NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.5968 8.4293 116.1984 55.1510 30.2762 173.2379 2 C 4.1337 7.6433 113.9131 56.8605 30.1639 172.2561 3 D 4.5587 8.3582 118.5947 54.9714 40.2486 175.3049 4 L 4.0701 8.0286 120.4692 57.1932 42.2284 175.6910 5 P 4.5757 0.0000 0.0000 62.1297 32.4240 175.3712 6 C 4.2170 8.4320 113.6110 58.1378 30.5008 174.9095 7 G 3.9272 8.3064 107.5908 45.4095 0.0000 172.7910 8 V 4.3567 7.2298 118.6501 60.9450 33.1501 174.3441 9 Y 4.6929 8.1555 123.3885 56.7418 42.1173 174.5293 10 D 3.6732 7.8829 118.5125 51.7635 43.4882 174.5901 11 P 4.0842 0.0000 0.0000 64.6121 31.1529 178.0925 12 A 4.0209 8.4450 120.3969 54.9188 17.6306 179.6791 13 Q 3.7657 8.0156 116.6963 59.0421 28.7327 178.7899 14 A 4.0616 7.7427 121.2571 55.0431 18.4644 179.3916 15 R 3.8372 8.0815 117.2690 59.7599 30.2999 178.7646 16 I 3.7247 8.0343 119.8188 64.5151 37.0693 178.3523 17 E 4.0155 7.9937 118.1881 59.2990 29.2906 179.2460 18 A 4.0708 8.2586 120.9249 55.0836 18.2989 179.5619 19 E 3.9633 8.5423 117.7524 59.6284 29.4065 179.7204 20 S 4.1105 7.9364 114.8905 61.3489 62.8572 176.6701 21 V 3.5640 7.7879 121.0076 66.0422 31.2164 178.0245 22 K 4.0930 8.0806 118.9224 59.5183 32.0545 178.5192 23 A 4.0074 8.3033 121.3086 55.2897 18.2321 179.7357 24 I 3.7387 8.1541 118.6465 64.6167 37.0395 178.6533 25 Q 4.0243 8.1442 118.9669 58.9976 28.3792 178.7505 26 E 4.0115 8.4557 119.7598 59.4459 29.5283 179.6151 27 K 4.1120 8.1766 118.5007 59.5305 31.9192 179.2050 28 M 4.4912 8.1799 117.8333 57.6128 31.9070 177.7480 29 A 4.3198 7.7812 119.6361 53.0247 19.0546 177.5666 30 A 4.4471 7.5880 118.5595 51.6707 19.5724 176.5763 31 N 4.5464 7.7962 115.7788 53.2161 39.9344 173.2014 32 D 4.7747 8.6100 124.8895 53.2142 40.1646 176.6997 33 D 4.4274 8.5134 120.7256 54.4843 42.5513 176.2641 34 L 3.9349 8.6547 128.4403 59.0019 42.1209 179.0829 35 H 4.1421 8.3196 115.3759 58.6389 28.6768 177.5112 36 F 4.1807 8.7298 122.6737 61.3799 39.2668 177.1931 37 Q 3.8688 8.3691 117.7727 58.8703 28.3862 178.9830 38 I 3.6334 7.8886 120.8033 64.5036 37.1240 178.6986 39 R 3.8193 8.0802 118.7430 59.1384 29.7818 178.9789 40 A 3.7184 7.9958 120.8049 55.3447 18.2726 179.8816 41 T 3.7233 7.8259 114.1699 66.6217 68.4739 177.0897 42 V 3.5386 7.9030 120.3458 66.2151 31.5265 178.2271 43 I 3.9979 7.9037 121.0867 63.6118 36.8993 178.3007 44 K 3.8844 8.2885 120.8751 59.3481 31.9591 178.4147 45 E 3.9047 8.1759 119.6187 59.3776 29.6836 178.9015 46 Q 3.9638 7.8581 117.6092 59.1788 28.8434 179.0589 47 R 4.0539 8.2468 118.9484 59.0371 30.0123 179.0060 48 A 4.0194 8.2239 120.8657 54.9990 18.3335 179.2710 49 E 3.8694 8.2117 117.9094 59.4664 29.6661 179.0912 50 L 3.9457 7.9778 118.8294 57.6523 41.6429 179.3550 51 A 4.0577 8.1599 120.7676 55.1015 18.2488 179.8186 52 K 3.9260 8.2686 117.1138 59.7516 32.0794 178.9740 53 H 4.1445 8.3774 118.4924 59.7299 29.8743 176.9377 54 H 4.1917 8.3016 117.9996 58.9848 28.5067 177.8552 55 L 4.0976 8.0798 120.7416 57.8645 41.4409 179.1546 56 D 4.5574 8.5471 119.3269 57.4821 40.7140 179.1289 57 V 3.7409 8.0872 118.7751 65.9392 31.4728 178.0792 58 L 3.9320 8.0035 118.6584 57.5429 41.2593 179.3701 59 W 4.5897 8.4772 127.4060 60.6525 30.8209 177.7998 60 S 4.0177 8.8035 113.3497 60.3019 62.8610 175.0719 61 D 4.7343 8.3057 120.8163 55.8843 41.9646 177.3784 62 Y 3.3727 7.4911 118.1842 60.1030 38.9880 175.6598 63 F 3.9702 7.8708 118.2602 57.2217 39.4787 175.0638 64 K 4.5938 8.0804 123.5798 53.3758 35.4133 175.1134 65 P 4.4548 0.0000 0.0000 65.9472 31.0554 177.0731 66 P 4.2602 0.0000 0.0000 65.8498 31.0955 178.4256 67 H 4.3523 7.9607 115.0636 58.9869 28.4107 177.9389 68 F 4.2906 7.7147 117.7765 60.2498 38.8101 177.2132 69 E 4.1928 8.0163 118.0251 59.5236 29.4169 179.1162 70 S 4.2715 8.1338 114.1213 59.9176 64.1530 174.1230 71 Y 4.6285 8.0909 120.1869 54.5788 37.6978 174.1179 72 P 4.4352 0.0000 0.0000 64.9463 31.8550 177.8809 73 E 4.4627 8.1037 117.1244 56.3473 30.3807 177.3866 74 L 3.9036 8.2453 122.3119 58.4609 42.0407 178.3510 75 H 4.3861 8.3577 115.5539 59.5010 28.7150 177.6985 76 T 3.7960 7.9224 116.7868 66.3558 68.3185 176.2279 77 L 3.7141 8.0411 122.3226 58.2576 42.1633 179.3315 78 V 3.5580 7.9208 118.2130 65.8770 31.4346 177.4592 79 N 4.0605 8.1126 116.9249 56.6689 38.6940 176.7849 80 E 3.7977 8.4296 120.2074 58.8780 29.4574 179.1972 81 A 4.0376 7.6443 120.9442 55.3898 18.5244 180.1990 82 V 3.6191 7.7969 110.9134 64.4002 31.5673 179.0548 83 K 4.0008 8.0947 118.2187 59.2078 31.8353 179.2670 84 A 4.0999 8.2123 121.4313 55.1003 18.3000 179.7079 85 L 4.0070 7.8760 117.4842 58.0164 41.4244 179.8688 86 S 4.1402 8.1401 115.0327 61.5072 62.5064 176.6101 87 A 3.9971 7.9272 122.5114 54.9892 18.4491 179.2667 88 A 4.2359 8.0226 120.7911 54.5405 18.1754 179.9542 89 K 3.9441 7.9579 116.3240 59.2750 32.1615 178.3463 90 A 4.5055 7.3439 118.0569 51.1754 18.9647 176.6173 91 S 4.6377 7.2528 112.2131 57.6985 65.6343 173.9530 92 T 4.3562 8.3217 113.1863 61.2724 69.5485 173.8359 93 D 4.5231 8.2278 124.2719 53.2341 41.4052 175.0229 94 P 4.6123 0.0000 0.0000 64.8215 31.2513 178.3019 95 A 3.9835 8.6499 120.3898 55.1659 18.0518 179.7556 96 T 3.9812 8.2971 108.9291 64.8950 68.9368 177.2585 97 G 3.5851 8.1307 108.2017 47.4356 0.0000 175.2903 98 Q 3.9469 8.3670 122.2066 58.8238 29.1104 178.1951 99 K 3.6810 8.1550 120.4435 59.3546 32.1670 178.6045 100 A 4.1169 7.8348 120.7123 55.2616 18.3301 179.5782 101 L 3.9758 7.9535 117.5087 58.0801 41.6515 179.5746 102 D 4.3246 8.3261 119.1299 57.5417 40.7318 178.4575 103 Y 4.3938 7.7834 117.2409 61.1337 37.7939 178.4438 104 I 3.7927 8.1599 120.6830 64.3892 37.1873 178.3401 105 A 4.0973 8.2898 121.6578 55.2011 18.2368 179.7587 106 Q 4.0274 7.9935 116.2966 59.2261 28.7352 178.9930 107 I 3.8109 8.0294 120.9363 64.2554 37.1399 177.9451 108 D 4.3580 8.6094 119.4588 57.1925 41.2092 178.2221 109 K 4.1294 8.1975 120.1335 59.7285 32.2621 178.8555 110 I 3.5479 7.6763 119.5871 64.0761 36.9699 177.9152 111 F 3.9640 8.6029 121.9234 61.4319 39.2140 177.4368 112 W 4.2150 8.2788 118.0303 59.5237 28.6402 178.5156 113 E 4.1190 8.1676 118.9117 59.5421 28.7199 179.2625 114 T 4.0370 7.7704 108.5552 64.2169 68.9651 176.5838 115 K 4.0765 7.3862 120.9234 58.7869 32.1418 179.0356 116 K 4.1748 7.9420 118.3811 59.8570 32.7349 176.8741 117 A 4.1744 7.6272 126.5707 52.0439 18.2785 176.8383 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 H 8.43 4.60 0.00 3.25 3.30 0.00 5.48 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.64 4.13 0.00 3.10 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 3 D 8.36 4.56 0.00 2.87 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 4 L 8.03 4.07 0.00 1.59 1.74 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.58 0.00 2.28 2.09 0.00 3.81 0.00 0.00 3.72 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 6 C 8.43 4.22 0.00 3.00 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 7 G 8.31 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 8 V 7.23 4.36 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 0.89 0.00 0.00 0.92 0.00 0.00 9 Y 8.16 4.69 0.00 2.73 2.36 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 10 D 7.88 3.67 0.00 2.58 2.36 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 11 P 0.00 4.08 0.00 2.28 1.89 0.00 2.94 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 1.36 1.14 0.00 12 A 8.44 4.02 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 13 Q 8.02 3.77 0.00 1.80 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 14 A 7.74 4.06 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 15 R 8.08 3.84 0.00 1.90 2.08 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 16 I 8.03 3.72 1.86 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 1.52 1.08 0.91 0.00 0.00 17 E 7.99 4.02 0.00 2.19 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 0.00 2.56 2.55 0.00 18 A 8.26 4.07 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 19 E 8.54 3.96 0.00 2.17 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 2.56 2.50 0.00 20 S 7.94 4.11 0.00 4.09 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 21 V 7.79 3.56 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 1.00 0.00 0.00 0.96 0.00 0.00 22 K 8.08 4.09 0.00 1.89 1.79 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 23 A 8.30 4.01 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 24 I 8.15 3.74 2.01 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 1.53 0.75 0.90 0.00 0.00 25 Q 8.14 4.02 0.00 2.29 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 26 E 8.46 4.01 0.00 2.18 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 2.56 2.51 0.00 27 K 8.18 4.11 0.00 2.17 2.18 0.00 1.77 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.68 7.81 28 M 8.18 4.49 0.00 2.03 2.32 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 2.88 2.45 0.00 29 A 7.78 4.32 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 30 A 7.59 4.45 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 31 N 7.80 4.55 0.00 2.28 2.23 0.00 0.00 7.08 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 32 D 8.61 4.77 0.00 2.83 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 33 D 8.51 4.43 0.00 2.80 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 34 L 8.65 3.93 0.00 1.78 1.63 0.88 1.01 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 35 H 8.32 4.14 0.00 3.47 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.73 4.18 0.00 3.17 3.27 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 37 Q 8.37 3.87 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 38 I 7.89 3.63 1.98 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 1.47 0.81 0.88 0.00 0.00 39 R 8.08 3.82 0.00 1.84 1.91 0.00 3.16 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 40 A 8.00 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.83 3.72 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 1.17 0.00 0.00 42 V 7.90 3.54 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 1.01 0.00 0.00 0.92 0.00 0.00 43 I 7.90 4.00 1.87 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 1.37 0.90 0.89 0.00 0.00 44 K 8.29 3.88 0.00 1.82 1.97 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.18 3.90 0.00 2.29 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 2.29 2.39 0.00 46 Q 7.86 3.96 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 47 R 8.25 4.05 0.00 1.82 2.09 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.22 4.02 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 49 E 8.21 3.87 0.00 2.19 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 2.29 2.38 0.00 50 L 7.98 3.95 0.00 1.92 1.69 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.16 4.06 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 52 K 8.27 3.93 0.00 2.01 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.64 7.81 53 H 8.38 4.14 0.00 3.22 3.44 0.00 5.79 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 54 H 8.30 4.19 0.00 3.37 3.28 0.00 5.67 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 55 L 8.08 4.10 0.00 1.88 1.77 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.55 4.56 0.00 2.91 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 57 V 8.09 3.74 2.30 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 1.27 0.00 0.00 0.92 0.00 0.00 58 L 8.00 3.93 0.00 2.09 1.72 0.79 0.35 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 W 8.48 4.59 0.00 3.45 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 60 S 8.80 4.02 0.00 4.05 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 61 D 8.31 4.73 0.00 3.00 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 62 Y 7.49 3.37 0.00 1.43 2.38 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 63 F 7.87 3.97 0.00 2.89 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 0.00 0.00 0.00 64 K 8.08 4.59 0.00 1.45 1.54 0.00 1.41 0.00 0.00 1.64 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.33 7.81 65 P 0.00 4.45 0.00 2.15 2.17 0.00 3.56 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 2.12 2.26 0.00 66 P 0.00 4.26 0.00 1.96 2.03 0.00 3.35 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 67 H 7.96 4.35 0.00 2.96 3.16 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 68 F 7.71 4.29 0.00 3.17 3.02 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 69 E 8.02 4.19 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 2.38 2.54 0.00 70 S 8.13 4.27 0.00 3.88 3.46 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 71 Y 8.09 4.63 0.00 3.01 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 72 P 0.00 4.44 0.00 2.21 2.23 0.00 3.81 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 2.02 2.00 0.00 73 E 8.10 4.46 0.00 2.08 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 2.38 2.27 0.00 74 L 8.25 3.90 0.00 1.80 1.83 0.54 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.36 4.39 0.00 3.25 3.34 0.00 5.68 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 76 T 7.92 3.80 4.37 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 1.17 0.00 0.00 77 L 8.04 3.71 0.00 1.80 1.82 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.92 3.56 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 0.93 0.00 0.00 1.14 0.00 0.00 79 N 8.11 4.06 0.00 2.70 2.75 0.00 0.00 7.22 7.20 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 80 E 8.43 3.80 0.00 1.48 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 2.16 2.30 0.00 81 A 7.64 4.04 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 82 V 7.80 3.62 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 0.86 0.00 0.00 0.90 0.00 0.00 83 K 8.09 4.00 0.00 1.95 1.83 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.47 7.81 84 A 8.21 4.10 1.59 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 85 L 7.88 4.01 0.00 1.92 1.74 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.14 4.14 0.00 4.05 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 87 A 7.93 4.00 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 88 A 8.02 4.24 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 89 K 7.96 3.94 0.00 1.96 2.03 0.00 1.69 0.00 0.00 1.94 0.00 0.00 3.22 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.34 4.51 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 91 S 7.25 4.64 0.00 3.79 3.74 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 92 T 8.32 4.36 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 1.20 0.00 0.00 93 D 8.23 4.52 0.00 2.70 2.59 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 94 P 0.00 4.61 0.00 2.20 2.22 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 95 A 8.65 3.98 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 96 T 8.30 3.98 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 1.21 0.00 0.00 97 G 8.13 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 98 Q 8.37 3.95 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 99 K 8.15 3.68 0.00 1.92 1.88 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 1.18 7.81 100 A 7.83 4.12 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 0.00 101 L 7.95 3.98 0.00 1.89 1.73 0.97 1.16 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 0.00 102 D 8.33 4.32 0.00 2.54 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 0.00 103 Y 7.78 4.39 0.00 3.20 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 0.00 104 I 8.16 3.79 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.92 0.94 0.00 0.00 105 A 8.29 4.10 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 0.00 106 Q 7.99 4.03 0.00 2.45 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.45 2.65 0.00 107 I 8.03 3.81 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.89 1.09 0.00 0.00 108 D 8.61 4.36 0.00 2.85 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 0.00 109 K 8.20 4.13 0.00 1.98 2.03 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.69 1.59 7.81 110 I 7.68 3.55 1.87 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.77 -0.09 0.00 0.00 111 F 8.60 3.96 0.00 3.00 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 0.00 112 W 8.28 4.21 0.00 3.56 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 0.00 113 E 8.17 4.12 0.00 2.32 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 0.00 2.45 2.56 0.00 114 T 7.77 4.04 4.10 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 0.00 0.00 1.29 0.00 0.00 115 K 7.39 4.08 0.00 1.96 1.94 0.00 1.50 0.00 0.00 1.01 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.38 0.39 7.81 116 K 7.94 4.17 0.00 2.00 2.19 0.00 1.69 0.00 0.00 1.91 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.64 7.81 117 A 7.63 4.17 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