NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4212 8.3349 115.2896 58.4349 63.6494 173.0976 5 E 4.4990 8.3010 123.5036 55.3139 30.2066 176.6640 6 I 3.6886 7.8698 122.4967 64.0463 38.7316 177.4824 7 R 3.8489 7.8878 119.1305 59.5165 30.0968 178.6142 8 K 3.9927 7.9969 117.7016 59.0123 31.9435 179.0977 9 L 3.9370 7.9636 120.8823 58.2186 42.0394 178.9825 10 L 3.9843 8.0803 119.0671 57.7443 41.4773 179.2635 11 Q 3.9517 8.2832 119.6386 59.3165 28.9994 178.1479 12 E 3.9646 8.3533 120.2545 59.0966 29.6286 178.7289 13 I 3.7788 8.0545 120.4192 64.3705 37.1402 178.3101 14 K 3.9747 8.3140 120.5456 59.2694 31.7926 178.5708 15 K 3.8994 7.9948 119.1789 59.7718 32.3664 178.4887 16 Q 4.1960 8.3716 118.2346 59.0014 28.4783 178.7076 17 V 3.5916 7.8800 118.2093 66.1142 31.6127 177.4686 18 D 4.6571 8.3567 117.3190 55.8539 42.0893 176.7613 19 N 5.0313 7.6315 116.9420 51.9293 40.2670 171.8411 20 P 4.5501 0.0000 0.0000 62.4685 32.9230 176.5632 21 G 4.2599 8.8928 108.7092 43.9539 0.0000 173.0975 22 N 4.5179 8.7775 115.8310 55.0028 38.6518 176.2667 23 S 4.6284 7.8081 111.7656 57.9316 64.2252 175.7443 24 S 4.1376 7.9280 119.1541 62.5604 62.6158 176.8218 25 T 3.5350 7.5311 111.3387 64.7661 68.5365 176.5527 26 T 3.8520 7.6683 118.3567 66.5062 68.5120 176.4080 27 E 3.9673 8.3040 120.6787 59.3794 29.3700 179.5072 28 I 3.6423 7.6753 119.9479 64.0431 37.0349 178.3397 29 K 3.8542 8.0034 120.5155 59.2894 31.9574 178.6875 30 K 3.8646 8.0111 119.8096 59.7845 32.0222 178.3547 31 M 3.9630 8.2207 118.3037 58.5248 32.0645 178.0111 32 A 3.9658 8.2101 121.0631 55.1205 18.5716 179.3923 33 S 4.0085 8.2887 111.9298 61.8294 62.2986 176.4143 34 E 3.9942 8.2993 119.2287 58.5278 29.2332 178.1735 35 A 4.5036 7.5495 118.8576 51.1703 19.4142 177.6237 36 G 3.8418 7.8190 105.1207 45.9922 0.0000 173.6402 37 I 4.2187 7.6152 119.9276 59.2322 38.5596 175.8676 38 D 4.3336 8.6854 122.9586 55.0686 41.8381 177.3476 39 E 3.9805 8.8191 126.8452 59.4191 29.5536 178.9895 40 Q 3.9746 8.0330 119.4060 59.4993 29.2435 178.3645 41 T 3.8878 8.2790 110.5833 64.5042 68.8409 176.4694 42 A 3.9746 7.8562 123.3330 55.2028 18.4658 179.5180 43 E 4.0072 8.3895 117.2131 59.3497 29.4242 179.0525 44 E 4.0196 8.5065 119.6579 59.5086 29.6959 179.0392 45 I 3.7029 7.8404 119.7509 64.4518 37.1716 177.6638 46 Y 3.9971 7.8849 120.1794 61.1933 38.5851 178.1073 47 H 4.0991 8.4563 117.0020 58.6140 28.7323 177.8518 48 L 3.9776 8.2969 121.3709 57.6002 41.3822 179.2563 49 L 3.6512 8.2438 120.6881 58.1906 41.9487 179.0762 50 T 3.5775 7.4773 115.6104 66.5698 68.3338 176.3944 51 E 4.1823 7.9166 121.6200 58.7939 29.4270 179.0237 52 F 4.3622 8.3033 120.8049 61.9126 39.4969 176.9094 53 Y 3.9227 7.9618 116.1157 60.8769 37.0926 178.5334 54 Q 3.9492 8.0993 119.1672 58.7071 28.5801 178.4105 55 A 4.3647 8.1289 122.6636 54.5750 18.6870 179.3760 56 V 3.2987 7.6742 116.9684 66.2779 31.4369 178.1490 57 E 3.9010 7.9494 117.9235 59.3540 29.1412 178.9282 58 E 4.1735 8.1357 117.6685 58.2460 29.2269 177.6622 59 H 4.9074 8.0144 115.6955 55.3013 29.5002 175.8977 60 G 3.8400 7.3577 109.4458 44.5182 0.0000 173.9428 61 G 3.9266 8.1113 105.7291 44.1024 0.0000 174.7432 62 I 3.6207 8.4422 118.5973 64.0393 37.7562 177.6724 63 E 3.7878 8.0080 119.4669 59.2064 29.4361 178.4544 64 K 3.9354 7.9642 117.8638 59.5980 32.5536 177.6713 65 Y 4.2730 8.4076 120.2477 60.9398 38.6065 177.5028 66 M 3.7879 7.9877 118.1413 57.4581 32.0446 176.7064 67 H 4.7932 7.1136 113.2090 55.1784 30.1384 174.6347 68 S 4.3663 7.4057 114.7146 58.2262 63.9057 173.3451 69 N 4.7193 8.6497 117.7278 54.0764 39.6977 174.0935 70 I 4.6373 7.1926 118.7520 60.4624 38.1015 175.6695 71 S 4.1799 9.3316 123.3483 60.5189 63.0147 174.3656 72 W 5.5881 8.0462 117.6366 55.1387 33.7005 174.5101 73 L 5.0546 9.0953 122.8404 53.2501 43.2914 177.7096 74 K 3.8951 9.3970 123.2301 60.0982 32.0004 179.2336 75 I 3.8942 7.8406 118.0843 63.9897 37.8389 177.2638 76 E 3.4891 8.0814 119.9624 59.0435 29.5076 178.6346 77 L 3.9290 8.1902 119.1726 57.5211 41.6473 179.2286 78 E 3.9653 8.2582 118.7666 59.2794 29.3444 179.1060 79 L 3.9781 8.2183 120.5897 57.9352 42.1383 178.5797 80 L 4.1903 8.3160 120.4918 58.5938 42.0355 179.1859 81 S 4.2085 8.2764 114.6851 61.6245 62.7818 176.6505 82 A 4.0715 8.1583 123.4641 55.2667 18.1336 179.5609 83 C 4.1260 8.6224 115.6438 63.2506 28.1890 175.9390 84 Y 3.7076 8.2336 118.2981 60.9681 37.3674 178.6245 85 Q 4.0433 8.2883 118.9427 59.1892 28.7821 178.9370 86 I 3.7338 7.9477 119.2806 63.9034 38.0043 177.8107 87 A 3.9958 8.0014 121.8331 55.0555 18.1818 179.7056 88 I 3.7119 8.1076 118.7566 64.5229 36.9653 178.6922 89 L 4.1206 7.8549 118.7969 57.1275 41.3625 178.1301 90 E 4.4615 7.5426 117.0602 55.8519 29.7326 176.0333 91 D 4.5126 7.8204 116.4520 55.5137 38.9473 173.9162 92 M 4.3709 7.8340 118.3383 54.6309 33.0705 177.2081 93 K 4.2887 8.2931 121.3798 55.7044 34.5108 178.3678 94 V 3.6316 8.4550 122.1541 66.4472 31.5211 178.1702 95 L 4.1815 8.0300 119.2190 58.5338 41.8053 178.5788 96 D 4.4012 8.0414 118.2307 57.1400 40.7862 178.7162 97 I 3.5251 7.7063 120.4573 64.4076 36.8650 178.4789 98 S 4.0977 7.8145 114.6340 61.5319 62.9857 176.2702 99 E 4.0613 8.0902 121.6025 59.5134 29.5091 178.2432 100 M 4.2695 8.0676 119.7750 58.2110 32.4078 178.1140 101 L 4.3015 8.1234 118.3212 56.3668 42.0146 177.4552 102 S 5.1862 7.7853 113.8256 56.9559 64.4391 174.8485 103 L 4.1132 8.4252 119.9304 57.6067 41.2231 178.6755 104 N 4.6854 8.0358 115.0061 54.8557 40.2809 174.9739 105 D 4.8295 8.8156 115.2954 54.7943 43.0818 176.9638 106 L 3.9787 5.6884 122.9682 55.7730 42.5731 177.5318 107 R 4.3486 7.4554 114.1518 57.1928 28.8977 177.3957 108 I 3.9262 7.4668 116.5766 63.2018 37.3429 176.8146 109 F 5.2379 8.0920 116.8893 55.1465 41.7944 173.6845 110 P 4.8057 0.0000 0.0000 62.5969 31.2545 175.5830 111 K 4.8235 7.5899 116.7404 54.9258 36.6461 176.7118 112 T 4.6308 9.1139 112.3828 60.6039 71.1724 174.1530 113 P 4.4805 0.0000 0.0000 65.9836 31.2538 179.2473 114 S 4.2700 8.0683 113.5618 61.5436 62.9534 176.4292 115 Q 4.1844 8.1565 120.7154 58.9625 28.4114 178.9716 116 L 4.1710 8.1229 119.8958 58.0281 41.8097 179.4240 117 Q 4.0052 8.6295 119.8708 59.2972 29.0292 177.8897 118 N 4.4617 8.7288 118.0040 56.7594 38.5308 177.6026 119 T 3.7203 7.8565 116.6834 66.3815 68.4174 176.1217 120 Y 3.6387 7.8533 121.6402 60.9600 38.6489 178.0554 121 Y 3.7008 7.6276 117.2870 60.6529 37.8473 178.4723 122 K 3.9252 7.9948 119.7523 59.1174 32.1248 179.1455 123 L 3.7778 7.7966 120.8353 58.0792 41.7715 179.2778 124 K 3.8291 7.4326 117.2807 58.7169 32.0115 178.3874 125 K 4.1452 7.9213 117.2488 55.6204 32.3726 176.0508 126 E 3.7585 7.5490 115.5633 58.2502 27.4097 175.5726 127 L 4.2496 8.1891 120.0263 56.0956 42.2063 177.1780 128 I 4.6555 7.2165 110.0980 59.1159 40.6037 174.1436 129 Q 4.5148 8.2036 119.7422 54.0290 31.0013 176.8243 130 V 3.8377 7.9585 119.9143 62.0317 29.8271 174.3462 131 E 4.8108 7.8480 121.7423 54.7715 32.2025 175.0711 132 D 4.7509 8.9453 120.0679 55.1988 41.7353 176.3001 133 I 4.6517 9.1105 124.2502 58.8573 39.5834 173.6030 134 P 4.8775 0.0000 0.0000 62.2519 32.7457 176.5705 135 K 4.2839 8.7960 121.8586 55.9645 31.9859 176.7234 136 N 4.5904 8.6339 123.4030 52.5654 39.3988 175.7859 137 K 4.2361 8.3775 122.2508 55.3050 33.0551 175.5503 138 P 4.4915 0.0000 0.0000 61.7928 33.0362 176.2797 139 G 4.0168 8.6217 103.6121 45.2554 0.0000 173.6866 140 R 4.0647 8.1237 118.4788 56.1021 30.7040 176.8725 141 K 4.3272 8.2145 119.4209 55.3354 33.1904 177.2529 142 R 4.0339 8.3225 122.4953 55.7672 30.7621 176.5934 143 K 4.0848 8.6536 121.6740 57.4345 32.3056 176.5510 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 4 S 8.33 4.42 0.00 3.84 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 5 E 8.30 4.50 0.00 2.08 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 2.29 2.30 0.00 6 I 7.87 3.69 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 1.38 1.43 0.89 0.00 0.00 7 R 7.89 3.85 0.00 1.90 1.90 0.00 3.23 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 1.70 1.72 0.00 8 K 8.00 3.99 0.00 1.95 1.84 0.00 2.02 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.49 7.81 9 L 7.96 3.94 0.00 1.77 1.83 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.08 3.98 0.00 1.86 1.71 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.28 3.95 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 12 E 8.35 3.96 0.00 2.22 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 2.30 2.39 0.00 13 I 8.05 3.78 2.07 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 1.47 0.69 1.01 0.00 0.00 14 K 8.31 3.97 0.00 1.85 1.99 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.21 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.67 1.65 7.81 15 K 7.99 3.90 0.00 1.92 2.05 0.00 1.87 0.00 0.00 2.04 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.51 7.81 16 Q 8.37 4.20 0.00 2.47 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 17 V 7.88 3.59 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 0.74 0.00 0.00 0.63 0.00 0.00 18 D 8.36 4.66 0.00 2.85 2.72 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 19 N 7.63 5.03 0.00 2.65 2.69 0.00 0.00 7.19 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 20 P 0.00 4.55 0.00 2.30 2.20 0.00 3.80 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 2.02 1.99 0.00 21 G 8.89 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 22 N 8.78 4.52 0.00 2.72 2.89 0.00 0.00 6.74 7.57 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 23 S 7.81 4.63 0.00 3.95 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 24 S 7.93 4.14 0.00 3.90 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 25 T 7.53 3.54 4.11 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 0.84 0.00 0.00 26 T 7.67 3.85 4.34 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 1.18 0.00 0.00 27 E 8.30 3.97 0.00 2.10 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 2.30 2.44 0.00 28 I 7.68 3.64 1.80 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.62 0.86 0.00 0.00 29 K 8.00 3.85 0.00 2.09 1.92 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.48 7.81 30 K 8.01 3.86 0.00 1.93 1.94 0.00 1.68 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 31 M 8.22 3.96 0.00 2.10 2.03 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 2.59 2.55 0.00 32 A 8.21 3.97 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 33 S 8.29 4.01 0.00 4.09 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 34 E 8.30 3.99 0.00 1.96 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 2.34 2.64 0.00 35 A 7.55 4.50 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 36 G 7.82 3.84 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 0.00 0.00 0.00 37 I 7.62 4.22 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 1.48 0.79 0.91 0.00 0.00 38 D 8.69 4.33 0.00 2.79 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 39 E 8.82 3.98 0.00 2.05 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 2.53 2.36 0.00 40 Q 8.03 3.97 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 41 T 8.28 3.89 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 1.25 0.00 0.00 42 A 7.86 3.97 1.42 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 43 E 8.39 4.01 0.00 2.18 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 2.54 2.47 0.00 44 E 8.51 4.02 0.00 2.12 2.16 0.00 0.00 0.00 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 2.39 0.00 45 I 7.84 3.70 2.06 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 1.43 0.49 0.90 0.00 0.00 46 Y 7.88 4.00 0.00 3.04 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 47 H 8.46 4.10 0.00 3.39 3.35 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 48 L 8.30 3.98 0.00 1.76 1.68 0.94 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.24 3.65 0.00 1.53 1.48 0.10 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.48 3.58 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 1.08 0.00 0.00 51 E 7.92 4.18 0.00 2.21 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 2.37 0.00 52 F 8.30 4.36 0.00 2.94 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 53 Y 7.96 3.92 0.00 2.81 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 54 Q 8.10 3.95 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.67 0.00 55 A 8.13 4.36 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 56 V 7.67 3.30 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 0.89 0.00 0.00 0.08 0.00 0.00 57 E 7.95 3.90 0.00 2.15 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 2.44 2.43 0.00 58 E 8.14 4.17 0.00 2.13 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 2.29 2.62 0.00 59 H 8.01 4.91 0.00 3.24 3.41 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.36 3.84 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 0.00 0.00 0.00 61 G 8.11 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 62 I 8.44 3.62 1.71 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 1.44 1.38 0.83 0.00 0.00 63 E 8.01 3.79 0.00 2.05 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 2.41 2.37 0.00 64 K 7.96 3.94 0.00 1.78 1.99 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.66 7.81 65 Y 8.41 4.27 0.00 3.01 3.10 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 0.00 66 M 7.99 3.79 0.00 1.82 1.82 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 2.81 2.51 0.00 67 H 7.11 4.79 0.00 3.21 3.23 0.00 5.68 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.41 4.37 0.00 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 0.00 69 N 8.65 4.72 0.00 2.88 2.83 0.00 0.00 6.81 8.05 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 70 I 7.19 4.64 1.99 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.81 1.14 0.00 0.00 71 S 9.33 4.18 0.00 3.88 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 72 W 8.05 5.59 0.00 3.31 3.09 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 0.00 0.00 0.00 73 L 9.10 5.05 0.00 1.93 1.70 0.71 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.40 3.90 0.00 1.92 1.88 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.61 7.81 75 I 7.84 3.89 1.94 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 1.59 1.35 1.08 0.00 0.00 76 E 8.08 3.49 0.00 1.88 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 2.82 1.57 0.00 77 L 8.19 3.93 0.00 1.87 1.58 0.94 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.26 3.97 0.00 2.23 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 2.34 2.52 0.00 79 L 8.22 3.98 0.00 1.76 1.88 0.82 0.18 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 80 L 8.32 4.19 0.00 1.82 1.77 0.27 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.28 4.21 0.00 4.06 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 82 A 8.16 4.07 1.42 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 83 C 8.62 4.13 0.00 3.32 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 84 Y 8.23 3.71 0.00 2.90 2.67 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 85 Q 8.29 4.04 0.00 2.35 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 86 I 7.95 3.73 1.89 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 1.46 1.36 1.00 0.00 0.00 87 A 8.00 4.00 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 88 I 8.11 3.71 2.09 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 1.56 0.85 0.96 0.00 0.00 89 L 7.85 4.12 0.00 1.81 1.74 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.54 4.46 0.00 2.03 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 2.45 2.48 0.00 91 D 7.82 4.51 0.00 2.83 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 92 M 7.83 4.37 0.00 1.98 2.11 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 2.60 2.48 0.00 93 K 8.29 4.29 0.00 1.81 1.75 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.50 7.81 94 V 8.46 3.63 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 1.28 0.00 0.00 1.09 0.00 0.00 95 L 8.03 4.18 0.00 1.84 1.69 0.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.04 4.40 0.00 2.88 2.68 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 0.00 0.00 0.00 0.00 97 I 7.71 3.53 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.77 -0.04 0.00 0.00 98 S 7.81 4.10 0.00 4.04 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 99 E 8.09 4.06 0.00 2.13 2.18 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 2.31 2.37 0.00 100 M 8.07 4.27 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.45 0.00 101 L 8.12 4.30 0.00 1.79 2.06 0.58 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.79 5.19 0.00 4.26 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 0.00 103 L 8.43 4.11 0.00 1.70 1.81 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.04 4.69 0.00 2.81 3.03 0.00 0.00 6.66 8.21 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 0.00 105 D 8.82 4.83 0.00 2.71 2.56 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 0.00 106 L 5.69 3.98 0.00 1.92 1.74 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 107 R 7.46 4.35 0.00 2.05 2.04 0.00 3.28 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 108 I 7.47 3.93 2.07 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 1.36 0.94 0.39 0.00 0.00 109 F 8.09 5.24 0.00 3.17 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 0.00 110 P 0.00 4.81 0.00 2.23 2.20 0.00 4.31 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 111 K 7.59 4.82 0.00 1.83 1.76 0.00 1.17 0.00 0.00 1.50 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 0.96 7.81 112 T 9.11 4.63 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 1.26 0.00 0.00 113 P 0.00 4.48 0.00 2.23 2.19 0.00 3.64 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 2.27 2.22 0.00 114 S 8.07 4.27 0.00 3.92 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 0.00 115 Q 8.16 4.18 0.00 2.38 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 116 L 8.12 4.17 0.00 2.00 1.87 1.00 0.60 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 0.00 117 Q 8.63 4.01 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 118 N 8.73 4.46 0.00 2.89 2.91 0.00 0.00 7.06 6.68 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 0.00 119 T 7.86 3.72 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 0.00 120 Y 7.85 3.64 0.00 2.16 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 0.00 121 Y 7.63 3.70 0.00 3.13 2.89 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 0.00 0.00 0.00 122 K 7.99 3.93 0.00 1.83 1.76 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.58 7.81 123 L 7.80 3.78 0.00 1.68 1.48 0.74 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.43 3.83 0.00 1.60 1.63 0.00 0.61 0.00 0.00 0.62 0.00 0.00 2.80 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.95 0.53 7.81 125 K 7.92 4.15 0.00 1.84 1.75 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.43 7.81 126 E 7.55 3.76 0.00 2.12 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 2.18 2.20 0.00 127 L 8.19 4.25 0.00 1.55 1.69 0.89 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 128 I 7.22 4.66 1.80 0.00 0.00 0.62 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 0.51 0.86 0.00 0.00 129 Q 8.20 4.51 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.39 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 130 V 7.96 3.84 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 0.80 0.00 0.00 0.88 0.00 0.00 131 E 7.85 4.81 0.00 1.98 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 2.13 2.29 0.00 132 D 8.95 4.75 0.00 2.63 2.76 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 0.00 133 I 9.11 4.65 2.15 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 1.55 0.97 1.03 0.00 0.00 134 P 0.00 4.88 0.00 2.11 2.09 0.00 3.82 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 2.02 2.03 0.00 135 K 8.80 4.28 0.00 1.61 1.82 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.35 7.81 136 N 8.63 4.59 0.00 2.73 2.76 0.00 0.00 7.21 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 0.00 137 K 8.38 4.24 0.00 1.75 1.74 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.43 7.81 138 P 0.00 4.49 0.00 2.18 2.10 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 139 G 8.62 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 0.00 140 R 8.12 4.06 0.00 1.81 1.89 0.00 3.20 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 141 K 8.21 4.33 0.00 1.74 1.73 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.36 7.81 142 R 8.32 4.03 0.00 1.77 1.83 0.00 3.25 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 143 K 8.65 4.08 0.00 1.90 1.80 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.45 7.81