NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2732 7.8827 121.4508 61.2127 38.7422 173.7644 17 V 4.3888 8.7816 125.9781 61.8017 32.6943 174.4577 18 G 3.9228 8.4672 114.2091 46.6918 0.0000 173.3243 19 G 4.1921 7.7624 110.0911 44.1475 0.0000 172.6639 20 Y 4.9731 7.6973 116.5277 55.2360 42.2370 174.8305 21 T 4.3152 8.5969 117.1739 63.9306 68.4538 175.1905 22 C 4.2777 8.5126 125.1160 60.8431 35.0105 174.8914 23 G 4.1084 8.7621 106.6082 44.0511 0.0000 172.8329 24 A 4.3251 8.7455 125.4942 54.0823 18.5099 176.8091 25 N 4.2416 8.8508 119.4552 54.5089 36.2785 175.2096 26 T 4.2704 7.6229 106.3899 62.3956 69.9304 175.2781 27 V 4.0875 7.0052 122.1731 59.7772 31.5613 173.5066 28 P 4.4406 0.0000 0.0000 64.7541 31.7975 178.3147 29 Y 5.1029 6.9545 115.0834 56.6792 38.7879 174.6828 30 Q 4.5061 7.2382 123.2564 56.2640 29.5671 175.2976 31 V 4.8192 8.9309 125.4110 61.1356 35.6352 173.7461 32 S 4.8002 8.6712 119.7722 56.4163 65.0584 172.5874 33 L 4.4731 8.5381 127.8978 53.5526 43.0019 175.1962 34 N 5.5914 9.0262 122.5448 49.9113 42.3857 174.8086 *37 S 4.2085 8.4333 119.2954 58.3962 64.1677 174.5276 38 G 4.0102 9.7029 108.9267 46.0166 0.0000 172.9814 39 Y 4.4854 6.6047 115.2150 56.3746 39.8900 172.3950 40 H 4.5459 8.8644 121.6429 56.0256 30.4308 174.7592 41 F 5.0609 7.6280 119.7060 56.8012 39.6103 173.8640 42 C 4.7040 6.8542 114.8418 56.3208 43.1566 173.2390 43 G 4.1980 8.6505 109.1863 45.6125 0.0000 172.0697 44 G 4.4711 7.9345 105.6137 46.4616 0.0000 172.6693 45 S 5.5116 8.8010 115.5706 56.4466 66.8034 173.6243 46 L 4.8881 9.1259 127.4198 54.7148 42.3647 177.0488 47 I 4.3861 8.4653 120.0067 61.0754 38.7892 174.6102 48 N 4.5851 7.6733 117.4361 52.0486 39.3450 175.1949 49 S 4.2067 8.5635 112.7972 60.7957 63.0006 174.8916 50 Q 4.5806 9.2554 120.5175 55.1439 31.0063 174.3655 51 W 5.4967 8.5330 118.1776 55.6041 33.2461 174.3809 52 V 5.0466 9.1372 123.5135 61.1422 34.4339 174.1074 53 V 4.8883 8.9682 127.1263 61.7152 33.9679 174.6757 54 S 4.9097 8.9791 120.9780 57.6817 66.1357 171.8960 55 A 4.9303 8.4969 120.4876 50.5888 20.5617 178.3933 56 A 3.8027 8.3601 124.5951 55.3500 18.4660 179.1776 57 H 4.5357 8.3510 109.0209 57.1946 28.6325 175.3813 58 C 4.6443 7.7288 117.2884 57.6381 40.7177 173.4624 59 Y 4.1524 7.4781 121.3921 58.0566 38.7411 175.2065 60 K 3.7619 6.6592 124.5449 55.4189 34.8577 174.5560 61 S 4.2078 8.1373 118.1354 58.1847 64.6982 173.3524 62 G 3.6682 8.2499 106.3626 46.5963 0.0000 173.8462 63 I 4.3686 7.2186 118.8347 59.7387 39.8820 176.0790 64 Q 4.7454 8.8018 127.8348 54.1875 31.6233 174.1925 65 V 4.3078 8.8795 127.3871 62.0650 33.3772 174.6065 66 R 5.0449 8.8934 127.5069 54.6680 32.2986 175.2605 67 L 4.7787 9.1713 124.7344 52.5615 44.9615 177.3207 *69 G 3.9309 8.2146 106.9216 45.5553 0.0000 172.8699 70 E 4.5697 8.2654 118.0720 55.1595 30.6294 174.2884 71 D 4.7418 7.9776 117.8676 54.9205 43.6880 174.3394 72 N 5.2247 9.0905 122.8303 52.3226 38.7996 176.0606 73 I 3.9083 8.2871 119.7687 62.2172 37.8007 176.3163 74 N 4.7835 8.6708 118.0592 53.1151 39.4929 174.8516 75 V 4.3415 7.4292 117.4323 60.7028 34.4569 174.9766 76 V 4.1640 8.3972 126.3505 62.4281 31.0801 175.2405 77 E 4.4604 9.5233 127.0101 55.3793 30.7358 177.0095 78 G 3.9472 8.5225 106.6280 46.3297 0.0000 174.1331 79 N 4.6099 8.9532 117.1514 52.6850 36.7170 174.4872 80 E 4.5593 7.5973 116.8300 56.3921 30.8619 176.4551 81 Q 4.3534 8.9977 120.6520 54.5077 32.9881 173.9106 82 F 5.5931 8.8253 123.3064 56.0434 40.8630 175.4275 83 I 4.7014 8.8393 124.6590 59.3938 41.0254 175.4883 84 S 4.5745 8.7034 122.1154 58.3117 64.3141 173.0412 85 A 4.5461 8.2669 125.5287 51.7958 18.4219 177.9789 86 S 4.4289 9.2364 118.6536 60.7665 64.1798 174.8115 87 K 4.6333 7.5367 116.6730 55.7193 35.5238 174.7358 88 S 5.1663 8.8199 117.6414 56.9889 65.8987 173.6344 89 I 4.4525 9.3424 126.1642 59.4895 38.8069 174.9326 90 V 4.1458 8.2526 127.2772 62.1503 32.6802 175.1880 91 H 3.9015 8.6309 127.0920 56.0477 29.9558 174.4403 92 P 4.3011 0.0000 0.0000 65.2957 31.3681 177.1661 93 S 4.6769 7.9620 111.7110 58.0560 62.9058 173.3208 94 Y 4.3007 8.1747 123.7093 57.6702 39.0292 174.4044 95 N 4.5684 8.0757 125.4119 51.2885 40.3159 175.2154 96 S 3.9432 7.7993 120.4049 60.2306 63.5504 175.3977 97 N 4.3652 8.5187 119.3028 55.4740 38.3696 175.9737 98 T 4.0537 7.6435 105.2291 60.5339 70.1235 174.8112 99 L 3.7299 7.9766 121.0177 55.4678 39.9518 173.9234 100 N 4.4946 7.6613 117.8807 54.5829 39.5368 174.5576 101 N 4.9658 8.6682 119.5434 54.2187 35.8901 175.5566 102 D 4.7994 7.9598 117.5247 53.0581 39.7198 174.6519 103 I 4.7953 7.1858 120.8652 59.3257 42.2932 172.9299 104 M 5.3788 9.1345 126.8715 54.1951 36.3218 173.1965 105 L 5.3818 9.2754 124.5863 53.1670 44.9220 175.3981 106 I 4.9369 9.1819 123.8493 59.4279 40.5683 174.2395 107 K 3.7304 8.5281 128.9425 54.5170 33.4685 175.6546 108 L 4.4257 8.2041 128.2081 54.2036 41.8929 177.1438 109 K 4.1375 8.7885 124.9014 59.0644 32.5836 177.1274 110 S 4.6335 7.7165 111.1159 55.7780 66.1365 173.2428 111 A 4.3775 8.3907 123.1640 52.1646 18.7465 177.3428 112 A 4.2189 8.9604 123.2501 51.7263 19.8606 177.7767 113 S 4.4829 9.3479 115.8232 56.8456 62.4814 173.9726 114 L 4.5093 8.4297 128.0794 54.6836 42.8449 176.9226 115 N 4.7668 8.8133 119.4196 52.6203 39.6934 174.9287 116 S 4.2502 8.8302 111.2864 61.6108 63.2675 175.1504 117 R 4.2352 8.2967 117.9719 56.3364 30.5696 176.3987 118 V 4.4301 7.7581 116.3387 61.0889 33.6697 173.6009 119 A 5.1561 8.4695 127.9347 50.4860 23.0124 175.0700 120 S 5.1231 8.6804 113.9136 57.6801 64.9830 173.1107 121 I 4.4486 8.2718 121.2253 59.1673 39.5940 175.4481 122 S 4.4381 8.3787 123.8728 58.3280 64.0882 173.8186 123 L 4.2816 8.3368 123.0647 53.3111 42.5619 175.2262 124 P 4.5178 0.0000 0.0000 62.9766 32.1756 176.2809 125 T 4.1871 8.2321 108.8390 62.3593 70.0581 174.5690 *127 S 4.5717 7.5672 114.7865 58.0389 64.0339 174.0538 128 C 4.4280 8.3887 118.0005 56.6176 40.7324 173.5782 129 A 4.3722 7.9814 124.6472 51.6760 19.5020 177.6147 130 S 4.3256 8.0998 115.8332 57.3907 64.4588 173.5764 *132 A 4.2237 8.1795 124.3074 53.4848 19.2265 177.2942 133 G 3.9648 9.1146 110.2016 45.2914 0.0000 174.2574 134 T 3.9791 7.5719 117.7444 63.5440 69.3479 173.5793 135 Q 4.6677 8.6252 128.2568 56.0958 30.0320 175.3971 136 C 5.2802 9.4401 122.8084 55.1477 46.6423 172.2924 137 L 5.2128 9.0203 122.5811 53.5409 44.0686 175.0380 138 I 5.2848 9.2179 127.2416 58.8718 40.0437 174.8307 139 S 4.9012 8.5185 119.0939 56.5026 66.5278 173.0003 140 G 3.7783 7.2888 108.3425 46.1945 0.0000 172.9192 141 W 4.5971 8.6026 117.0127 56.2821 29.4407 177.0829 142 G 4.1646 8.3639 109.2517 44.2763 0.0000 173.4897 143 N 3.8305 8.7254 118.4339 54.3569 38.9117 174.6863 144 T 5.0861 8.1181 113.2778 60.5884 69.6580 174.3710 145 K 4.5992 7.8688 121.6245 54.9244 34.4815 176.0638 146 S 4.5059 8.5739 115.7374 58.7615 63.2399 173.9873 147 S 4.5990 7.5133 114.4631 59.0028 65.9600 176.7079 148 G 4.1744 7.5443 115.7059 45.2005 0.0000 172.0783 149 T 4.6577 8.2824 111.6957 59.9531 71.6578 174.5653 150 S 4.3310 9.2577 121.1341 57.6071 65.0428 171.8000 151 Y 4.9970 8.5254 125.6588 56.0266 38.8657 174.4379 152 P 4.6762 0.0000 0.0000 62.5488 33.0416 175.8339 153 D 4.6308 8.7565 117.6212 56.1920 41.5329 177.3114 154 V 5.7181 7.3756 109.6302 58.5446 34.5044 175.7924 155 L 3.1255 8.2443 124.5899 55.1505 42.9134 176.0449 156 K 4.8205 8.1446 125.0845 54.9727 35.0306 174.6235 157 C 5.2237 8.5154 119.3901 55.3163 41.3276 172.9952 158 L 4.7870 8.3869 121.3810 54.1963 45.6596 173.9855 159 K 5.1094 9.0135 125.8503 55.4178 33.4816 175.8989 160 A 4.8330 9.1968 126.2540 49.8148 23.1773 173.3181 161 P 5.0684 0.0000 0.0000 61.6609 34.0965 174.9161 162 I 4.4054 8.2340 122.6248 61.3111 38.1581 175.9981 163 L 4.7670 8.7547 127.6447 53.4399 43.2873 176.8684 164 S 4.3766 8.4073 114.6235 57.9537 64.1693 174.8893 165 D 4.3887 8.7125 121.0394 57.5693 40.9653 178.7028 166 S 4.2498 8.0312 114.4069 61.5872 63.2007 176.5686 167 S 4.1310 7.9925 118.4509 61.2390 62.6220 175.8123 168 C 4.3210 8.2736 121.2121 59.8330 41.7649 175.9324 169 K 3.9680 8.6459 120.1127 59.2449 31.3215 179.6241 170 S 4.2599 7.8499 115.0863 61.3287 62.8059 176.0784 171 A 4.0166 7.7508 122.4248 53.7580 19.7204 177.3760 172 Y 4.8863 7.7166 113.6660 55.1476 38.2603 173.0088 173 P 4.5375 0.0000 0.0000 63.3570 32.3010 177.3799 174 G 3.9789 9.0301 109.7071 46.1893 0.0000 173.7191 175 Q 4.5218 8.2173 116.3512 55.3021 30.1259 175.2976 176 I 4.4131 7.8559 119.9169 59.8972 38.2197 175.4918 177 T 4.5257 8.2215 116.0575 59.7453 70.6999 175.4577 178 S 4.3465 8.5259 115.0778 60.3028 63.2665 174.4016 179 N 4.9684 8.0926 118.9518 53.3418 38.4847 173.8248 180 M 5.5967 7.8434 116.9903 53.9207 36.2905 174.5110 181 F 5.0960 8.5892 114.3037 56.0468 41.9726 172.5089 182 C 5.4281 9.0601 116.9455 55.9250 41.7511 172.5724 183 A 5.0454 9.1818 122.5333 50.8244 22.3682 175.5788 184A G 4.0939 6.9059 108.3288 44.7513 0.0000 172.5475 184 Y 4.6503 8.3898 119.6543 56.0083 41.1086 176.4461 185 L 4.1490 8.6539 125.1101 57.1293 41.9986 178.5721 186 E 4.0338 8.2727 115.1567 56.5419 30.0327 177.5910 187 G 3.8941 8.0434 107.6639 45.3401 0.0000 173.2392 188A G 4.0331 9.8410 106.7779 44.6689 0.0000 173.5560 188 K 4.8301 7.2831 117.5603 55.0763 35.7751 175.1465 189 D 4.6120 8.8225 123.4201 54.0494 45.7310 174.7552 190 S 4.9529 8.7628 116.4375 57.8495 65.4894 173.0352 191 C 4.7828 9.3352 118.8920 55.3627 43.9209 172.3574 192 Q 4.4913 8.5813 117.7862 57.9834 28.3551 177.0976 193 G 4.4723 9.2868 109.3791 45.7555 0.0000 173.9881 194 D 4.7135 8.3039 118.4537 55.2707 41.7889 176.8278 195 S 4.5288 8.0518 115.6100 60.5228 63.4349 175.3233 196 G 4.1719 8.8547 112.6557 46.4308 0.0000 173.7965 197 G 4.3350 7.8579 107.2546 45.2721 0.0000 171.2840 198 P 5.0543 0.0000 0.0000 62.4559 33.4957 175.7693 199 V 4.6050 8.4769 120.8083 61.4188 34.1837 173.7971 200 V 4.8354 8.6447 128.6621 61.2462 33.9522 173.7120 201 C 5.0964 8.7179 124.8587 55.3830 43.6279 174.6125 202 S 3.6890 9.6006 121.1524 59.7884 59.7983 173.3067 203 G 3.9184 8.4600 105.3614 45.5952 0.0000 173.9091 204 K 4.6825 7.4132 118.0660 53.1505 34.9655 175.4129 *209 L 4.3550 8.2721 123.2539 55.4220 42.0897 175.7477 210 Q 4.4681 8.7931 125.9910 56.8172 30.6547 175.8219 211 G 5.3240 7.9835 104.5636 45.8208 0.0000 171.4569 212 I 5.2099 8.1972 119.5156 58.8688 41.1291 175.3240 213 V 3.8023 8.9441 127.4493 64.0732 31.8026 174.1981 214 S 4.8241 8.4703 120.7805 58.6980 64.3885 174.3918 215 W 4.9576 7.1866 114.5614 56.8016 31.6181 172.4264 216 G 3.8330 8.4901 106.7872 46.8134 0.0000 173.0258 217 S 4.6547 8.3975 115.0909 56.6596 62.2678 172.8516 *219 G 4.1594 7.9777 117.8920 45.6575 0.0000 170.6877 220 C 4.9315 8.0744 115.1031 56.4004 41.1873 173.9436 221A A 3.9415 9.0969 125.6493 53.2116 16.5106 177.1184 221 Q 4.5207 7.3337 117.8432 56.2184 29.7501 175.8647 222 K 4.0869 8.4302 121.9078 57.9294 32.6899 176.2202 223 N 4.2944 9.3678 121.9402 54.1073 36.7736 175.4830 224 K 4.2641 7.5429 117.5836 53.8830 32.7669 173.8622 225 P 4.6414 0.0000 0.0000 61.9294 33.3310 176.9012 226 G 3.6605 8.4712 106.2472 45.9923 0.0000 172.8424 227 V 4.3908 7.8544 121.9743 60.6979 34.0340 174.1499 228 Y 4.8851 8.0583 124.1137 55.9649 42.3353 174.9002 229 T 4.4482 8.4662 119.6966 63.5225 70.0215 174.3951 230 K 4.8728 9.4730 128.4702 55.7160 31.4126 177.1862 231 V 3.9259 8.7962 126.5114 65.9098 31.4152 174.9070 232 C 4.5942 8.3756 112.4740 58.2749 41.4168 174.9029 233 N 4.2288 8.0505 117.3308 54.5699 38.5139 175.0826 234 Y 4.7840 8.1478 117.3827 57.4895 39.3324 177.4671 235 V 3.6807 8.1059 121.3852 66.4479 31.4929 178.0657 236 S 4.1701 8.1052 114.2455 61.2733 62.6560 176.3326 237 W 4.1569 8.2967 130.6537 60.4126 30.5107 177.9609 238 I 3.1920 8.3025 120.0152 64.1813 36.5810 178.5409 239 K 3.7642 7.9452 119.1417 59.6258 31.6718 179.5150 240 Q 3.8905 7.7743 116.9377 59.1171 28.5597 178.7002 241 T 3.6996 7.5523 116.9846 66.4894 68.2248 177.0096 242 I 2.6332 7.4102 121.8641 63.8273 36.7220 178.3807 243 A 4.0411 7.7840 120.9485 53.9573 18.1489 178.7632 244 S 4.6786 7.2628 110.2711 58.1813 63.5024 174.0599 245 N 4.6758 7.9118 125.4597 53.9412 39.2950 174.0718 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 16 I 7.88 4.27 1.80 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 1.39 0.88 0.91 0.00 0.00 17 V 8.78 4.39 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 0.93 0.00 0.00 0.93 0.00 0.00 18 G 8.47 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 0.00 19 G 7.76 4.19 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 0.00 20 Y 7.70 4.97 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.60 4.32 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 1.22 0.00 0.00 22 C 8.51 4.28 0.00 2.77 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 23 G 8.76 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 0.00 0.00 0.00 0.00 24 A 8.75 4.33 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 25 N 8.85 4.24 0.00 2.87 2.90 0.00 0.00 7.12 7.54 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 26 T 7.62 4.27 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 1.31 0.00 0.00 27 V 7.01 4.09 1.72 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 0.21 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.44 0.00 2.39 2.31 0.00 3.64 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.01 0.00 29 Y 6.95 5.10 0.00 3.27 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.24 4.51 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.71 0.00 0.00 0.00 0.00 0.00 1.91 2.48 0.00 31 V 8.93 4.82 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 0.89 0.00 0.00 1.00 0.00 0.00 32 S 8.67 4.80 0.00 3.12 3.28 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 33 L 8.54 4.47 0.00 0.49 0.81 0.77 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.03 5.59 0.00 2.38 2.42 0.00 0.00 6.78 7.78 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 *37 S 8.43 4.21 0.00 3.78 3.73 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 38 G 9.70 4.01 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 0.00 0.00 0.00 39 Y 6.60 4.49 0.00 3.04 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 40 H 8.86 4.55 0.00 2.86 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.63 5.06 0.00 3.06 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 42 C 6.85 4.70 0.00 2.18 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 43 G 8.65 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 44 G 7.93 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.80 5.51 0.00 3.82 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 46 L 9.13 4.89 0.00 1.87 1.68 1.04 0.87 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 47 I 8.47 4.39 1.90 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 1.58 0.90 0.96 0.00 0.00 48 N 7.67 4.59 0.00 2.98 2.98 0.00 0.00 6.00 7.96 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 49 S 8.56 4.21 0.00 4.20 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 50 Q 9.26 4.58 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.79 0.00 0.00 0.00 0.00 0.00 2.02 2.18 0.00 51 W 8.53 5.50 0.00 3.32 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 52 V 9.14 5.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.98 0.00 0.00 53 V 8.97 4.89 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 1.04 0.00 0.00 1.02 0.00 0.00 54 S 8.98 4.91 0.00 3.90 3.70 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 55 A 8.50 4.93 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 56 A 8.36 3.80 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.35 4.54 0.00 3.38 3.58 0.00 5.55 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 58 C 7.73 4.64 0.00 3.24 3.30 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 59 Y 7.48 4.15 0.00 2.97 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 60 K 6.66 3.76 0.00 1.32 1.13 0.00 1.02 0.00 0.00 1.27 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.04 7.81 61 S 8.14 4.21 0.00 3.96 3.79 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 0.00 0.00 0.00 62 G 8.25 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 63 I 7.22 4.37 1.84 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 1.45 0.61 0.89 0.00 0.00 64 Q 8.80 4.75 0.00 1.98 1.86 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 2.05 2.18 0.00 65 V 8.88 4.31 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 0.97 0.00 0.00 0.88 0.00 0.00 66 R 8.89 5.04 0.00 1.51 1.70 0.00 2.61 0.00 0.00 2.40 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.14 0.00 67 L 9.17 4.78 0.00 1.60 1.64 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.21 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 70 E 8.27 4.57 0.00 2.07 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 2.35 2.10 0.00 71 D 7.98 4.74 0.00 2.78 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 72 N 9.09 5.22 0.00 2.83 2.84 0.00 0.00 7.15 7.37 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 73 I 8.29 3.91 1.43 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 -0.53 0.00 0.00 74 N 8.67 4.78 0.00 2.83 2.88 0.00 0.00 6.62 7.25 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 75 V 7.43 4.34 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.40 4.16 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 0.82 0.00 0.00 0.95 0.00 0.00 77 E 9.52 4.46 0.00 1.94 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 2.26 2.38 0.00 78 G 8.52 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 0.00 0.00 0.00 79 N 8.95 4.61 0.00 2.92 3.14 0.00 0.00 6.99 7.66 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 80 E 7.60 4.56 0.00 1.55 1.73 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 2.54 2.60 0.00 81 Q 9.00 4.35 0.00 1.99 1.97 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 2.24 2.30 0.00 82 F 8.83 5.59 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.84 4.70 1.87 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 1.24 0.70 0.92 0.00 0.00 84 S 8.70 4.57 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.27 4.55 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 86 S 9.24 4.43 0.00 3.76 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.54 4.63 0.00 1.84 1.89 0.00 1.57 0.00 0.00 1.90 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.37 7.81 88 S 8.82 5.17 0.00 4.11 4.08 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 89 I 9.34 4.45 2.07 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.03 1.09 0.00 0.00 90 V 8.25 4.15 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 0.62 0.00 0.00 0.72 0.00 0.00 91 H 8.63 3.90 0.00 2.96 3.00 0.00 5.65 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 92 P 0.00 4.30 0.00 2.07 2.15 0.00 3.17 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 93 S 7.96 4.68 0.00 3.94 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 94 Y 8.17 4.30 0.00 3.09 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 95 N 8.08 4.57 0.00 2.59 2.43 0.00 0.00 6.62 7.09 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 96 S 7.80 3.94 0.00 3.96 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 97 N 8.52 4.37 0.00 2.75 2.79 0.00 0.00 6.87 7.09 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 98 T 7.64 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 1.10 0.00 0.00 99 L 7.98 3.73 0.00 1.45 1.85 0.64 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.66 4.49 0.00 2.73 2.64 0.00 0.00 7.25 6.92 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 0.00 101 N 8.67 4.97 0.00 2.95 2.68 0.00 0.00 7.23 8.06 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 0.00 102 D 7.96 4.80 0.00 3.09 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 0.00 103 I 7.19 4.80 1.42 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 1.28 1.16 0.14 0.00 0.00 104 M 9.13 5.38 0.00 2.17 1.83 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 2.64 2.63 0.00 105 L 9.28 5.38 0.00 1.84 1.93 1.12 0.30 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 0.00 106 I 9.18 4.94 1.92 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 1.19 0.97 0.87 0.00 0.00 107 K 8.53 3.73 0.00 0.79 1.10 0.00 1.26 0.00 0.00 1.35 0.00 0.00 2.63 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.64 0.21 7.81 108 L 8.20 4.43 0.00 1.46 1.56 0.96 0.71 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 0.00 109 K 8.79 4.14 0.00 1.86 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.72 4.63 0.00 3.92 3.73 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 0.00 111 A 8.39 4.38 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 0.00 112 A 8.96 4.22 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 0.00 113 S 9.35 4.48 0.00 3.84 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 0.00 114 L 8.43 4.51 0.00 1.70 1.61 0.96 1.14 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 0.00 115 N 8.81 4.77 0.00 2.89 2.93 0.00 0.00 6.52 7.22 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 0.00 116 S 8.83 4.25 0.00 4.01 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 0.00 117 R 8.30 4.24 0.00 1.94 2.17 0.00 3.31 0.00 0.00 3.16 7.32 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.57 0.00 4.00 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 0.00 128 C 8.39 4.43 0.00 2.94 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.98 4.37 1.04 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 0.00 130 S 8.10 4.33 0.00 3.84 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 *132 A 8.18 4.22 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 0.00 133 G 9.11 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 0.00 0.00 0.00 134 T 7.57 3.98 4.16 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 1.14 0.00 0.00 135 Q 8.63 4.67 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 136 C 9.44 5.28 0.00 2.77 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 0.00 137 L 9.02 5.21 0.00 1.75 1.56 1.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.22 5.28 1.88 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 0.74 1.64 0.97 0.00 0.00 139 S 8.52 4.90 0.00 3.53 3.57 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 0.00 0.00 0.00 0.00 140 G 7.29 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 0.00 0.00 0.00 141 W 8.60 4.60 0.00 3.11 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 0.00 142 G 8.36 4.16 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 0.00 0.00 0.00 143 N 8.73 3.83 0.00 2.33 2.64 0.00 0.00 7.12 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 0.00 144 T 8.12 5.09 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 1.24 0.00 0.00 145 K 7.87 4.60 0.00 1.89 1.70 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.34 7.81 146 S 8.57 4.51 0.00 4.08 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 0.00 147 S 7.51 4.60 0.00 3.85 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 0.00 148 G 7.54 4.17 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 0.00 149 T 8.28 4.66 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 1.23 0.00 0.00 150 S 9.26 4.33 0.00 3.80 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 0.00 151 Y 8.53 5.00 0.00 2.98 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 0.00 152 P 0.00 4.68 0.00 2.45 2.12 0.00 4.17 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 153 D 8.76 4.63 0.00 2.80 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 0.00 154 V 7.38 5.72 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 0.71 0.00 0.00 0.96 0.00 0.00 155 L 8.24 3.13 0.00 1.38 1.26 -0.80 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.82 0.00 1.68 1.51 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.48 7.81 157 C 8.52 5.22 0.00 1.57 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 0.00 0.00 0.00 158 L 8.39 4.79 0.00 1.72 1.45 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.01 5.11 0.00 1.82 1.85 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.72 7.81 160 A 9.20 4.83 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 0.00 161 P 0.00 5.07 0.00 2.01 2.25 0.00 3.27 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 162 I 8.23 4.41 1.74 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.73 0.76 0.00 0.00 163 L 8.75 4.77 0.00 1.55 1.61 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.41 4.38 0.00 4.00 3.98 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 0.00 165 D 8.71 4.39 0.00 2.83 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 0.00 166 S 8.03 4.25 0.00 4.10 4.12 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 0.00 167 S 7.99 4.13 0.00 4.02 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 0.00 168 C 8.27 4.32 0.00 3.20 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 0.00 169 K 8.65 3.97 0.00 1.89 1.90 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.54 1.69 7.81 170 S 7.85 4.26 0.00 4.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.75 4.02 1.02 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 0.00 172 Y 7.72 4.89 0.00 3.14 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 0.00 173 P 0.00 4.54 0.00 2.08 2.05 0.00 3.90 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 174 G 9.03 3.98 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 0.00 0.00 0.00 175 Q 8.22 4.52 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.61 0.00 0.00 0.00 0.00 0.00 2.26 2.58 0.00 176 I 7.86 4.41 1.98 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 1.86 0.97 1.00 0.00 0.00 177 T 8.22 4.53 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 1.28 0.00 0.00 178 S 8.53 4.35 0.00 4.01 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 0.00 179 N 8.09 4.97 0.00 3.00 3.10 0.00 0.00 6.61 8.13 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 0.00 180 M 7.84 5.60 0.00 1.79 1.98 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 181 F 8.59 5.10 0.00 3.02 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 0.00 182 C 9.06 5.43 0.00 2.99 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 0.00 183 A 9.18 5.05 1.23 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 0.00 0.00 0.00 184A G 6.91 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 0.00 184 Y 8.39 4.65 0.00 2.99 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 0.00 185 L 8.65 4.15 0.00 1.73 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.27 4.03 0.00 2.10 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 2.34 2.26 0.00 187 G 8.04 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 188A G 9.84 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 0.00 0.00 0.00 188 K 7.28 4.83 0.00 1.50 1.69 0.00 0.83 0.00 0.00 1.01 0.00 0.00 2.56 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.20 7.81 189 D 8.82 4.61 0.00 2.84 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 0.00 190 S 8.76 4.95 0.00 4.00 4.01 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 0.00 191 C 9.34 4.78 0.00 2.92 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 0.00 192 Q 8.58 4.49 0.00 2.42 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.21 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 193 G 9.29 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.30 4.71 0.00 3.01 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 0.00 195 S 8.05 4.53 0.00 3.99 3.85 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 0.00 0.00 0.00 196 G 8.85 4.17 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 0.00 197 G 7.86 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 0.00 0.00 0.00 0.00 198 P 0.00 5.05 0.00 2.36 2.38 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 199 V 8.48 4.61 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 0.84 0.00 0.00 0.62 0.00 0.00 200 V 8.64 4.84 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 0.81 0.00 0.00 0.66 0.00 0.00 201 C 8.72 5.10 0.00 2.79 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 0.00 202 S 9.60 3.69 0.00 3.98 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 0.00 203 G 8.46 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 0.00 204 K 7.41 4.68 0.00 1.74 1.64 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.27 4.35 0.00 1.50 1.64 0.98 0.77 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 0.00 210 Q 8.79 4.47 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.38 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 211 G 7.98 5.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.20 5.21 1.92 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 1.30 0.95 0.99 0.00 0.00 213 V 8.94 3.80 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.23 0.00 0.00 214 S 8.47 4.82 0.00 3.90 3.81 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 0.00 215 W 7.19 4.96 0.00 3.38 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 0.00 216 G 8.49 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 0.00 0.00 0.00 217 S 8.40 4.65 0.00 4.38 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 *219 G 7.98 4.16 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 0.00 0.00 0.00 220 C 8.07 4.93 0.00 2.95 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 221A A 9.10 3.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.33 4.52 0.00 2.32 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.43 4.09 0.00 1.70 1.72 0.00 1.93 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.62 7.81 223 N 9.37 4.29 0.00 2.82 2.81 0.00 0.00 6.77 8.14 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 0.00 224 K 7.54 4.26 0.00 1.67 1.79 0.00 1.71 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.23 7.81 225 P 0.00 4.64 0.00 2.13 2.11 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 226 G 8.47 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 0.00 227 V 7.85 4.39 0.67 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 0.37 0.00 0.00 -0.74 0.00 0.00 228 Y 8.06 4.89 0.00 1.43 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.47 4.45 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 1.23 0.00 0.00 230 K 9.47 4.87 0.00 2.08 1.92 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.69 7.81 231 V 8.80 3.93 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.11 0.00 0.00 232 C 8.38 4.59 0.00 3.17 3.23 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 0.00 233 N 8.05 4.23 0.00 2.58 2.35 0.00 0.00 6.81 7.31 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 0.00 234 Y 8.15 4.78 0.00 3.08 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.11 3.68 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 1.09 0.00 0.00 1.11 0.00 0.00 236 S 8.11 4.17 0.00 3.97 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 0.00 237 W 8.30 4.16 0.00 3.51 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 0.00 238 I 8.30 3.19 2.04 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 1.64 1.03 0.76 0.00 0.00 239 K 7.95 3.76 0.00 1.83 1.77 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.41 7.81 240 Q 7.77 3.89 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 241 T 7.55 3.70 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 242 I 7.41 2.63 1.40 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.38 0.39 0.00 0.00 243 A 7.78 4.04 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 0.00 244 S 7.26 4.68 0.00 3.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.91 4.68 0.00 2.96 3.06 0.00 0.00 6.73 8.48 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 * Residues marked with a * may have inaccurate shift predictions.