NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9689 8.3393 109.7487 45.0874 0.0000 172.9127 3 P 4.3645 0.0000 0.0000 61.1975 32.4513 173.9718 4 N 4.5595 8.3713 117.7494 51.6995 39.6531 175.6493 5 P 3.2846 0.0000 0.0000 62.0825 29.6363 174.9386 *7 K 3.9689 7.3615 116.3315 57.2981 33.4883 175.8527 *9 Y 4.4907 8.1739 116.4417 58.0920 37.7517 172.9950 10 P 4.4670 0.0000 0.0000 64.9609 31.7450 177.4760 11 I 4.2923 7.4977 120.2421 59.7518 38.1029 176.4731 12 E 3.8093 8.8305 125.1337 58.7584 29.8960 178.4928 13 G 3.6544 8.1205 107.2364 47.5113 0.0000 173.5822 14 N 4.9695 7.4654 117.2908 51.5161 38.5057 175.4442 15 K 3.7995 7.9669 117.7673 58.8652 33.4443 178.4574 16 S 4.3570 7.9393 113.7805 60.4617 63.5449 174.0807 17 V 4.4811 8.3322 120.4917 62.5574 32.1650 175.7013 18 Q 4.5901 9.3404 126.5394 54.0165 32.4878 174.6849 19 F 5.5761 8.7006 122.1504 56.6524 39.8243 176.5069 20 I 4.0258 8.4142 119.3903 62.7017 37.6220 178.1018 21 K 3.8504 7.9095 120.9731 59.1810 32.2122 176.5144 22 P 4.3818 0.0000 0.0000 65.0301 31.5215 178.3862 23 I 3.8924 7.1033 119.7016 64.1904 37.1714 177.6788 24 L 4.3258 8.7622 118.5274 55.7129 41.2805 178.6488 25 E 3.9870 7.9336 122.4706 59.4971 29.5785 178.5348 26 K 4.0980 8.0360 119.0194 56.4965 32.0932 181.4056 27 L 4.5776 7.6338 116.7942 53.9518 43.3605 175.9454 28 E 4.2373 8.3849 120.5948 56.8864 30.6521 176.7194 29 N 4.1987 8.7449 118.4977 54.1677 36.2880 173.1398 30 V 4.6558 7.1176 116.2692 61.3835 33.5103 175.3065 31 E 4.5254 9.3769 127.8599 54.6947 31.9931 173.8603 32 V 4.7953 8.3608 119.5242 59.3713 34.4218 176.1263 33 G 4.1384 9.3012 112.8145 43.9402 0.0000 172.2325 34 E 4.1490 8.2611 117.9358 57.2665 30.6608 177.4419 35 Y 3.2050 8.1365 120.1768 57.2285 35.9537 169.5287 36 S 5.2723 7.5814 116.8480 58.4090 64.1448 172.9261 37 Y 5.4156 8.5012 119.9740 55.7949 41.9682 172.9334 38 Y 4.9064 9.7086 122.3091 55.8017 42.2905 173.6818 39 D 5.1854 7.6721 125.9745 52.2321 43.3360 175.1628 40 S 4.1771 8.2457 121.8735 56.9049 63.5705 175.1270 41 K 3.7923 8.9983 126.8480 59.3896 31.9513 176.2395 42 N 4.8965 8.5355 111.7099 52.4000 42.6232 174.3898 43 G 4.0546 7.8329 103.9213 45.1638 0.0000 173.9006 44 E 4.1592 8.3603 120.0209 55.8852 30.4703 176.9377 45 T 5.1291 8.3946 112.6351 60.9777 69.7187 174.9189 46 F 3.8180 8.7978 123.8612 60.8376 38.8269 176.7090 47 D 3.7414 8.2934 118.6362 56.5511 38.4524 178.6603 48 K 4.0468 7.5269 117.6192 58.1506 32.4983 178.2086 49 Q 4.2007 8.3480 118.5297 55.2091 28.5960 175.0259 50 I 4.3272 6.4271 120.8684 59.6987 36.2752 174.9949 51 L 4.4052 8.5356 126.2786 54.0913 44.1506 176.7916 52 Y 2.9714 7.8130 118.2423 58.9403 34.9040 168.7416 53 H 4.4614 7.1420 120.6873 55.2636 28.7654 173.5486 54 Y 4.9768 7.8267 124.7377 55.4041 39.8314 175.0441 55 P 4.3087 0.0000 0.0000 65.8711 31.6929 178.1117 56 I 3.5493 8.0143 116.1196 64.0813 38.0190 176.4140 57 L 4.1824 8.0204 118.2041 55.0502 41.9437 176.3432 58 N 4.0603 8.8275 117.8555 53.9809 37.9526 173.3340 59 D 4.8156 7.5488 116.4780 53.0706 41.2613 176.5744 60 K 4.9749 8.4719 122.6688 53.4088 36.2501 174.8981 61 L 5.2815 8.7559 123.0914 54.7106 45.4203 175.9951 62 K 5.2434 9.0554 128.6386 53.5298 35.8949 172.5236 63 I 4.8724 9.1743 125.1765 58.7122 40.9223 175.8165 64 G 3.9696 8.0661 116.0736 45.7815 0.0000 172.3321 65 K 4.5317 8.3246 120.5052 54.8428 35.6596 176.4152 66 F 4.3392 7.7091 118.2313 59.0467 37.3072 175.0089 67 C 5.0581 8.3564 117.1435 58.9328 30.7060 173.7702 68 S 4.6514 8.9866 116.8601 56.8298 65.9205 173.2488 69 I 4.8043 7.7611 125.1089 59.4659 40.1493 176.1160 70 G 4.0494 8.5298 114.8981 44.1322 0.0000 170.9905 71 P 4.7513 0.0000 0.0000 63.6095 31.3642 177.6643 72 G 4.4167 9.2188 110.3265 46.4967 0.0000 172.7845 73 V 4.1833 7.6406 119.1232 62.9576 32.2211 175.5281 74 T 4.8266 8.6941 117.1598 59.8857 72.2179 172.8175 75 I 4.8421 8.6715 124.8067 59.8761 39.8863 175.1931 76 I 4.5325 8.9011 128.4776 60.4500 38.4742 176.5022 *78 N 4.4992 8.7005 120.3629 53.0938 41.0483 177.4809 79 G 3.9287 7.5794 101.6298 46.7451 0.0000 173.2688 80 A 3.9859 9.1816 120.5108 51.1727 19.0597 177.4017 81 N 5.0091 7.6392 113.9449 52.1338 42.0002 174.2847 82 H 4.3676 8.7280 119.5898 55.0450 29.6650 175.0349 83 R 3.9219 8.3667 122.4861 56.7481 30.1407 176.5648 *85 D 4.7838 8.4288 117.2906 52.6584 41.9064 175.6517 86 G 4.0875 7.3575 110.8052 45.0580 0.0000 174.3132 87 S 4.4009 8.7589 119.7631 58.0509 62.8924 173.8557 88 T 4.4528 8.2960 113.8612 62.7621 69.2945 173.8580 89 Y 3.9004 7.7847 123.2767 57.1589 38.4816 176.1288 90 P 4.5806 0.0000 0.0000 62.6987 29.8590 177.7291 91 F 4.4758 7.9544 120.5743 61.8247 39.2684 177.2939 92 N 4.7388 8.5487 115.9456 56.1683 36.6610 176.2262 93 L 4.2456 9.1887 118.7483 55.6863 41.9171 177.8237 94 F 4.5815 8.1936 116.8389 57.9235 40.8712 177.7907 95 G 3.8609 8.4487 105.3874 44.5386 0.0000 173.9688 96 N 4.3223 10.0123 112.0460 54.4238 35.4083 172.9012 97 G 4.2697 8.3588 106.7817 45.8912 0.0000 175.0731 98 W 4.7080 8.2336 118.1301 58.1290 29.5081 178.0234 99 E 4.2755 7.7633 118.8607 59.2939 28.9514 178.4860 100 K 4.1116 8.0189 115.9025 58.4052 32.9571 176.3421 101 H 4.6497 8.1704 118.3406 53.4292 29.6471 172.5723 *103 P 4.1095 0.0000 0.0000 63.0424 32.2742 177.1558 104 K 4.4137 8.2266 122.0918 53.1549 33.2773 176.0722 105 L 4.0101 8.5167 117.4141 59.5579 41.4912 180.3516 106 D 4.9020 7.9283 114.8437 53.8311 39.2478 176.9828 107 Q 4.3969 8.3694 119.4166 57.7732 31.6621 176.6008 108 L 4.1801 7.5304 116.7964 53.5182 42.1995 175.1731 109 P 4.1808 0.0000 0.0000 62.9000 31.5933 175.7604 110 I 4.1867 8.3705 125.5894 59.9835 37.9793 175.0942 111 K 4.1781 8.8458 129.8355 55.3486 32.5339 172.9777 112 G 3.7777 7.5972 101.6997 44.3119 0.0000 172.2983 113 D 4.9306 8.4938 118.7692 53.3042 44.0491 175.9154 114 T 5.0019 8.4779 116.4524 62.1536 71.0996 173.6353 115 I 4.9272 8.8226 128.2845 59.4824 39.8927 174.7256 116 I 4.5115 8.6269 128.6168 59.4008 39.7985 177.1720 117 G 4.1257 8.4042 114.9314 46.2004 0.0000 171.5507 118 N 4.6928 8.2288 117.4596 51.8684 41.2870 175.1453 119 D 5.3476 8.4485 119.0143 55.1409 40.4791 172.8999 120 V 4.7084 7.4834 116.9099 59.6088 33.6607 174.0696 121 W 5.3843 8.8824 135.0000 56.0689 32.2894 174.5803 122 I 4.5650 9.2919 128.7156 59.2561 38.9944 175.8434 123 G 3.5926 8.3258 114.0216 44.9358 0.0000 172.8629 124 K 4.0720 8.5721 120.7188 58.2654 32.6087 176.4311 125 D 4.9053 9.0662 123.9844 55.0443 39.0668 173.8720 126 V 4.1847 7.2837 117.8958 62.7619 33.2171 174.7570 127 V 4.7226 9.0418 125.6595 61.3396 33.9045 175.0346 128 I 4.5050 8.3710 128.4008 59.2238 40.0483 173.0820 *130 P 4.5597 0.0000 0.0000 63.6200 32.6150 177.8055 131 G 4.2953 7.8407 105.9993 45.7783 0.0000 173.1916 132 V 4.6666 7.2140 118.7449 60.2386 36.4183 176.6945 133 K 5.0384 9.1184 124.8887 53.6756 35.5781 175.8727 134 I 4.7465 8.9810 126.8796 58.2652 39.6996 176.0058 135 G 4.0411 9.6869 115.4172 45.7369 0.0000 172.5695 136 D 4.4212 8.6555 120.7480 55.5400 41.7988 178.0161 137 G 3.6622 8.9770 109.5349 44.9076 0.0000 173.3937 138 A 4.1922 7.3219 121.7761 51.7984 20.2603 177.0260 139 I 4.9081 8.0508 118.5865 59.7467 41.3859 174.6312 140 V 4.6389 8.6722 127.9187 60.7994 32.9049 175.3024 141 A 4.1898 8.7508 130.3243 51.4540 19.0682 176.8841 142 A 3.9907 8.2615 120.8389 52.3926 19.4086 176.9402 143 N 4.3129 8.3729 114.4669 53.3384 37.1241 174.8761 144 S 4.7480 7.7207 111.9320 57.5173 65.7365 174.2759 145 V 4.5834 8.4089 123.3343 61.3157 32.6919 174.4838 146 V 4.2225 9.0323 129.8456 62.3856 31.7042 175.8035 147 V 4.1965 8.3450 123.5300 63.5415 34.6466 175.0257 148 K 4.4693 7.6586 117.3636 54.5969 34.1401 175.2029 149 D 4.8019 8.2744 119.0052 54.6066 41.7597 176.3879 150 I 4.5557 8.8446 121.6200 59.2443 39.8983 175.5304 151 A 4.2382 8.9770 129.2475 51.0175 19.0914 175.4013 152 P 4.1872 0.0000 0.0000 63.7598 32.6820 176.7601 153 Y 3.7552 8.2188 113.1808 57.9077 34.6317 170.0461 *155 L 4.6323 7.9146 125.3014 54.7411 43.8066 175.1360 156 A 4.4367 8.2280 126.5004 49.5361 23.1213 174.8119 157 G 4.5866 8.5560 105.6367 45.8577 0.0000 171.1390 158 G 4.0694 8.4270 104.8624 44.1768 0.0000 172.6562 159 N 5.2125 8.1778 118.0115 51.6205 39.9545 172.7202 160 P 4.5563 0.0000 0.0000 62.0432 32.4032 176.2899 161 A 4.3885 8.4229 123.5613 52.7342 19.1458 177.2110 162 N 4.6903 8.7763 115.9410 52.0312 43.6098 173.8020 163 E 4.1120 9.0390 123.4497 57.8319 29.5564 177.0093 164 I 4.2329 9.9661 126.2753 62.7838 37.6608 176.4116 165 K 4.5180 7.5290 117.3606 55.5604 34.9754 174.9618 166 Q 4.3229 8.4650 119.7478 55.5286 29.3673 176.1707 167 R 3.8124 8.5640 123.3453 58.7205 30.2349 176.8923 168 F 5.1760 7.5481 112.8034 54.3176 43.1028 174.8789 169 D 4.4963 8.7747 122.6073 53.8653 40.5842 177.1118 170 Q 4.0160 8.9249 122.9773 60.4105 28.9105 178.5608 171 D 4.6390 8.2890 119.1454 57.0659 40.9289 178.4844 172 T 3.7796 10.0329 116.3084 67.0738 68.7506 176.4566 173 I 3.3710 8.2039 121.8265 64.4352 37.0282 177.8945 174 N 4.2518 8.8433 117.2656 56.8191 38.6176 177.2408 175 Q 4.0949 8.1222 118.8707 59.0294 28.9197 178.5013 176 L 3.7045 7.5385 119.3495 57.6301 41.3881 178.9518 177 L 4.4842 7.7438 116.2722 56.0105 41.7705 177.4211 178 D 4.7078 8.4736 118.4225 55.2944 42.3323 177.5050 179 I 3.9500 7.5529 112.1455 61.2562 39.8674 175.7890 180 K 2.0000 7.1800 118.5287 55.5798 29.3217 176.3116 181 W 2.0000 6.0443 116.1340 57.1324 28.3387 178.3241 182 W 3.9056 5.5602 114.7289 57.2758 28.1555 176.4944 183 N 4.8648 7.4768 115.2493 52.9968 38.7358 175.2457 184 W 4.7228 7.2409 118.2169 55.9112 29.7674 173.9519 185 P 4.5684 0.0000 0.0000 62.4570 31.6985 176.2414 186 I 3.8902 8.8973 122.2481 64.4411 38.3621 176.1972 187 D 4.6286 7.9048 120.3910 53.2028 37.7544 176.6063 *189 I 4.1995 7.4775 123.7703 63.0859 39.7557 179.2095 190 N 4.1796 8.4064 119.2422 56.7325 38.7962 176.8570 191 E 4.6290 7.0897 110.4524 54.0518 29.1195 177.8151 192 N 4.9359 9.3258 116.4082 53.9653 45.4939 177.4913 193 I 3.2783 8.1252 122.8125 65.1386 36.6339 178.5612 194 D 4.0379 8.1955 120.2957 55.7445 39.9830 180.3916 195 K 5.4156 7.4490 116.7830 55.5129 33.5522 183.8128 196 I 3.3693 7.7891 118.6497 64.4604 36.8575 177.6555 197 L 4.0870 8.3573 119.9461 56.6022 41.5923 177.2534 198 D 4.7280 7.2010 116.1793 52.1403 40.3194 176.9592 199 N 4.4101 8.8414 117.2430 53.4738 37.2593 175.9738 200 S 4.1204 7.8454 115.7370 61.2999 63.1023 176.8775 201 I 4.2856 7.1156 114.7413 60.1155 36.5667 176.0906 202 I 4.1419 8.5767 121.6934 62.3317 37.5071 174.4066 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 2 G 8.34 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 0.00 0.00 0.00 3 P 0.00 4.36 0.00 2.56 2.28 0.00 4.02 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 2.42 2.38 0.00 4 N 8.37 4.56 0.00 2.70 2.82 0.00 0.00 6.97 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 5 P 0.00 3.28 0.00 1.28 0.49 0.00 3.70 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 1.62 1.52 0.00 *7 K 7.36 3.97 0.00 2.05 1.99 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.51 7.81 *9 Y 8.17 4.49 0.00 3.01 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 10 P 0.00 4.47 0.00 2.28 2.55 0.00 3.65 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 1.70 0.96 0.00 11 I 7.50 4.29 1.84 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 1.38 0.84 0.93 0.00 0.00 12 E 8.83 3.81 0.00 1.96 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 2.26 0.00 13 G 8.12 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.47 4.97 0.00 2.61 2.66 0.00 0.00 7.15 6.63 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 15 K 7.97 3.80 0.00 1.66 1.68 0.00 1.48 0.00 0.00 1.38 0.00 0.00 2.16 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.15 1.30 7.81 16 S 7.94 4.36 0.00 3.98 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 17 V 8.33 4.48 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 0.58 0.00 0.00 0.93 0.00 0.00 18 Q 9.34 4.59 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 19 F 8.70 5.58 0.00 3.19 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 20 I 8.41 4.03 1.83 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.83 0.63 0.00 0.00 21 K 7.91 3.85 0.00 1.77 1.77 0.00 1.79 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.58 7.81 22 P 0.00 4.38 0.00 2.00 2.04 0.00 3.86 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 23 I 7.10 3.89 2.04 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.68 0.96 0.00 0.00 24 L 8.76 4.33 0.00 1.65 1.70 1.14 -0.07 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 25 E 7.93 3.99 0.00 2.02 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 2.29 2.35 0.00 26 K 8.04 4.10 0.00 1.81 1.72 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.36 1.03 7.81 27 L 7.63 4.58 0.00 1.63 1.52 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.38 4.24 0.00 1.99 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 0.00 2.36 2.30 0.00 29 N 8.74 4.20 0.00 2.97 2.96 0.00 0.00 6.66 7.68 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 30 V 7.12 4.66 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 0.72 0.00 0.00 0.88 0.00 0.00 31 E 9.38 4.53 0.00 2.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 32 V 8.36 4.80 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 0.77 0.00 0.00 0.98 0.00 0.00 33 G 9.30 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.26 4.15 0.00 1.57 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 0.00 2.31 2.27 0.00 35 Y 8.14 3.20 0.00 1.99 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 36 S 7.58 5.27 0.00 3.79 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.50 5.42 0.00 2.97 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 38 Y 9.71 4.91 0.00 2.37 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 39 D 7.67 5.19 0.00 2.68 2.34 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 40 S 8.25 4.18 0.00 4.25 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 0.00 41 K 9.00 3.79 0.00 1.77 2.11 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.49 7.81 42 N 8.54 4.90 0.00 2.74 2.86 0.00 0.00 7.38 7.28 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 43 G 7.83 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.36 4.16 0.00 2.19 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 2.60 2.53 0.00 45 T 8.39 5.13 4.40 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 1.39 0.00 0.00 46 F 8.80 3.82 0.00 2.84 2.96 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 47 D 8.29 3.74 0.00 2.82 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 48 K 7.53 4.05 0.00 1.75 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.59 1.61 7.81 49 Q 8.35 4.20 0.00 0.93 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 50 I 6.43 4.33 1.78 0.00 0.00 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 1.05 -0.03 0.80 0.00 0.00 51 L 8.54 4.41 0.00 1.73 1.25 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 7.81 2.97 0.00 3.09 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 53 H 7.14 4.46 0.00 3.10 3.09 0.00 5.74 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.83 4.98 0.00 3.07 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.31 0.00 2.21 2.16 0.00 3.78 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 2.17 2.29 0.00 56 I 8.01 3.55 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 1.40 0.62 0.93 0.00 0.00 57 L 8.02 4.18 0.00 1.95 1.72 1.10 0.56 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 58 N 8.83 4.06 0.00 2.70 2.81 0.00 0.00 7.14 8.35 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 59 D 7.55 4.82 0.00 2.71 2.61 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 0.00 0.00 0.00 0.00 60 K 8.47 4.97 0.00 1.44 1.67 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.21 7.81 61 L 8.76 5.28 0.00 1.75 1.54 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 62 K 9.06 5.24 0.00 1.44 1.60 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.25 1.25 7.81 63 I 9.17 4.87 1.84 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 1.15 0.65 0.85 0.00 0.00 64 G 8.07 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 0.00 0.00 0.00 65 K 8.32 4.53 0.00 1.80 1.64 0.00 1.98 0.00 0.00 2.19 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.58 1.37 7.81 66 F 7.71 4.34 0.00 3.26 3.36 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 67 C 8.36 5.06 0.00 2.80 2.80 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 68 S 8.99 4.65 0.00 3.93 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 69 I 7.76 4.80 1.66 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.64 0.95 0.00 0.00 70 G 8.53 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.75 0.00 2.19 2.04 0.00 3.92 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 2.11 1.98 0.00 72 G 9.22 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 0.00 0.00 0.00 0.00 73 V 7.64 4.18 2.37 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 0.92 0.00 0.00 1.08 0.00 0.00 74 T 8.69 4.83 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 75 I 8.67 4.84 1.77 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.71 0.89 0.00 0.00 76 I 8.90 4.53 1.83 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 1.34 1.22 0.81 0.00 0.00 *78 N 8.70 4.50 0.00 2.82 2.90 0.00 0.00 6.69 7.95 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 79 G 7.58 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 80 A 9.18 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 7.64 5.01 0.00 2.81 2.67 0.00 0.00 7.09 8.16 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 82 H 8.73 4.37 0.00 3.10 3.33 0.00 5.74 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 83 R 8.37 3.92 0.00 1.85 1.88 0.00 3.23 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 *85 D 8.43 4.78 0.00 2.85 2.82 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 86 G 7.36 4.09 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 0.00 0.00 0.00 87 S 8.76 4.40 0.00 3.93 3.94 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 88 T 8.30 4.45 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 1.22 0.00 0.00 89 Y 7.78 3.90 0.00 2.65 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 0.00 0.00 0.00 0.00 90 P 0.00 4.58 0.00 1.99 1.98 0.00 3.20 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 1.81 1.71 0.00 91 F 7.95 4.48 0.00 3.12 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 92 N 8.55 4.74 0.00 2.98 3.27 0.00 0.00 6.25 6.67 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 93 L 9.19 4.25 0.00 1.25 1.36 0.72 0.68 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 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 V 7.48 4.71 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 0.59 0.00 0.00 0.90 0.00 0.00 121 W 8.88 5.38 0.00 3.43 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 0.00 122 I 9.29 4.56 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 1.10 0.99 0.89 0.00 0.00 123 G 8.33 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 0.00 124 K 8.57 4.07 0.00 1.82 1.74 0.00 1.86 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.70 7.81 125 D 9.07 4.91 0.00 2.95 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.28 4.18 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 0.91 0.00 0.00 0.92 0.00 0.00 127 V 9.04 4.72 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 0.91 0.00 0.00 0.92 0.00 0.00 128 I 8.37 4.50 1.86 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 1.36 0.88 0.89 0.00 0.00 *130 P 0.00 4.56 0.00 2.02 1.97 0.00 3.73 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 131 G 7.84 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 0.00 132 V 7.21 4.67 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 0.81 0.00 0.00 0.90 0.00 0.00 133 K 9.12 5.04 0.00 1.38 1.62 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 1.25 7.81 134 I 8.98 4.75 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.59 0.85 0.00 0.00 135 G 9.69 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 0.00 0.00 0.00 136 D 8.66 4.42 0.00 2.70 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 0.00 0.00 0.00 137 G 8.98 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.32 4.19 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 0.00 139 I 8.05 4.91 1.90 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.04 0.80 0.00 0.00 140 V 8.67 4.64 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 0.84 0.00 0.00 0.86 0.00 0.00 141 A 8.75 4.19 1.09 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 0.00 0.00 142 A 8.26 3.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.37 4.31 0.00 2.82 2.87 0.00 0.00 6.93 7.86 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 0.00 144 S 7.72 4.75 0.00 3.83 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 0.00 145 V 8.41 4.58 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 0.91 0.00 0.00 0.98 0.00 0.00 146 V 9.03 4.22 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 0.73 0.00 0.00 0.89 0.00 0.00 147 V 8.34 4.20 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 0.88 0.00 0.00 0.90 0.00 0.00 148 K 7.66 4.47 0.00 1.76 1.74 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.42 7.81 149 D 8.27 4.80 0.00 2.56 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 0.00 150 I 8.84 4.56 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.97 0.89 0.00 0.00 151 A 8.98 4.24 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.19 0.00 2.22 2.25 0.00 3.89 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 2.14 2.18 0.00 153 Y 8.22 3.76 0.00 3.31 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 *155 L 7.91 4.63 0.00 1.78 1.74 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 156 A 8.23 4.44 1.13 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 0.00 157 G 8.56 4.59 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 0.00 158 G 8.43 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 0.00 0.00 0.00 159 N 8.18 5.21 0.00 2.67 2.68 0.00 0.00 6.89 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 0.00 160 P 0.00 4.56 0.00 2.09 2.02 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 161 A 8.42 4.39 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 0.00 162 N 8.78 4.69 0.00 2.64 2.67 0.00 0.00 7.19 8.16 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 0.00 163 E 9.04 4.11 0.00 1.84 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 2.32 2.38 0.00 164 I 9.97 4.23 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.74 0.90 0.00 0.00 165 K 7.53 4.52 0.00 1.81 1.72 0.00 1.54 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.42 7.81 166 Q 8.46 4.32 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.99 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 167 R 8.56 3.81 0.00 1.64 1.04 0.00 3.14 0.00 0.00 3.46 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 168 F 7.55 5.18 0.00 2.97 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 0.00 169 D 8.77 4.50 0.00 2.98 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 0.00 170 Q 8.92 4.02 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 171 D 8.29 4.64 0.00 2.88 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 0.00 172 T 10.03 3.78 4.48 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 0.85 0.00 0.00 173 I 8.20 3.37 2.05 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 1.47 1.47 0.99 0.00 0.00 174 N 8.84 4.25 0.00 2.69 2.93 0.00 0.00 7.21 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 0.00 175 Q 8.12 4.09 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 176 L 7.54 3.70 0.00 1.48 1.73 0.33 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 177 L 7.74 4.48 0.00 1.87 1.85 1.05 1.28 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 0.00 178 D 8.47 4.71 0.00 2.77 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 0.00 179 I 7.55 3.95 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 1.65 0.49 0.95 0.00 0.00 180 K 7.18 2.00 0.00 1.49 1.11 0.00 1.88 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.20 1.34 7.81 181 W 6.04 2.00 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 W 5.56 3.91 0.00 3.11 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 0.00 183 N 7.48 4.86 0.00 2.77 3.01 0.00 0.00 6.97 7.11 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 0.00 184 W 7.24 4.72 0.00 3.68 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 P 0.00 4.57 0.00 2.50 2.14 0.00 3.94 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 2.03 1.98 0.00 186 I 8.90 3.89 2.08 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 1.02 0.00 0.00 187 D 7.90 4.63 0.00 2.92 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 *189 I 7.48 4.20 2.16 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.35 0.80 0.00 0.00 190 N 8.41 4.18 0.00 2.67 2.85 0.00 0.00 6.93 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 7.09 4.63 0.00 2.04 1.76 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 2.17 2.12 0.00 192 N 9.33 4.94 0.00 2.88 2.94 0.00 0.00 7.06 7.43 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 0.00 193 I 8.13 3.28 1.76 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 1.06 0.93 0.78 0.00 0.00 194 D 8.20 4.04 0.00 2.60 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 0.00 195 K 7.45 5.42 0.00 1.66 1.81 0.00 1.83 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 0.96 7.81 196 I 7.79 3.37 1.30 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.47 -0.63 0.00 0.00 197 L 8.36 4.09 0.00 1.54 1.66 0.83 0.62 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 0.00 198 D 7.20 4.73 0.00 2.94 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 0.00 199 N 8.84 4.41 0.00 2.82 2.81 0.00 0.00 6.94 8.42 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 0.00 200 S 7.85 4.12 0.00 3.80 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 0.00 201 I 7.12 4.29 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.46 0.93 0.00 0.00 202 I 8.58 4.14 1.81 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 1.12 0.52 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.