 3.85 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 6 S 8.65 4.69 0.00 3.88 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 7 G 8.97 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 8 E 9.08 3.78 0.00 2.05 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 0.00 2.25 2.28 0.00 9 N 8.08 4.03 0.00 2.68 2.73 0.00 0.00 7.26 7.69 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 10 P 0.00 4.65 0.00 2.12 2.07 0.00 3.77 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 11 R 8.12 4.51 0.00 1.77 1.84 0.00 3.57 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 12 N 8.83 4.12 0.00 3.15 2.97 0.00 0.00 7.01 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 13 V 6.93 4.15 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 0.03 0.00 0.00 0.79 0.00 0.00 14 G 8.11 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 0.00 0.00 0.00 15 S 8.33 4.05 0.00 3.85 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 16 L 8.11 4.45 0.00 1.68 1.60 0.96 1.06 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 17 D 8.49 4.36 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.52 4.29 0.00 1.93 2.09 0.00 1.63 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 19 T 7.75 4.24 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 20 S 7.52 4.71 0.00 4.01 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 21 K 8.33 4.49 0.00 1.93 2.01 0.00 1.56 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.42 7.81 22 N 8.33 4.75 0.00 3.18 3.23 0.00 0.00 5.82 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 23 V 6.78 5.12 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 1.11 0.00 0.00 1.00 0.00 0.00 24 G 8.70 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 0.00 0.00 0.00 25 T 8.53 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 1.24 0.00 0.00 26 G 9.47 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 L 8.65 5.34 0.00 1.65 1.59 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 28 V 9.01 4.36 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 0.87 0.00 0.00 1.02 0.00 0.00 29 G 9.09 4.71 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 0.00 0.00 0.00 30 A 8.31 4.92 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 31 P 0.00 4.07 0.00 2.19 2.20 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 32 A 7.49 4.12 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 33 C 7.86 3.63 0.00 2.67 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.44 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 0.00 0.00 0.00 35 D 7.53 5.85 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.28 4.42 2.42 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 1.16 0.00 0.00 1.00 0.00 0.00 37 M 8.61 4.65 0.00 2.29 1.97 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 38 K 9.22 4.66 0.00 1.94 1.71 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.44 7.81 39 L 9.06 5.19 0.00 1.78 1.58 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.86 5.07 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.47 2.33 0.00 41 I 8.21 4.93 1.83 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.60 0.91 0.00 0.00 42 Q 9.06 4.64 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 43 V 8.51 4.40 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 0.50 0.00 0.00 0.11 0.00 0.00 44 D 8.37 4.76 0.00 2.81 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 45 E 8.68 4.08 0.00 2.14 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 0.00 2.29 2.35 0.00 46 K 7.93 4.02 0.00 1.77 1.92 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.44 7.81 47 G 8.29 3.98 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 0.00 0.00 0.00 48 K 7.72 4.44 0.00 1.73 1.63 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.36 7.81 49 I 8.41 4.05 2.15 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 1.22 1.15 0.94 0.00 0.00 50 V 8.27 3.97 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 0.76 0.00 0.00 0.98 0.00 0.00 51 D 7.79 5.09 0.00 2.67 2.44 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 52 A 8.49 5.18 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 53 R 9.23 4.89 0.00 1.70 1.72 0.00 3.33 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 54 F 8.57 5.40 0.00 3.07 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 55 K 8.66 3.82 0.00 1.65 1.49 0.00 0.95 0.00 0.00 1.29 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 0.48 7.81 56 T 7.60 4.85 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 1.21 0.00 0.00 57 F 9.16 4.96 0.00 2.94 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 58 G 9.14 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 59 C 8.74 4.40 0.00 3.15 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 60 G 8.98 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 3.97 0.00 3.84 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 62 A 7.89 3.94 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 63 I 8.17 3.98 2.00 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 1.36 1.85 1.02 0.00 0.00 64 A 8.08 3.92 1.22 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 0.00 0.00 65 S 8.01 3.80 0.00 3.84 3.81 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 66 S 8.04 3.90 0.00 3.93 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 67 S 6.76 2.79 0.00 3.72 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 68 L 7.61 3.69 0.00 1.38 1.36 0.68 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.40 3.49 1.15 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 70 T 8.06 3.97 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 1.10 0.00 0.00 71 E 7.35 3.96 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 72 W 8.36 4.68 0.00 3.39 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 73 V 7.88 3.86 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 1.09 0.00 0.00 0.99 0.00 0.00 74 K 7.00 4.18 0.00 1.80 1.78 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.50 1.65 7.81 75 G 8.58 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 76 K 7.58 4.33 0.00 2.02 1.74 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.41 7.81 77 T 7.86 4.75 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 78 V 7.78 3.63 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 0.72 0.00 0.00 1.03 0.00 0.00 79 E 8.05 4.01 0.00 1.94 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 2.33 2.42 0.00 80 E 7.82 4.07 0.00 2.13 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 2.32 2.46 0.00 81 A 7.94 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.49 3.97 0.00 1.83 1.79 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 83 T 7.89 4.12 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 1.25 0.00 0.00 84 I 7.13 3.64 2.12 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.75 1.14 0.00 0.00 85 K 8.26 4.68 0.00 1.93 1.73 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.47 7.81 86 N 8.62 4.65 0.00 2.91 3.07 0.00 0.00 5.63 7.23 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 87 T 8.00 3.88 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 1.23 0.00 0.00 88 D 8.21 4.42 0.00 2.97 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 89 I 7.37 3.55 1.97 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.89 0.68 0.00 0.00 90 A 8.25 3.91 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 91 K 7.65 3.89 0.00 1.80 2.09 0.00 1.84 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.46 7.81 92 E 8.25 4.13 0.00 2.25 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 0.00 2.59 2.45 0.00 93 L 8.01 4.06 0.00 1.58 1.65 0.79 1.04 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 94 C 7.75 4.01 0.00 3.12 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 95 L 7.58 4.34 0.00 1.70 1.62 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.55 0.00 2.24 2.24 0.00 3.68 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 1.95 0.00 97 P 0.00 4.39 0.00 2.20 2.22 0.00 3.76 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 1.95 0.00 98 V 7.73 3.92 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 0.72 0.00 0.00 0.95 0.00 0.00 99 K 7.60 4.66 0.00 1.76 1.80 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.54 7.81 100 L 8.17 4.05 0.00 1.72 1.71 0.98 0.98 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 0.00 101 H 8.46 4.05 0.00 3.35 3.60 0.00 5.46 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 C 7.29 3.95 0.00 3.11 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 0.00 103 S 7.83 3.91 0.00 3.88 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 0.00 104 M 8.00 4.11 0.00 2.28 2.33 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 2.71 2.80 0.00 105 L 7.81 3.87 0.00 2.06 1.85 0.93 1.20 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 0.00 106 A 7.93 3.88 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 0.00 107 E 7.71 3.85 0.00 2.09 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 0.00 2.34 2.50 0.00 108 D 8.38 4.35 0.00 2.95 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 0.00 109 A 7.97 3.96 1.41 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 0.00 0.00 0.00 110 I 7.77 3.58 2.03 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 1.54 1.56 0.99 0.00 0.00 111 K 8.27 3.80 0.00 1.89 1.88 0.00 1.83 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.55 7.81 112 A 8.10 3.99 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 0.00 113 A 8.16 4.02 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 0.00 114 L 8.17 3.96 0.00 1.68 1.83 0.89 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.48 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.65 4.34 0.00 2.78 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 0.00 117 Y 8.05 4.16 0.00 3.10 3.29 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 0.00 118 K 8.48 3.77 0.00 2.02 1.81 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.19 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.84 7.81 119 L 8.07 4.17 0.00 1.75 1.73 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 120 K 7.30 4.28 0.00 1.62 1.81 0.00 1.68 0.00 0.00 1.55 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.54 7.81 121 Q 7.85 4.00 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.81 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 122 E 8.00 4.53 0.00 2.16 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 0.00 2.33 2.32 0.00 123 S 8.37 4.64 0.00 3.91 3.98 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 0.00 124 K 8.77 4.04 0.00 1.87 1.96 0.00 1.50 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.42 7.81 125 S 7.74 4.69 0.00 3.78 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 0.00 126 G 8.02 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 0.00 127 P 0.00 4.11 0.00 2.19 2.19 0.00 3.73 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 1.98 1.95 0.00 128 S 7.31 4.77 0.00 3.67 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 0.00 129 S 8.81 4.43 0.00 3.87 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 0.00 130 G 8.11 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 0.00 0.00 0.00 0.00