NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.4314 8.0385 120.6276 54.2703 43.7111 178.5412 23 A 3.8048 8.3205 123.4371 55.2745 18.0802 178.4250 24 D 4.3166 8.9118 118.8868 57.3425 41.2498 177.4466 25 S 4.1383 8.4222 115.6675 61.6284 62.9198 176.7206 26 K 3.8743 8.3149 121.0416 59.6590 31.8346 179.1775 27 A 4.0440 8.1707 121.0195 55.1459 18.2178 180.1053 28 V 3.6775 8.1029 117.8129 64.8209 31.5633 178.5017 29 L 4.1766 8.2842 119.7957 57.8562 41.5416 179.1224 30 N 4.2046 8.3530 116.8555 56.4108 38.7421 176.6967 31 Q 4.2397 8.4877 121.0118 59.2060 29.1560 178.0477 32 A 4.2046 8.6061 122.1770 55.3254 18.5695 179.6705 33 V 3.5525 7.9914 116.3811 66.1279 31.6410 178.0311 34 A 4.1975 8.3267 120.2604 55.6286 18.3357 179.4577 35 D 4.4020 8.5119 117.4441 57.3988 40.8352 179.0552 36 L 4.2672 8.5811 120.0978 57.6888 41.4551 179.6463 37 S 3.8752 7.7623 115.0823 61.4009 62.5518 176.8810 38 V 3.6067 7.6766 120.7590 65.7414 31.1960 177.9138 39 A 3.9988 8.4982 121.0844 55.2890 18.1195 178.9713 40 H 3.9681 8.4712 116.8964 59.5165 29.8895 177.2604 41 S 4.0963 7.8466 114.7629 61.5021 62.1520 176.1662 42 I 3.6369 7.8546 122.2873 64.5453 36.9040 178.4074 43 L 3.9263 8.1065 119.9274 58.0605 41.3636 179.2036 44 H 3.7773 8.1793 118.4778 58.8502 29.6020 176.9939 45 Q 4.1935 8.1315 121.6804 59.2770 28.7249 178.6146 46 V 3.6196 7.9783 119.2858 66.1617 31.3500 177.1894 47 H 4.0966 8.0109 116.9399 59.3806 29.6637 176.7333 48 W 4.7942 7.9555 118.9388 59.3170 29.3705 177.4928 49 Y 4.3710 8.5623 114.7694 57.2007 37.8691 175.3354 50 M 4.4353 7.5593 121.0939 55.9111 32.9551 175.6831 51 R 4.6145 8.8255 123.5820 54.8296 34.6048 174.0845 52 G 4.1991 8.9615 107.2451 42.7389 0.0000 172.8870 53 R 4.2175 8.2249 119.7766 57.3705 30.3928 177.3900 54 G 4.2980 9.4424 109.9568 45.4530 0.0000 175.0669 55 F 4.1299 8.6410 122.2077 61.9380 39.0754 176.7787 56 M 4.1780 8.2659 115.5289 57.9841 31.9193 177.1336 57 I 3.7968 7.5228 118.1503 62.9645 38.6178 177.3358 58 W 4.3098 8.0586 119.5588 59.3648 28.7421 177.8556 59 H 3.8870 8.2467 119.2774 58.7215 29.1131 175.4684 60 P 4.0362 0.0000 0.0000 65.6559 31.0409 178.0502 61 K 3.5386 7.4675 118.2066 59.4609 31.9657 178.4403 62 M 4.0388 7.9793 118.8847 58.5188 31.8592 178.1639 63 D 4.1825 7.3820 118.4177 57.6263 41.0153 179.0510 64 E 3.8985 7.7346 118.3475 59.5388 29.3955 179.0654 65 Y 4.4634 7.8244 116.7305 61.4789 37.9144 178.4714 66 M 4.0606 8.6526 119.8718 58.4462 32.1064 178.5630 67 E 3.9120 8.2514 118.6405 59.4358 29.7343 179.1658 68 E 3.6604 8.1400 119.1122 59.1633 29.6791 178.7732 69 I 3.7948 8.1016 120.2174 64.7416 37.2602 178.1476 70 D 4.4603 8.5477 120.0759 57.1323 40.5416 179.2608 71 G 3.4336 7.8223 106.0903 48.0463 0.0000 175.2243 72 Y 4.3199 7.2190 119.7365 60.6134 37.8923 178.7922 73 L 4.0189 8.1072 121.1676 58.2372 42.1672 178.5587 74 D 4.3161 8.1908 118.0078 57.3227 41.1810 177.8040 75 E 3.8907 8.2134 119.8990 59.5152 29.6539 178.7459 76 M 3.9364 8.3228 119.0983 58.1977 32.0228 178.6768 77 S 4.0985 8.1645 113.3446 61.5139 62.5779 176.1323 78 E 4.0033 8.5369 121.4279 58.9751 29.1486 179.3215 79 R 3.8387 8.0138 119.3000 59.1008 30.1516 178.1888 80 L 3.9282 7.9395 120.1785 58.1822 42.0396 178.9129 81 I 3.6621 7.8512 119.6955 64.9501 36.8811 178.6203 82 T 3.9003 7.8519 114.9468 66.1996 68.2866 175.7509 83 L 4.4141 7.6901 118.4747 54.4612 41.7661 177.3920 84 G 3.8008 8.0792 107.3613 45.8915 0.0000 174.3772 85 G 3.8231 8.2013 109.5139 44.0546 0.0000 174.0908 86 A 4.4474 7.9840 121.2931 49.1521 19.7701 173.9658 87 P 4.4019 0.0000 0.0000 62.9536 32.0829 176.9950 88 F 4.7864 8.1096 120.1725 58.8908 39.2713 176.4459 89 S 4.8235 8.9147 121.0787 56.3018 63.3231 174.4918 90 T 4.5011 6.7866 109.4404 60.1193 73.0533 173.3452 91 L 4.0666 8.2912 122.1983 57.6951 41.6864 179.8222 92 K 3.8932 7.7957 119.2793 59.5471 32.1546 178.5721 93 E 3.7237 7.6170 118.9628 59.2247 29.2790 179.4355 94 F 4.4952 7.6382 117.8306 60.7830 38.8091 177.7449 95 S 4.1485 8.0118 111.4837 61.3845 62.3025 175.6408 96 E 4.1148 8.1392 119.8938 58.3433 29.3482 177.9093 97 N 4.5645 7.5004 115.0441 53.5161 39.7960 175.8028 98 S 4.4654 7.4746 114.4807 58.4458 62.9251 173.8839 99 Q 4.2354 8.7747 124.7191 56.3475 29.0152 176.0319 100 L 4.0109 7.7459 122.0060 54.2209 42.4801 176.8246 101 K 4.4695 8.3021 124.6856 52.9272 33.2943 173.0224 102 E 4.5872 8.5318 123.2935 54.1064 31.0152 175.9555 103 V 4.4252 7.8443 115.5072 58.8382 34.4231 175.6128 104 L 3.8872 8.4388 121.6545 55.0132 41.9755 177.9223 105 G 2.5542 8.0634 111.0455 45.4525 0.0000 172.8450 106 D 4.3612 7.3224 121.4377 52.8379 43.3295 175.5838 107 Y 4.7470 8.6445 124.3291 59.9072 38.1268 176.4096 108 N 4.6117 8.4285 117.1071 54.2809 39.3765 175.2781 109 V 3.7732 7.2345 117.2168 63.5149 32.2909 176.2482 110 T 4.3375 8.2052 116.6550 60.9719 71.1656 175.7758 111 I 3.6803 8.2934 122.9695 64.9409 37.1535 178.3974 112 E 3.8264 8.1304 118.5698 59.4822 29.2858 178.9940 113 E 3.8712 8.4105 119.3807 59.1524 29.6824 178.8805 114 Q 3.9229 8.2956 118.4654 58.9999 28.7253 178.8266 115 L 3.6730 7.8733 119.7410 57.5393 41.4889 179.3892 116 A 3.8523 8.0528 120.9009 55.0171 18.2345 179.6852 117 R 3.7203 7.9206 117.3738 59.4696 30.1294 179.0006 118 V 3.2202 7.4029 118.0206 65.6340 31.3724 177.9984 119 V 3.4207 7.6392 118.2404 65.9890 31.4427 177.4306 120 E 3.8902 8.1758 118.9356 59.4219 29.4656 179.0255 121 V 3.6409 7.8094 118.0551 66.0796 31.5250 178.0179 122 F 4.4201 8.6790 118.0010 60.7106 38.7327 177.7159 123 R 3.9438 8.9047 118.3378 59.5197 29.7837 178.5014 124 Y 3.9313 7.9776 118.6942 60.6344 38.7509 178.0103 125 L 3.3945 8.0901 119.7018 57.4804 41.6364 179.3528 126 A 3.8652 8.1140 120.8362 54.8842 18.2735 179.5049 127 A 3.7755 7.7224 119.2884 55.2060 18.3733 179.6323 128 L 3.6445 7.4892 119.1214 58.2760 42.0257 179.2522 129 F 4.5713 8.1477 118.0417 60.2413 38.7196 177.5858 130 Q 3.9076 8.2313 119.6233 59.0929 28.8197 178.2041 131 K 3.9198 7.9646 119.6547 59.6111 32.0861 179.5366 132 G 2.2357 7.8359 105.9200 47.0173 0.0000 175.5392 133 F 3.9719 8.0317 123.0935 61.0821 39.4133 176.8379 134 D 4.4091 8.5105 118.8382 57.5821 40.8196 179.0597 135 V 3.5455 7.8610 118.9263 66.0305 31.3959 178.2021 136 S 4.3977 7.9381 115.3137 60.5474 62.8169 176.0119 137 D 4.1040 7.8801 121.8278 57.2301 40.7317 178.0395 138 E 3.9554 8.0807 118.0161 58.9277 29.5393 178.2365 139 E 4.4201 7.9015 115.4760 55.4437 29.8805 176.9194 140 G 3.8398 7.3545 107.0819 46.6730 0.0000 175.2726 141 D 4.5989 7.8200 121.7706 52.9560 39.2425 176.5996 142 S 4.1351 8.0446 119.9861 60.3889 63.6123 176.7098 143 V 3.4893 7.6106 121.6712 66.3588 31.4779 177.9330 144 T 3.8093 7.7092 114.4511 66.5237 68.2059 176.0395 145 N 4.4034 8.0282 120.3880 56.1852 38.8430 176.4624 146 D 4.3637 8.0947 119.3769 57.2067 41.3311 177.8941 147 I 3.5299 7.5510 120.3047 64.7509 37.1732 178.3802 148 F 3.8172 7.8641 118.1064 60.3205 38.6608 177.3886 149 N 4.3589 8.3389 116.8993 56.6248 38.6823 177.1695 150 V 3.5348 8.0711 119.7371 65.9010 31.6511 177.8040 151 A 3.3401 7.4145 121.7397 54.1695 17.9339 179.5615 152 K 4.0280 8.0288 117.8781 59.4551 32.3688 178.6001 153 A 3.9705 8.0483 121.2290 55.5344 18.2821 179.6752 154 S 4.0714 7.8750 111.2885 61.5356 62.4738 176.3526 155 I 3.5460 7.8165 122.5669 64.3627 36.8027 178.3151 156 E 4.0191 8.4136 119.5601 59.0838 29.2764 179.0965 157 K 4.2090 8.0007 119.2980 60.1692 32.2783 178.5144 158 H 4.4589 8.3522 116.2562 58.9707 28.5408 177.7782 159 I 3.8263 8.2171 121.7805 64.1142 36.8977 178.0475 160 W 4.3991 8.4528 129.0824 61.0408 30.5450 177.9552 161 M 3.2704 7.9068 118.3077 57.9375 31.4253 178.7411 162 L 3.9674 8.4611 119.4065 58.0641 41.7799 179.5863 163 Q 3.9916 8.4191 117.9617 58.8933 28.6374 178.7975 164 A 4.0203 8.3663 122.1744 55.2752 18.1952 179.2614 165 E 4.0253 8.1215 116.5931 59.0618 29.7190 178.0190 166 L 4.4944 7.4830 116.4265 54.1100 41.7560 177.0552 167 G 3.9309 7.9658 106.4541 46.2857 0.0000 173.7035 168 Q 4.6493 8.1130 116.7298 53.1351 32.3422 175.3764 169 A 4.3811 8.3174 122.2171 51.3727 19.1702 176.3203 170 P 4.3549 0.0000 0.0000 64.0354 32.0860 177.3172 171 K 3.8124 8.0918 115.6962 57.3430 29.4831 174.6564 172 L 4.1858 7.6561 120.7666 55.1723 41.5090 177.8455 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 22 L 8.04 4.43 0.00 1.72 1.74 0.97 0.56 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 23 A 8.32 3.80 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 24 D 8.91 4.32 0.00 2.96 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 25 S 8.42 4.14 0.00 4.07 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 26 K 8.31 3.87 0.00 1.99 1.86 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.65 7.81 27 A 8.17 4.04 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 28 V 8.10 3.68 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 1.02 0.00 0.00 0.81 0.00 0.00 29 L 8.28 4.18 0.00 1.96 1.79 0.95 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.35 4.20 0.00 2.72 2.51 0.00 0.00 6.87 6.25 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 31 Q 8.49 4.24 0.00 2.47 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 32 A 8.61 4.20 1.70 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 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.99 3.55 2.40 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 1.24 0.00 0.00 1.06 0.00 0.00 34 A 8.33 4.20 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 35 D 8.51 4.40 0.00 2.89 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 36 L 8.58 4.27 0.00 1.76 1.79 1.16 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.76 3.88 0.00 3.33 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 38 V 7.68 3.61 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 1.02 0.00 0.00 1.04 0.00 0.00 39 A 8.50 4.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.47 3.97 0.00 3.32 3.49 0.00 5.80 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.85 4.10 0.00 3.92 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 42 I 7.85 3.64 1.97 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.50 0.85 0.00 0.00 43 L 8.11 3.93 0.00 1.75 1.67 1.08 1.26 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 44 H 8.18 3.78 0.00 2.95 2.63 0.00 5.61 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.13 4.19 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 46 V 7.98 3.62 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 0.94 0.00 0.00 0.95 0.00 0.00 47 H 8.01 4.10 0.00 3.10 3.24 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 7.96 4.79 0.00 3.68 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 49 Y 8.56 4.37 0.00 3.09 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 50 M 7.56 4.44 0.00 2.34 2.38 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.72 0.00 51 R 8.83 4.61 0.00 1.91 1.81 0.00 3.33 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 2.01 0.00 52 G 8.96 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 53 R 8.22 4.22 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.44 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 0.00 0.00 0.00 55 F 8.64 4.13 0.00 3.41 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 56 M 8.27 4.18 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 57 I 7.52 3.80 1.66 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.29 0.67 0.00 0.00 58 W 8.06 4.31 0.00 3.55 3.18 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 59 H 8.25 3.89 0.00 1.88 2.72 0.00 5.79 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.04 0.00 2.17 2.23 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 61 K 7.47 3.54 0.00 1.60 1.87 0.00 0.97 0.00 0.00 1.12 0.00 0.00 2.65 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.16 0.71 7.81 62 M 7.98 4.04 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.02 0.00 63 D 7.38 4.18 0.00 2.91 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.73 3.90 0.00 1.84 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 0.00 2.22 2.35 0.00 65 Y 7.82 4.46 0.00 3.18 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 8.65 4.06 0.00 1.84 2.08 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.33 0.00 67 E 8.25 3.91 0.00 2.12 1.96 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 2.48 2.42 0.00 68 E 8.14 3.66 0.00 2.04 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 1.85 2.05 0.00 69 I 8.10 3.79 2.06 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.84 1.01 0.00 0.00 70 D 8.55 4.46 0.00 2.85 2.70 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 0.00 0.00 0.00 0.00 71 G 7.82 3.43 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 0.00 72 Y 7.22 4.32 0.00 3.21 2.83 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 73 L 8.11 4.02 0.00 1.87 1.86 0.81 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.19 4.32 0.00 2.83 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 75 E 8.21 3.89 0.00 2.12 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 0.00 2.25 2.30 0.00 76 M 8.32 3.94 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.00 0.00 77 S 8.16 4.10 0.00 3.96 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 78 E 8.54 4.00 0.00 2.14 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 2.32 2.35 0.00 79 R 8.01 3.84 0.00 1.96 2.01 0.00 3.11 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 80 L 7.94 3.93 0.00 1.78 1.83 0.93 0.89 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 81 I 7.85 3.66 2.02 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 1.52 0.60 0.91 0.00 0.00 82 T 7.85 3.90 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 1.20 0.00 0.00 83 L 7.69 4.41 0.00 1.77 1.69 1.00 0.71 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 84 G 8.08 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 0.00 0.00 0.00 85 G 8.20 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 0.00 0.00 0.00 86 A 7.98 4.45 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 87 P 0.00 4.40 0.00 2.24 2.05 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 88 F 8.11 4.79 0.00 3.42 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 89 S 8.91 4.82 0.00 3.99 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 90 T 6.79 4.50 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 1.13 0.00 0.00 91 L 8.29 4.07 0.00 1.71 1.81 1.00 0.90 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 92 K 7.80 3.89 0.00 1.76 1.71 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.49 7.81 93 E 7.62 3.72 0.00 1.80 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 2.22 2.23 0.00 94 F 7.64 4.50 0.00 3.24 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 95 S 8.01 4.15 0.00 4.13 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 96 E 8.14 4.11 0.00 1.93 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 2.30 2.43 0.00 97 N 7.50 4.56 0.00 2.43 2.74 0.00 0.00 6.93 8.91 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 98 S 7.47 4.47 0.00 4.09 3.78 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 99 Q 8.77 4.24 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.55 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 100 L 7.75 4.01 0.00 1.48 1.44 0.89 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.30 4.47 0.00 1.76 1.59 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.28 1.01 7.81 102 E 8.53 4.59 0.00 1.92 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 2.22 2.29 0.00 103 V 7.84 4.43 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 0.69 0.00 0.00 0.85 0.00 0.00 104 L 8.44 3.89 0.00 1.54 1.53 0.90 0.87 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 0.00 105 G 8.06 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 0.00 0.00 0.00 106 D 7.32 4.36 0.00 2.57 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 0.00 107 Y 8.64 4.75 0.00 3.12 3.04 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 0.00 108 N 8.43 4.61 0.00 2.75 3.00 0.00 0.00 7.11 7.07 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 0.00 109 V 7.23 3.77 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 0.91 0.00 0.00 0.97 0.00 0.00 110 T 8.21 4.34 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 0.00 111 I 8.29 3.68 1.89 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 1.85 1.11 0.87 0.00 0.00 112 E 8.13 3.83 0.00 1.97 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 2.34 2.35 0.00 113 E 8.41 3.87 0.00 1.99 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 2.26 2.30 0.00 114 Q 8.30 3.92 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 115 L 7.87 3.67 0.00 1.51 1.27 -0.19 -0.29 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 0.00 116 A 8.05 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 0.00 117 R 7.92 3.72 0.00 1.97 2.10 0.00 3.08 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 118 V 7.40 3.22 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 -0.12 0.00 0.00 0.78 0.00 0.00 119 V 7.64 3.42 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 0.99 0.00 0.00 0.93 0.00 0.00 120 E 8.18 3.89 0.00 2.13 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 2.29 2.32 0.00 121 V 7.81 3.64 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 1.10 0.00 0.00 0.92 0.00 0.00 122 F 8.68 4.42 0.00 3.17 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 0.00 123 R 8.90 3.94 0.00 2.03 2.02 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 124 Y 7.98 3.93 0.00 3.12 3.16 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 0.00 0.00 0.00 125 L 8.09 3.39 0.00 1.67 0.98 1.00 0.67 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 0.00 126 A 8.11 3.87 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 0.00 127 A 7.72 3.78 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 0.00 128 L 7.49 3.64 0.00 1.05 1.25 0.92 1.06 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 0.00 129 F 8.15 4.57 0.00 3.16 3.18 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 0.00 130 Q 8.23 3.91 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 131 K 7.96 3.92 0.00 1.91 1.75 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.58 7.81 132 G 7.84 2.24 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 0.00 0.00 0.00 0.00 133 F 8.03 3.97 0.00 3.27 3.18 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 0.00 134 D 8.51 4.41 0.00 2.87 2.70 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 0.00 0.00 0.00 0.00 135 V 7.86 3.55 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 1.05 0.00 0.00 0.93 0.00 0.00 136 S 7.94 4.40 0.00 4.30 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 0.00 137 D 7.88 4.10 0.00 2.50 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 0.00 138 E 8.08 3.96 0.00 2.10 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 2.33 2.47 0.00 139 E 7.90 4.42 0.00 1.94 1.96 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 2.27 2.50 0.00 140 G 7.35 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 0.00 141 D 7.82 4.60 0.00 2.71 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 0.00 142 S 8.04 4.14 0.00 4.05 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 0.00 143 V 7.61 3.49 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 1.02 0.00 0.00 0.91 0.00 0.00 144 T 7.71 3.81 4.42 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 1.42 0.00 0.00 145 N 8.03 4.40 0.00 2.68 2.80 0.00 0.00 6.55 8.60 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 0.00 146 D 8.09 4.36 0.00 2.85 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 0.00 147 I 7.55 3.53 1.67 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.71 0.50 0.00 0.00 148 F 7.86 3.82 0.00 3.17 3.24 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 0.00 149 N 8.34 4.36 0.00 3.38 3.00 0.00 0.00 6.80 7.81 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 0.00 150 V 8.07 3.53 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 0.99 0.00 0.00 0.99 0.00 0.00 151 A 7.41 3.34 -0.24 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 0.00 0.00 0.00 152 K 8.03 4.03 0.00 2.07 2.01 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.41 1.48 7.81 153 A 8.05 3.97 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 0.00 154 S 7.87 4.07 0.00 3.95 4.07 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 0.00 155 I 7.82 3.55 1.90 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.77 0.69 0.00 0.00 156 E 8.41 4.02 0.00 2.10 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 2.34 2.43 0.00 157 K 8.00 4.21 0.00 2.08 2.02 0.00 1.74 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.79 1.88 7.81 158 H 8.35 4.46 0.00 3.51 3.52 0.00 5.68 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 0.00 159 I 8.22 3.83 2.15 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.13 1.00 0.00 0.00 160 W 8.45 4.40 0.00 3.40 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 M 7.91 3.27 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.03 0.00 162 L 8.46 3.97 0.00 1.71 1.60 0.67 0.52 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 0.00 163 Q 8.42 3.99 0.00 2.34 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.49 2.75 0.00 164 A 8.37 4.02 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 0.00 165 E 8.12 4.03 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 2.37 2.45 0.00 166 L 7.48 4.49 0.00 1.78 1.63 0.81 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 167 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 0.00 168 Q 8.11 4.65 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 169 A 8.32 4.38 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 0.00 170 P 0.00 4.35 0.00 2.13 2.29 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.36 0.00 171 K 8.09 3.81 0.00 1.86 1.83 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.60 7.81 172 L 7.66 4.19 0.00 1.63 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00