NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.3524 0.0000 0.0000 62.1191 32.8916 176.1954 5 R 3.5854 8.7489 122.5009 58.2721 30.2220 174.9996 6 Y 4.9032 8.7619 115.5414 56.0697 40.8221 174.5779 7 K 4.9437 8.7383 121.7515 55.0480 36.4143 175.7409 8 A 4.4854 8.6185 120.3242 52.3657 19.5270 178.5049 9 D 4.4119 8.5242 118.8319 58.7165 40.9963 178.9668 10 I 3.8344 7.9817 118.2776 64.1376 37.8983 176.9383 11 G 3.8896 7.8924 104.9346 46.4374 0.0000 175.1955 12 G 3.8402 8.5909 108.3117 45.8560 0.0000 174.1351 13 G 4.1476 6.7030 108.4418 45.1441 0.0000 174.4722 14 S 4.5621 8.3358 116.2950 57.7958 64.7505 173.8765 15 L 4.0674 9.2178 118.9241 56.4964 42.2801 177.2860 16 K 3.7759 8.2656 116.2481 56.6618 30.0896 174.7189 17 L 3.9376 7.8036 123.7130 58.0160 42.5332 176.2755 18 P 4.3389 0.0000 0.0000 65.6338 31.2195 178.5234 19 E 3.9996 8.1168 116.9947 59.3675 29.4760 179.1796 20 S 4.1368 8.5312 115.7101 61.6787 62.8935 176.9172 21 R 3.9237 8.4991 120.9111 59.4129 29.8587 179.0432 22 I 3.7015 7.6850 119.3570 64.5777 37.0383 178.6010 23 I 3.8041 8.0536 120.3870 64.3447 36.9653 178.0919 24 A 3.9000 8.5377 122.1905 55.3165 18.0054 180.0326 25 G 3.5539 8.1820 103.9743 47.7460 0.0000 175.8454 26 L 4.0238 7.8592 121.5639 57.7312 41.5190 179.5699 27 L 3.6726 7.7111 117.4581 57.8104 41.4261 179.4362 28 L 4.4657 7.7950 117.8060 57.9107 41.6525 179.0657 29 E 4.2941 8.3630 118.2887 57.0215 29.4590 178.1673 30 G 3.9879 8.1402 107.0721 46.0794 0.0000 173.3545 31 V 4.5151 8.0158 118.0030 58.8639 34.4925 176.5067 32 T 4.2680 9.4166 116.6324 61.1134 70.8948 175.2340 33 E 4.0537 8.6573 119.9761 59.4910 29.3436 179.1841 34 D 4.3712 8.0678 117.8215 57.5015 41.4607 178.1811 35 Q 4.0721 8.2125 118.6651 58.3804 28.6523 178.4879 36 W 4.1365 8.5954 129.8506 60.5988 30.7593 178.2485 37 R 3.7411 8.5076 118.4620 59.3725 29.4393 178.4966 38 H 3.9787 8.2954 117.6695 59.2324 29.9363 176.9304 39 A 4.0235 8.3028 122.8443 55.3422 17.7054 179.7225 40 I 3.4052 7.4173 118.1571 63.7893 37.0979 177.8623 41 E 4.2162 8.0503 116.2231 56.6914 30.3046 176.6672 42 V 4.0101 7.2292 117.1714 64.5710 32.8285 176.7406 43 E 3.8385 8.1390 118.4506 57.2475 30.1192 176.5297 44 N 4.2945 7.8999 115.3422 53.7490 36.7106 175.4726 45 V 3.5798 7.7882 111.9063 64.0751 30.9909 177.9347 46 L 4.3073 7.8033 117.8132 53.9587 41.9056 176.4328 47 Q 3.4900 7.9839 116.7962 56.6831 26.7335 174.3885 48 R 4.0813 7.3108 113.3694 56.3429 30.6163 177.8662 49 R 3.9951 8.3077 119.1006 58.2879 30.7786 177.9350 *55 K 4.6374 7.9451 116.8680 56.6632 34.2676 178.1202 56 R 3.9393 8.0443 117.0370 59.3896 30.0010 178.7237 57 Q 4.0097 8.0864 118.9351 59.2324 28.9874 178.3722 58 S 4.2812 8.0764 114.7792 61.6200 63.2590 176.2057 59 S 4.1619 8.6766 119.4872 61.2142 62.6379 176.4593 60 L 3.8969 8.0732 122.7084 58.5251 41.8505 178.9171 61 M 4.0495 8.0433 118.5318 58.2951 31.8081 178.7063 62 R 3.5559 8.0274 118.6541 59.4834 29.9878 178.1377 63 N 4.1821 8.2326 115.0127 56.3612 38.8247 177.1002 64 R 3.9831 8.2423 119.5360 59.5814 30.1814 179.1548 65 L 4.1727 7.8500 118.3502 57.7307 41.4004 178.8474 66 E 4.5501 8.2418 116.6276 57.8383 29.6042 178.4801 67 T 4.2066 7.9249 109.9516 63.0537 69.1883 173.4308 68 M 4.8144 8.1468 120.6024 53.5078 35.4270 174.1561 69 G 3.5636 8.0949 108.5625 42.7716 0.0000 172.5384 70 P 3.4565 0.0000 0.0000 65.6256 30.8319 178.6473 71 E 3.8719 7.8868 116.5215 59.2848 29.3159 178.9799 72 L 3.5758 7.4921 120.1765 57.4063 42.1123 178.7921 73 W 4.3917 7.6547 118.5611 59.9114 28.8804 178.0524 74 Q 4.1849 8.4191 119.7841 59.1325 28.4908 177.8638 75 M 4.0240 7.7965 119.9492 58.3364 31.7791 178.8701 76 V 3.5835 7.7296 116.9949 66.0895 31.8674 177.7108 77 R 4.0671 8.4124 117.3092 58.8918 30.0701 176.6708 78 D 4.8283 8.3142 115.7263 54.0981 42.8779 176.7578 79 G 3.8667 7.9282 108.1911 44.3366 0.0000 174.0078 80 S 4.2841 8.3924 114.6224 58.4277 64.6227 175.3263 81 T 3.8371 8.5124 119.3745 67.0927 68.2017 176.3726 82 Q 3.8904 7.9788 120.4048 59.1660 29.2330 178.0797 83 V 3.5432 7.5637 118.6132 66.0125 31.5881 177.8258 84 A 3.9779 8.4623 120.6611 55.2594 18.2053 179.3301 85 I 3.6630 8.1332 117.5891 64.5298 38.0217 178.1284 86 Q 4.1437 8.2292 118.6056 58.7144 28.5321 178.4483 87 A 4.0357 8.2353 122.1330 54.9450 18.3294 179.8416 88 V 3.5719 7.9934 116.8076 66.1794 31.6075 177.7016 89 F 4.4584 8.6013 120.4591 61.6283 39.0002 177.0730 90 A 3.7791 8.2591 119.7184 55.1450 18.1755 179.4146 91 A 3.9873 8.1910 119.1063 55.4030 18.5297 179.7664 92 A 4.0529 8.4816 119.6535 55.1575 18.1942 179.9816 93 I 3.6933 7.8903 118.1273 64.5243 37.2847 178.1686 94 K 4.2112 8.1201 119.2645 59.9323 32.0836 178.0125 95 H 4.6464 8.6372 117.9556 57.2894 30.2093 174.5574 96 S 4.6352 7.9671 114.7442 55.8412 63.3319 174.0648 97 T 4.1095 8.5411 125.7877 66.3756 68.2169 175.9282 98 L 4.5958 8.3694 123.3865 57.6287 42.1218 178.7829 99 L 4.3209 8.4501 120.2827 58.2173 42.1832 178.9372 100 G 3.8467 8.5084 107.2930 47.5833 0.0000 175.3279 101 D 4.7270 8.7473 121.5870 56.6026 40.9115 178.4700 102 F 3.4298 8.2109 120.9305 61.0891 39.2825 177.1963 103 L 3.6605 7.8910 118.2862 57.8696 41.2723 179.0600 104 D 4.2611 8.4287 116.7434 56.6777 41.3274 177.3062 105 L 4.5974 8.2154 116.7116 54.8094 42.9520 176.1497 106 V 4.0950 7.1779 115.8067 63.7211 34.0533 177.0728 107 V 3.2377 7.5098 118.5297 66.0461 31.0525 178.0627 108 R 3.9447 7.5675 116.6223 59.8207 30.2926 177.6747 109 D 4.4678 7.9969 117.0321 57.2590 41.2926 177.7767 110 Q 3.9790 8.1676 118.7689 58.9615 28.4658 178.5682 111 F 4.2380 7.7816 116.5875 59.2488 38.9497 176.9495 112 R 4.1342 7.6892 118.0096 58.1645 30.2421 176.5409 113 M 4.2214 7.2585 117.5646 55.2391 32.7400 176.1826 114 F 4.5719 9.0792 123.7053 61.2019 39.6073 176.2292 115 R 4.1861 7.1178 120.1850 52.4133 30.1851 172.4227 116 P 4.3287 0.0000 0.0000 63.1462 32.7145 174.6758 117 D 5.1196 8.2070 121.4827 51.9625 42.9317 175.3109 118 L 4.8432 8.3975 118.6559 52.9381 41.2979 173.8515 119 P 4.5405 0.0000 0.0000 62.4468 32.6975 178.4426 120 R 3.7932 8.5680 118.9620 59.3371 29.8407 179.1556 121 K 4.1461 8.2930 118.0912 60.5123 32.1501 178.8817 122 M 4.2125 8.5061 120.3157 57.9156 31.8521 178.4201 123 W 4.2356 8.3487 128.1714 60.5272 31.1317 177.4782 124 D 4.3231 8.3291 118.8403 57.7677 40.3433 179.0557 125 Q 4.1792 8.1562 118.3154 58.8864 28.7446 178.2296 126 Y 4.1153 7.8800 120.7500 60.7377 38.8924 178.0284 127 L 3.4054 7.5396 119.8635 57.3655 41.6624 179.2640 128 E 3.8200 7.7087 118.1474 59.7094 29.3968 179.5598 129 Q 3.9703 7.8264 117.7759 58.7890 28.7346 178.3094 130 C 3.6792 7.7660 118.3201 62.8161 27.7516 176.4381 131 R 3.8276 7.4885 118.4575 59.0617 29.6204 178.5407 132 N 4.4417 7.6591 115.5914 56.3530 38.5838 177.3670 133 R 4.3843 7.9881 118.7645 57.3389 31.0013 175.8897 134 D 4.6759 8.1040 118.2674 51.5382 41.7892 173.7584 135 P 4.5400 0.0000 0.0000 63.4854 31.8020 177.1918 136 L 4.3893 8.0150 118.8512 55.7056 42.6910 176.9652 137 M 4.2132 7.2900 114.3241 53.9952 31.8127 174.3771 138 P 4.1750 0.0000 0.0000 62.3215 32.1099 176.9775 139 V 3.7551 7.6381 120.1455 60.8093 30.5908 175.4665 140 W 4.5703 7.8245 126.7676 56.1755 29.9358 177.3498 141 Q 4.2552 8.7083 120.8693 55.9461 30.2535 177.4493 142 D 4.5764 8.8539 123.2290 57.7366 40.8831 179.5617 143 S 4.1556 8.0419 114.1915 61.7077 63.1151 176.6044 144 T 3.7528 7.9083 118.7060 66.2709 68.3353 176.1072 145 A 4.1714 8.5367 123.1063 55.5706 18.2755 179.1597 146 N 4.2895 8.3052 115.1512 56.1380 39.1270 177.1934 147 K 3.7923 7.9925 121.4128 59.2330 32.3083 178.4679 148 L 3.7519 7.8151 120.3578 58.0149 41.9950 178.7849 149 A 2.5800 7.4555 120.5138 54.7441 18.1425 179.2612 150 D 4.2536 7.9210 117.4992 57.4756 40.7841 178.8022 151 C 4.0377 7.7559 118.8623 62.4718 31.6614 175.8085 152 V 3.6002 7.5323 119.8109 66.2893 31.0155 177.6331 153 Y 3.9309 8.5621 116.9126 60.7760 37.6074 178.3342 154 R 3.9067 8.1653 119.8138 59.4698 30.2241 178.5419 155 I 3.8711 7.7558 119.5350 64.6379 37.1994 178.5037 156 L 4.0105 7.9540 119.6281 57.4813 41.2197 179.8394 157 V 3.8084 7.9473 119.8429 65.5427 31.3063 177.6927 158 E 3.9397 8.4767 117.5960 59.4390 29.4640 179.3465 159 V 3.7905 7.3250 116.5282 62.0575 31.9704 177.0009 160 G 3.9853 7.4102 107.1201 45.0750 0.0000 174.0743 161 Y 4.6251 7.9933 118.1184 59.7433 39.3334 176.1259 162 I 5.0411 7.8915 120.5889 59.9325 39.0080 176.5416 163 T 4.4588 8.4428 117.5703 62.1103 70.3469 174.6666 164 D 4.5965 7.7992 122.0145 52.5817 43.6879 175.2076 165 S 4.4871 8.6826 120.1084 58.7953 63.5908 174.5890 166 K 4.0161 8.3152 119.9066 56.9524 34.2139 177.2621 167 T 4.1008 8.0811 106.5359 61.7471 69.6221 173.9395 168 Y 4.0007 7.1354 119.7789 58.9054 36.4105 170.7787 169 R 4.5232 7.6635 117.1868 56.3779 31.4860 176.1348 170 L 4.9080 8.3570 123.1277 53.2122 42.8976 175.9225 171 K 4.9619 9.1998 124.5767 54.2183 35.4349 175.5711 172 S 4.3349 8.8314 119.9926 57.7617 63.7192 173.8374 173 V 4.1692 7.8985 116.1217 59.4598 33.9295 175.2572 174 R 4.5370 8.2386 123.2361 54.3397 30.7688 176.2651 175 I 4.0423 8.8432 126.0215 60.5077 37.9438 177.0120 176 S 4.2799 9.5103 120.8263 59.0524 64.4520 176.1908 177 G 3.6710 8.7249 110.2533 48.0170 0.0000 175.6056 178 E 3.9919 8.1268 121.0891 58.9805 29.7043 178.9676 179 V 3.6933 7.5347 117.3322 66.2424 31.6316 178.0134 180 M 4.1135 8.1823 118.4853 58.2667 31.6786 178.5540 181 S 4.0652 8.2587 113.4036 61.6964 62.5562 175.5548 182 Y 4.0007 7.9138 121.5511 60.8137 38.4123 178.2699 183 L 3.9818 7.9948 119.8426 57.6094 41.7297 179.7045 184 R 3.8373 8.2334 118.2653 59.4404 29.8774 178.7208 185 E 3.9048 8.0862 117.2079 59.0801 29.4362 178.3853 186 N 4.5896 7.4104 113.3583 51.9111 38.9673 174.5069 187 N 4.1558 7.8759 116.1965 54.7301 37.3594 175.7516 188 E 4.3825 8.0623 116.0132 54.9149 26.3078 176.4083 189 Q 3.9672 7.8660 123.4172 59.5756 29.1235 179.0505 190 Y 4.0057 8.0117 119.3515 60.7203 39.0164 177.8615 191 V 3.4831 7.9533 118.6487 66.1250 30.8145 177.7120 192 I 3.6654 8.1136 119.8125 64.5008 36.7361 178.3107 193 R 3.9296 7.9521 118.4244 59.3641 29.9346 177.6605 194 C 4.2178 7.2642 114.5000 61.3137 28.6147 175.4482 195 I 4.0408 7.6042 119.7694 61.8781 37.9488 174.9407 196 Q 4.5449 7.4462 116.5609 54.4292 29.3870 174.7386 197 V 4.1913 8.6534 117.4393 60.7719 32.7996 176.7579 198 S 3.8752 7.6273 120.2030 58.0095 62.9017 173.8462 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 P 0.00 4.35 0.00 2.16 2.03 0.00 3.64 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 1.94 2.06 0.00 5 R 8.75 3.59 0.00 1.59 1.66 0.00 2.97 0.00 0.00 2.90 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.23 0.00 6 Y 8.76 4.90 0.00 3.00 2.97 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 7 K 8.74 4.94 0.00 1.82 1.82 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.47 7.81 8 A 8.62 4.49 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.52 4.41 0.00 2.87 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 10 I 7.98 3.83 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.42 1.00 0.00 0.00 11 G 7.89 3.89 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 0.00 0.00 0.00 12 G 8.59 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 13 G 6.70 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.34 4.56 0.00 4.25 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 15 L 9.22 4.07 0.00 1.68 1.82 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.27 3.78 0.00 1.96 1.79 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.55 7.81 17 L 7.80 3.94 0.00 1.76 1.68 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.34 0.00 2.19 2.08 0.00 3.65 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 19 E 8.12 4.00 0.00 2.14 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 2.39 2.40 0.00 20 S 8.53 4.14 0.00 3.95 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 21 R 8.50 3.92 0.00 2.00 2.00 0.00 3.14 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 22 I 7.68 3.70 2.01 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 1.51 0.75 0.89 0.00 0.00 23 I 8.05 3.80 1.91 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.94 1.00 0.00 0.00 24 A 8.54 3.90 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.18 3.55 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 26 L 7.86 4.02 0.00 2.03 1.89 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.71 3.67 0.00 0.84 0.13 -0.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.79 4.47 0.00 1.93 1.86 1.11 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.36 4.29 0.00 2.13 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 0.00 2.38 2.43 0.00 30 G 8.14 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.02 4.52 2.27 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 0.94 0.00 0.00 0.97 0.00 0.00 32 T 9.42 4.27 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 1.28 0.00 0.00 33 E 8.66 4.05 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 34 D 8.07 4.37 0.00 2.74 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 35 Q 8.21 4.07 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 36 W 8.60 4.14 0.00 3.42 3.33 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 37 R 8.51 3.74 0.00 1.95 2.13 0.00 3.27 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.05 0.00 38 H 8.30 3.98 0.00 3.36 3.46 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.30 4.02 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.42 3.41 1.34 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 -0.23 0.67 0.00 0.00 41 E 8.05 4.22 0.00 2.01 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 2.36 2.22 0.00 42 V 7.23 4.01 1.82 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 0.74 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0.00 1.87 2.00 0.00 3.14 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 57 Q 8.09 4.01 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 58 S 8.08 4.28 0.00 4.29 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 59 S 8.68 4.16 0.00 4.14 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.07 3.90 0.00 1.79 1.93 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 61 M 8.04 4.05 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 62 R 8.03 3.56 0.00 1.05 1.53 0.00 2.29 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.93 0.00 63 N 8.23 4.18 0.00 2.67 2.88 0.00 0.00 7.15 7.64 0.00 0.00 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 R 8.24 3.98 0.00 1.98 2.00 0.00 3.15 0.00 0.00 3.22 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0.00 0.00 0.00 0.00 0.00 73 W 7.65 4.39 0.00 3.54 3.05 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 74 Q 8.42 4.18 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 75 M 7.80 4.02 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 76 V 7.73 3.58 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 0.87 0.00 0.00 1.04 0.00 0.00 77 R 8.41 4.07 0.00 1.91 1.99 0.00 3.30 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 78 D 8.31 4.83 0.00 2.82 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 79 G 7.93 3.87 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 0.00 0.00 0.00 80 S 8.39 4.28 0.00 4.06 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 81 T 8.51 3.84 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 82 Q 7.98 3.89 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 83 V 7.56 3.54 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.94 0.00 0.00 84 A 8.46 3.98 1.43 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 85 I 8.13 3.66 1.94 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 1.50 1.59 1.01 0.00 0.00 86 Q 8.23 4.14 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 87 A 8.24 4.04 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 88 V 7.99 3.57 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 1.17 0.00 0.00 1.04 0.00 0.00 89 F 8.60 4.46 0.00 3.19 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 90 A 8.26 3.78 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 91 A 8.19 3.99 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.48 4.05 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.89 3.69 1.85 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.28 0.83 0.00 0.00 94 K 8.12 4.21 0.00 1.84 2.05 0.00 2.00 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.53 1.54 7.81 95 H 8.64 4.65 0.00 3.32 3.54 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.97 4.64 0.00 4.04 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 97 T 8.54 4.11 4.33 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 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7.18 4.10 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 0.92 0.00 0.00 0.95 0.00 0.00 107 V 7.51 3.24 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 0.68 0.00 0.00 0.24 0.00 0.00 108 R 7.57 3.94 0.00 1.92 2.02 0.00 3.31 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 109 D 8.00 4.47 0.00 2.81 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 0.00 110 Q 8.17 3.98 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 111 F 7.78 4.24 0.00 3.20 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 0.00 112 R 7.69 4.13 0.00 1.92 2.02 0.00 3.31 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 113 M 7.26 4.22 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.51 0.00 114 F 9.08 4.57 0.00 2.89 3.13 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 0.00 115 R 7.12 4.19 0.00 1.40 1.51 0.00 2.93 0.00 0.00 2.94 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.00 116 P 0.00 4.33 0.00 1.67 1.66 0.00 3.48 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 117 D 8.21 5.12 0.00 2.77 2.58 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 0.00 0.00 0.00 0.00 118 L 8.40 4.84 0.00 1.47 1.50 0.65 0.42 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 0.00 119 P 0.00 4.54 0.00 2.33 2.28 0.00 3.80 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 120 R 8.57 3.79 0.00 1.78 1.94 0.00 2.71 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.42 0.00 121 K 8.29 4.15 0.00 2.02 2.14 0.00 1.55 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.62 7.81 122 M 8.51 4.21 0.00 2.19 2.48 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.75 0.00 123 W 8.35 4.24 0.00 3.48 3.26 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 0.00 124 D 8.33 4.32 0.00 2.97 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 0.00 125 Q 8.16 4.18 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 126 Y 7.88 4.12 0.00 3.23 3.05 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 0.00 127 L 7.54 3.41 0.00 1.57 1.44 1.01 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 128 E 7.71 3.82 0.00 2.19 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 2.26 2.41 0.00 129 Q 7.83 3.97 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 130 C 7.77 3.68 0.00 2.36 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 0.00 0.00 0.00 131 R 7.49 3.83 0.00 1.78 1.84 0.00 2.99 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.56 0.00 132 N 7.66 4.44 0.00 2.85 2.85 0.00 0.00 7.07 7.36 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 0.00 133 R 7.99 4.38 0.00 2.08 2.09 0.00 3.27 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 134 D 8.10 4.68 0.00 2.76 2.74 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 0.00 135 P 0.00 4.54 0.00 2.18 2.11 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 136 L 8.02 4.39 0.00 1.70 1.72 0.89 0.75 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 0.00 137 M 7.29 4.21 0.00 2.39 1.79 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.60 0.00 138 P 0.00 4.17 0.00 1.67 1.97 0.00 3.15 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.08 0.00 139 V 7.64 3.76 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 0.75 0.00 0.00 0.80 0.00 0.00 140 W 7.82 4.57 0.00 3.55 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 0.00 141 Q 8.71 4.26 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.85 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 142 D 8.85 4.58 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 0.00 143 S 8.04 4.16 0.00 4.05 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 0.00 144 T 7.91 3.75 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 0.93 0.00 0.00 145 A 8.54 4.17 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 0.00 0.00 0.00 0.00 0.00 146 N 8.31 4.29 0.00 3.01 2.88 0.00 0.00 6.84 6.54 0.00 0.00 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 K 7.99 3.79 0.00 1.85 1.86 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.36 7.81 148 L 7.82 3.75 0.00 1.91 1.72 0.68 -0.06 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 0.00 149 A 7.46 2.58 0.17 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 0.00 0.00 0.00 0.00 0.00 150 D 7.92 4.25 0.00 2.73 2.65 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 0.00 151 C 7.76 4.04 0.00 2.95 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 0.00 152 V 7.53 3.60 1.54 0.00 0.00 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 0.93 0.00 0.00 153 Y 8.56 3.93 0.00 2.97 3.03 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 0.00 154 R 8.17 3.91 0.00 2.09 2.11 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 155 I 7.76 3.87 2.12 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 1.60 0.82 1.03 0.00 0.00 156 L 7.95 4.01 0.00 1.77 1.73 0.69 0.68 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 0.00 157 V 7.95 3.81 2.25 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 1.18 0.00 0.00 1.05 0.00 0.00 158 E 8.48 3.94 0.00 2.04 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 2.34 2.50 0.00 159 V 7.32 3.79 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.57 0.00 0.00 160 G 7.41 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 Y 7.99 4.63 0.00 3.12 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 0.00 162 I 7.89 5.04 1.94 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.27 1.11 0.00 0.00 163 T 8.44 4.46 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 164 D 7.80 4.60 0.00 2.59 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.68 4.49 0.00 3.97 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 0.00 166 K 8.32 4.02 0.00 1.54 1.69 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.23 1.14 7.81 167 T 8.08 4.10 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 1.21 0.00 0.00 168 Y 7.14 4.00 0.00 3.22 3.17 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 0.00 0.00 0.00 169 R 7.66 4.52 0.00 1.68 1.81 0.00 3.39 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 170 L 8.36 4.91 0.00 1.03 1.01 0.28 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 171 K 9.20 4.96 0.00 1.80 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.39 7.81 172 S 8.83 4.33 0.00 3.88 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 V 7.90 4.17 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 0.09 0.00 0.00 0.40 0.00 0.00 174 R 8.24 4.54 0.00 1.75 1.84 0.00 3.18 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 175 I 8.84 4.04 1.90 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 1.39 0.81 0.96 0.00 0.00 176 S 9.51 4.28 0.00 3.99 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 0.00 177 G 8.72 3.67 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 0.00 0.00 0.00 178 E 8.13 3.99 0.00 2.06 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 2.40 2.39 0.00 179 V 7.53 3.69 2.25 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 1.04 0.00 0.00 0.96 0.00 0.00 180 M 8.18 4.11 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.83 0.00 181 S 8.26 4.07 0.00 3.94 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 0.00 182 Y 7.91 4.00 0.00 3.18 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 0.00 183 L 7.99 3.98 0.00 1.93 1.71 0.97 1.13 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 0.00 184 R 8.23 3.84 0.00 1.93 1.94 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 185 E 8.09 3.90 0.00 1.77 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 2.38 0.00 186 N 7.41 4.59 0.00 2.26 2.57 0.00 0.00 7.05 8.09 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 0.00 187 N 7.88 4.16 0.00 2.83 2.87 0.00 0.00 6.90 7.21 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 0.00 188 E 8.06 4.38 0.00 1.99 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 2.38 2.52 0.00 189 Q 7.87 3.97 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.63 2.42 0.00 190 Y 8.01 4.01 0.00 3.07 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 0.00 191 V 7.95 3.48 2.22 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 1.03 0.00 0.00 1.09 0.00 0.00 192 I 8.11 3.67 2.02 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 1.40 0.85 0.90 0.00 0.00 193 R 7.95 3.93 0.00 1.87 1.89 0.00 3.25 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 194 C 7.26 4.22 0.00 2.62 2.74 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 0.00 195 I 7.60 4.04 1.82 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 0.37 1.00 0.00 0.00 196 Q 7.45 4.54 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.49 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 197 V 8.65 4.19 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 0.72 0.00 0.00 0.76 0.00 0.00 198 S 7.63 3.88 0.00 3.23 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 * Residues marked with a * may have inaccurate shift predictions.