NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9148 8.3549 109.7346 45.2965 0.0000 172.9673 3 R 4.0950 8.2067 117.8966 54.9293 31.1816 174.5680 4 K 5.0055 8.2858 118.6157 54.9500 36.8247 174.6732 5 I 5.1441 8.6502 121.3550 59.5887 42.1676 173.7830 6 V 4.9008 8.9668 127.7039 61.1912 34.4729 174.0886 7 F 5.3033 9.2108 126.5534 55.9542 41.6721 174.7783 8 F 5.4223 9.1564 120.3509 55.8954 42.6902 174.3264 9 D 4.8424 8.6306 122.8969 53.3153 42.0854 175.1043 10 I 3.9766 8.3806 121.9218 63.2097 37.9081 175.5358 11 D 4.5824 7.7122 121.8004 55.8500 41.5128 177.1264 12 G 4.0855 9.2504 113.5627 45.5870 0.0000 173.5147 13 T 4.5442 7.7194 112.6160 65.1416 70.6130 175.3793 14 L 4.2169 8.3237 119.9802 55.8326 42.4991 177.3773 15 L 4.9201 7.5503 118.1092 52.5806 44.0761 176.6407 16 D 4.8280 8.6643 122.9187 52.5833 41.0733 176.2379 17 E 3.9183 8.7787 118.5627 59.3384 29.6149 177.9128 18 Q 4.3952 8.2508 115.3538 55.2386 28.8633 175.4560 19 K 3.9377 8.0545 115.9611 57.5093 30.0097 175.5561 20 Q 4.4564 8.5426 118.0007 54.2055 30.2443 174.9321 21 L 4.7354 8.2043 123.8593 52.8743 42.5128 174.5806 22 P 4.3772 0.0000 0.0000 62.3961 32.3566 177.4948 23 L 3.9492 8.7046 122.7267 58.1154 41.5166 180.0353 24 S 4.0331 7.8997 112.9326 61.0877 62.9218 176.3788 25 T 4.0079 7.7509 119.9767 66.3960 68.1721 176.8484 26 I 3.6510 7.6052 121.4890 64.1517 37.1480 177.9147 27 E 3.8900 8.0788 119.4979 59.1660 29.4242 178.2621 28 A 4.2573 8.4502 121.2897 55.7057 18.4377 179.6919 29 V 3.4927 8.0404 116.2874 65.9975 31.5802 178.1017 30 R 3.8861 8.0076 118.3305 59.6646 30.0913 178.6065 31 R 3.9738 8.4613 118.0829 59.2282 30.0887 179.0174 32 L 3.9332 8.1238 118.7283 57.8475 41.6811 179.6817 33 K 4.0810 8.1429 118.2975 59.6444 31.7756 179.0359 34 Q 3.9878 7.9685 118.5843 59.2606 29.0422 177.9489 35 S 4.4253 7.6797 112.8335 58.6636 63.0906 175.0791 36 G 3.7708 7.9275 110.2851 45.1729 0.0000 173.3044 37 V 4.0095 7.3388 119.7044 61.8089 32.4976 175.5434 38 Y 4.7056 8.7049 126.2727 58.0682 39.1659 174.7012 39 V 5.0068 8.5853 122.7159 61.1720 34.0212 174.3674 40 A 5.2396 8.9309 128.1138 50.0090 23.2807 174.5113 41 I 5.1088 8.7386 119.6357 59.8902 39.6026 174.7278 42 A 5.3151 9.0593 127.3243 50.6522 21.5672 175.0610 43 T 4.3374 9.1944 116.6660 61.2625 71.2895 174.4544 44 G 3.8303 8.5616 111.7134 46.0916 0.0000 174.3609 45 R 3.8226 7.4667 119.5533 55.5468 30.7514 175.6820 46 A 2.7994 7.4165 122.0096 50.2383 19.4565 175.8504 47 P 3.5793 0.0000 0.0000 65.5171 31.8659 178.7848 48 F 4.4273 6.8521 112.6897 56.5618 36.0142 175.2734 *50 F 4.6684 7.6390 109.3864 57.3339 39.7365 177.4669 51 E 3.6529 8.0534 124.1597 60.2645 29.3953 177.0115 52 H 4.1083 8.1575 118.0133 59.2518 30.0244 177.1715 53 V 3.7799 7.7132 120.7918 65.5098 31.3043 177.9344 54 R 3.9645 7.7983 117.3474 59.3788 29.3992 179.2700 55 K 3.9707 8.3147 118.4531 59.3892 31.4474 179.4826 56 Q 3.9654 8.1961 118.5991 58.4672 28.4869 177.9365 57 L 4.5123 7.8538 116.4567 53.2668 42.4879 176.4992 58 G 3.8553 7.4690 106.1211 46.6346 0.0000 174.2584 59 I 4.3647 8.0488 121.0990 59.7463 38.0594 175.5966 60 D 5.2265 8.6786 124.9439 53.0108 40.8443 175.2095 61 S 4.9400 7.8065 114.4144 57.4214 66.8510 172.9154 62 F 5.1007 8.4811 117.2035 56.6359 41.8714 172.8900 63 V 4.8500 9.2512 120.4891 61.5427 33.6304 174.5535 64 S 5.1668 9.3636 122.9249 55.8267 66.9214 173.4935 65 F 4.3591 9.0279 115.2580 59.0365 36.7236 175.5887 66 N 4.3547 9.1343 109.9973 54.3725 36.8670 176.1922 67 G 4.0835 8.2955 106.0609 45.5676 0.0000 175.0772 68 Q 4.3780 8.3876 117.9079 57.3296 29.2694 174.8386 69 Y 4.8622 7.9231 120.1492 56.4879 41.6035 173.2245 70 V 4.7133 8.8240 128.1078 60.9316 34.4544 174.3185 71 V 4.4950 8.1429 127.8005 60.7647 34.5463 173.8074 72 F 4.8869 9.0364 129.2929 56.5921 41.9922 174.8940 73 E 3.9861 8.8436 127.2992 56.1198 27.2974 176.0378 74 G 3.9689 8.4642 106.3046 45.1505 0.0000 173.3513 75 N 4.9544 7.6569 117.3018 50.6859 41.2109 174.2515 76 V 3.6539 8.3128 122.0305 63.3528 32.0308 175.0599 77 L 4.5557 8.7908 129.5896 56.5049 43.8992 175.8661 78 Y 4.8781 7.4936 117.7181 56.2977 42.2755 173.5955 79 K 4.7903 7.5451 124.5314 55.6800 35.7212 175.3549 80 Q 4.4335 9.0762 126.3947 53.3377 29.8896 173.1100 81 P 4.4551 0.0000 0.0000 61.7566 32.4655 176.1543 82 L 4.3228 8.8401 122.5534 54.3842 42.6687 177.6097 83 R 3.9508 8.7914 121.2875 56.3976 30.2850 177.2486 84 R 3.9357 8.9631 124.1544 59.6053 29.9069 177.3674 85 E 3.9779 8.3272 118.2676 59.7753 29.5634 179.0990 86 K 4.2081 8.0767 117.5647 59.2255 32.1390 179.4890 87 V 3.6204 8.1870 119.1142 65.8425 31.4300 178.0367 88 R 3.8601 8.6010 119.8107 58.7481 29.9575 178.2951 89 A 4.1260 7.9545 120.0503 55.2696 18.4060 179.2351 90 L 3.6153 8.0623 118.8018 58.5237 41.9719 179.4163 91 T 3.8915 7.8904 115.5137 66.6364 68.5589 176.5865 92 E 4.0233 8.3477 120.3997 59.4321 29.1564 178.9669 93 E 4.0550 8.7958 119.4963 59.4290 29.7896 178.7213 94 A 4.8100 8.4791 122.3389 55.1755 18.4607 179.0129 95 H 4.1268 8.8390 117.1501 59.4202 29.6341 177.6114 96 K 4.1667 7.9715 119.2800 58.7845 31.8969 177.9444 97 N 4.8358 7.5286 113.9734 52.3233 38.7465 175.6003 98 G 3.7973 7.7283 108.0566 46.3102 0.0000 173.0323 99 H 4.9998 8.1063 117.3026 53.6253 29.7465 173.6669 100 P 4.7686 0.0000 0.0000 61.9545 33.8427 174.2844 101 L 5.9903 8.9348 118.9578 52.0422 46.5382 175.8673 102 V 4.4061 7.8842 118.8650 61.4579 34.6048 175.1184 103 F 5.0000 8.9433 128.0852 56.3095 41.2859 173.9270 *105 D 4.6264 8.1676 117.5512 53.4742 40.0647 174.8087 106 A 4.2305 8.7686 119.9801 55.2025 18.7113 179.5811 107 E 4.4784 8.6366 114.3354 57.8307 31.2841 175.4751 108 K 3.4206 8.7198 121.7537 55.4386 33.1182 176.0087 *110 R 4.2425 8.4429 114.8160 55.8910 31.8306 174.1415 111 A 4.9878 8.4821 124.4123 50.4005 20.9056 178.2056 112 S 4.4358 8.8341 116.4038 60.3190 64.0164 174.8346 113 I 4.6148 7.6001 119.9062 59.1286 40.2734 175.1037 114 G 3.8106 8.6224 113.0171 45.6038 0.0000 172.3703 115 D 4.2079 8.0670 117.6724 54.7223 40.0707 173.6632 116 H 4.5645 7.9279 116.4124 54.3470 31.6619 172.5036 117 P 4.3628 0.0000 0.0000 66.3171 31.0356 178.2410 118 H 4.5154 8.1717 115.5251 58.3252 28.5607 177.6272 119 I 3.0260 7.4735 120.6187 64.4625 37.0570 177.2889 120 H 4.2646 7.7086 115.4005 59.2503 28.7804 177.5446 121 V 3.8681 7.6974 119.6760 66.0221 30.0725 179.4925 122 S 3.8481 7.8975 110.5490 59.0666 62.5218 175.6040 *124 A 4.8115 8.2865 127.0399 52.9832 20.2098 179.9305 125 S 4.2296 7.9984 109.8011 60.8735 63.2112 175.0923 126 L 4.4542 7.5274 116.8065 54.1523 41.6491 176.3943 127 K 4.0249 8.2847 117.4530 57.8254 29.4164 175.6588 128 F 4.7119 8.1131 115.1528 55.4447 42.1003 175.2417 129 A 4.3630 8.4563 126.1432 51.1785 19.4628 176.9342 130 H 4.0537 8.7018 119.3966 55.7374 30.1578 173.6859 131 P 4.4249 0.0000 0.0000 61.8871 32.0762 174.3451 132 P 4.4776 0.0000 0.0000 62.8745 32.6874 175.3708 133 V 4.4638 8.0769 121.8048 62.5511 32.9887 175.7794 134 D 4.6987 9.2017 122.7890 53.1243 43.1946 174.0602 135 P 4.7258 0.0000 0.0000 64.3429 32.1438 177.1439 136 L 4.4545 8.1431 117.9659 54.2687 42.3944 177.9055 137 Y 3.9654 8.1444 123.4906 60.7328 38.5908 178.0197 138 Y 4.0543 7.3082 117.1437 59.2380 38.3802 177.6975 139 E 3.6656 6.6227 119.8782 58.1854 29.4691 177.1448 140 N 4.8346 7.5774 112.1241 51.8486 38.3832 173.9239 141 K 4.4481 7.0766 116.0700 54.4452 35.7228 175.5299 142 D 4.3218 8.3859 121.5849 53.9721 41.5388 175.9558 143 I 4.2738 7.8728 124.2688 59.7799 39.2348 175.7458 144 Y 4.0068 7.6168 121.0531 58.3365 39.0647 175.1554 145 Q 4.6008 6.9402 117.2912 55.3153 32.0004 172.2370 146 A 4.9371 8.2493 124.3300 50.3524 23.7644 174.6242 147 L 4.9021 8.7495 118.3282 52.8610 45.2778 175.7845 148 L 4.7391 8.3965 125.6909 53.2711 44.3930 175.0135 149 F 5.3192 9.0934 126.2161 55.9894 39.5028 174.6193 150 C 4.7348 8.0262 116.6444 57.5244 32.0976 173.8627 151 R 4.5831 9.5624 118.8133 54.3883 31.1078 177.8589 152 A 4.6635 8.3181 122.2254 54.9133 17.9482 179.7504 153 E 4.0690 8.1682 115.4585 58.4373 29.7428 177.8636 154 E 4.5284 7.9986 117.0380 56.4487 30.7610 177.3878 155 E 4.2403 8.0504 118.0110 59.3798 29.6022 178.8461 156 E 3.7047 7.8606 119.7784 58.5313 29.9687 176.8309 157 P 4.1068 0.0000 0.0000 65.9098 31.4330 177.9055 158 Y 4.5071 7.3332 114.5330 61.2841 37.5523 178.8192 159 V 3.5759 7.3184 117.3632 66.1901 31.6523 177.7746 160 R 4.0520 8.0671 117.1732 59.4712 30.1199 177.7188 161 N 4.5008 8.8945 114.8391 54.0865 40.2886 175.0628 162 Y 5.4617 8.1855 117.5529 54.4878 38.2725 174.2398 163 P 4.5894 0.0000 0.0000 64.2371 32.3634 177.9959 164 E 4.1466 8.0374 116.8482 57.3447 30.1887 175.5700 165 F 5.6334 7.9033 117.7008 55.7435 42.8626 174.6028 166 R 4.6168 9.0898 120.4880 54.7656 32.7176 174.0551 167 F 5.0334 9.1993 125.7331 56.3132 40.3558 175.5226 168 V 4.3878 8.4933 124.8487 60.8257 33.6108 174.6907 169 R 4.6308 8.9915 129.0911 55.4859 30.4135 176.0385 170 W 5.1349 8.3059 119.3034 55.9957 29.9786 173.9046 171 H 4.5625 7.0796 118.1500 54.3322 32.6104 173.5412 172 D 4.3294 7.9938 122.2413 56.8706 41.0459 178.3994 173 V 4.5243 7.6439 110.0116 60.5143 33.6410 175.0843 174 S 4.5992 7.3932 113.6023 57.1823 66.0800 172.9124 175 T 4.7397 8.5426 120.5697 60.2483 71.1564 172.6443 176 D 4.8260 9.5282 127.3948 54.2171 42.8886 175.8074 177 V 4.0282 8.6010 122.1669 61.2692 33.4784 174.3427 178 L 5.1732 8.2008 127.7178 51.7156 45.7429 174.1879 179 P 5.1335 0.0000 0.0000 62.2105 32.8420 175.8485 180 A 4.1572 8.5598 126.4958 54.0447 18.6651 178.0347 181 G 4.0119 9.2319 111.1735 44.9055 0.0000 173.5940 182 G 4.1033 7.7208 109.1192 44.5147 0.0000 173.9051 183 S 4.6034 7.8885 115.9085 56.0187 66.6343 176.4859 184 K 4.0208 8.4675 122.4697 59.8930 32.4234 179.1967 185 A 3.7592 7.7892 121.8718 54.7833 18.0697 179.0040 186 E 3.6590 7.5951 116.9370 59.2200 29.7577 178.9917 187 G 3.6302 7.6940 104.9259 47.7905 0.0000 175.5243 188 I 3.5952 7.4566 121.4503 63.2569 38.6702 177.9300 189 R 4.2440 7.3451 121.0082 56.4364 25.5763 176.7742 *192 I 4.1906 7.4225 114.6388 60.8667 40.4599 178.8819 193 E 3.9302 8.1896 120.7315 59.3811 29.5072 179.3693 194 K 3.9714 7.9423 116.4135 59.3704 32.2074 178.4202 195 L 3.8550 7.7127 116.9033 55.4337 41.8306 176.8639 196 G 3.7554 7.5428 106.4390 46.6949 0.0000 173.3891 197 I 4.4016 7.9191 120.6804 58.9180 38.9723 176.0476 198 D 4.4804 8.4733 125.4638 53.7431 41.6020 177.0884 199 K 3.7492 8.8249 124.5217 59.4666 32.1018 178.4896 200 K 3.8960 7.9210 115.6422 58.7691 32.7229 176.6606 201 D 4.8981 8.4933 119.5334 53.9866 42.6992 175.1234 202 V 4.8384 7.7573 120.6318 61.5719 33.3807 174.4103 203 Y 5.2648 9.2196 124.5950 56.4718 42.0696 174.3940 204 A 5.2944 8.6616 121.2137 50.8808 23.4093 175.1864 205 F 5.2554 9.4393 119.9974 55.7719 41.8853 174.9951 206 G 4.4989 9.4138 110.2024 44.9282 0.0000 172.4291 207 D 4.6270 9.1405 115.4494 53.8822 44.0112 175.2664 208 G 4.3241 8.4726 107.4792 43.0436 0.0000 174.1067 209 L 4.1181 8.3655 118.6208 57.6178 41.5793 179.1798 210 N 4.5977 8.1120 113.4887 54.2550 37.4798 175.0279 211 D 4.7325 8.1326 118.5339 54.6571 42.0728 177.6268 212 I 3.8235 7.7172 121.4339 64.5901 37.3446 178.9298 213 E 3.9870 8.1106 117.0339 57.0028 28.6335 178.0345 *215 L 4.3129 8.0339 119.4648 54.2727 43.5066 179.2250 216 S 4.2660 8.0993 111.8285 60.4658 63.5896 175.4421 217 F 4.2742 8.2161 123.2183 60.9487 39.2580 176.1779 218 V 3.4759 7.4979 111.8123 60.5529 32.2117 176.2625 219 G 3.5995 8.4056 108.7141 49.3449 0.0000 174.0139 220 T 4.5884 7.7127 121.2862 61.1275 71.5257 173.1745 221 G 4.2366 9.6854 115.1556 44.2772 0.0000 171.4416 222 V 4.8541 8.7726 124.4620 60.9514 33.8635 173.5651 223 A 5.0625 7.9887 134.2592 51.0636 21.1039 178.3872 *225 G 3.8351 8.7905 100.8636 45.9644 0.0000 173.8799 226 N 4.8960 7.9331 115.6070 52.5087 39.2936 175.0417 227 A 4.5908 7.8167 119.9225 51.3323 19.9946 177.7577 228 H 4.2250 8.1076 119.5555 56.4226 30.6361 176.6699 229 E 4.0389 8.5451 124.3746 59.3754 29.0523 179.3259 230 E 4.1211 8.4650 117.2280 58.5504 29.9064 178.7346 231 V 3.8472 7.8736 118.8897 65.6730 31.6676 178.1942 232 K 4.0337 7.9872 117.7185 59.1001 31.6668 179.1175 233 R 3.8622 7.8817 119.0394 59.4216 30.0037 177.8529 234 V 3.8750 7.2031 107.2853 62.1038 32.0326 176.4067 235 A 4.2312 7.3447 123.5508 52.0514 18.7356 177.4241 236 D 4.6550 8.7672 121.9875 56.2959 41.8483 176.6797 237 F 4.7381 7.8913 119.6837 56.9320 43.0130 172.5553 238 V 4.5723 7.4437 125.5868 61.5870 32.7670 174.9402 239 T 4.6973 8.4901 123.6341 60.3887 70.3263 173.7440 240 K 4.1975 8.6846 121.3063 55.0968 33.0868 174.9128 241 P 4.6166 0.0000 0.0000 62.2989 31.8621 178.1864 242 V 3.7015 8.4739 119.9328 64.9303 31.1669 176.7270 243 D 4.8242 8.0442 117.1086 53.0429 39.3644 176.2286 244 K 4.5886 7.6403 118.7230 56.7374 33.0869 175.7546 245 E 3.9187 8.5332 114.0500 57.2653 27.3689 177.4237 246 G 4.1304 8.5202 107.6363 47.5813 0.0000 175.6935 247 I 3.8577 7.8864 122.0899 63.5773 37.2559 178.1469 248 W 4.1002 8.3194 128.6994 60.6415 30.6154 177.0374 249 Y 4.2148 8.9495 119.9642 60.6925 38.2115 178.2126 250 G 3.9084 8.6882 106.6496 48.1787 0.0000 175.5768 251 L 3.9694 8.2331 122.1087 56.9865 41.4770 179.7611 252 K 3.7686 7.5070 120.9332 58.7523 31.9029 178.5840 253 Q 3.6361 7.5645 118.7864 59.1133 29.0456 177.9986 254 L 3.8996 7.5552 116.9665 54.8612 41.6187 177.1186 255 Q 3.5118 7.5025 116.8474 56.9218 26.5584 174.7101 256 L 4.0656 7.8178 119.2438 56.0582 41.8571 177.3985 257 I 3.9814 7.1509 124.2695 61.2454 37.8907 175.0110 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 8.35 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 0.00 0.00 0.00 3 R 8.21 4.10 0.00 1.92 1.67 0.00 2.40 0.00 0.00 2.92 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 4 K 8.29 5.01 0.00 1.66 1.80 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.42 7.81 5 I 8.65 5.14 2.07 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.66 1.12 0.00 0.00 6 V 8.97 4.90 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 0.47 0.00 0.00 0.87 0.00 0.00 7 F 9.21 5.30 0.00 3.01 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 8 F 9.16 5.42 0.00 2.98 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 9 D 8.63 4.84 0.00 2.80 2.66 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 10 I 8.38 3.98 1.76 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.34 0.88 0.00 0.00 11 D 7.71 4.58 0.00 2.67 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 12 G 9.25 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 13 T 7.72 4.54 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 14 L 8.32 4.22 0.00 1.70 1.64 0.87 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.55 4.92 0.00 1.68 1.45 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.66 4.83 0.00 2.90 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 17 E 8.78 3.92 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 18 Q 8.25 4.40 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.44 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 19 K 8.05 3.94 0.00 1.91 1.95 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.45 7.81 20 Q 8.54 4.46 0.00 2.47 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 21 L 8.20 4.74 0.00 1.55 1.56 0.89 0.91 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 22 P 0.00 4.38 0.00 2.21 1.95 0.00 3.69 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 23 L 8.70 3.95 0.00 1.66 1.64 0.88 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.90 4.03 0.00 3.78 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.75 4.01 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 26 I 7.61 3.65 2.02 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 1.47 0.50 0.88 0.00 0.00 27 E 8.08 3.89 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 28 A 8.45 4.26 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.04 3.49 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 1.03 0.00 0.00 0.74 0.00 0.00 30 R 8.01 3.89 0.00 1.95 2.21 0.00 3.16 0.00 0.00 3.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 31 R 8.46 3.97 0.00 2.06 1.97 0.00 3.42 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 32 L 8.12 3.93 0.00 1.86 1.72 1.01 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 33 K 8.14 4.08 0.00 1.97 1.88 0.00 1.81 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.49 7.81 34 Q 7.97 3.99 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 35 S 7.68 4.43 0.00 4.02 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 36 G 7.93 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 0.00 0.00 0.00 37 V 7.34 4.01 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 0.75 0.00 0.00 0.83 0.00 0.00 38 Y 8.70 4.71 0.00 3.08 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 39 V 8.59 5.01 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 1.00 0.00 0.00 1.03 0.00 0.00 40 A 8.93 5.24 1.05 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 41 I 8.74 5.11 2.15 0.00 0.00 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 1.41 0.76 0.66 0.00 0.00 42 A 9.06 5.32 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 9.19 4.34 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 0.47 0.00 0.00 44 G 8.56 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 45 R 7.47 3.82 0.00 1.61 1.68 0.00 2.86 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.33 0.00 46 A 7.42 2.80 0.28 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 47 P 0.00 3.58 0.00 2.21 2.10 0.00 3.27 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.33 0.00 48 F 6.85 4.43 0.00 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0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 58 G 7.47 3.86 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 0.00 0.00 0.00 59 I 8.05 4.36 1.95 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 1.40 0.84 1.15 0.00 0.00 60 D 8.68 5.23 0.00 2.68 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 61 S 7.81 4.94 0.00 3.93 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 62 F 8.48 5.10 0.00 3.33 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 9.25 4.85 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 1.05 0.00 0.00 64 S 9.36 5.17 0.00 4.12 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 9.03 4.36 0.00 3.32 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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3.24 3.35 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.77 0.00 1.93 2.04 0.00 3.88 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.29 0.00 101 L 8.93 5.99 0.00 1.11 1.14 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.88 4.41 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 1.13 0.00 0.00 0.97 0.00 0.00 103 F 8.94 5.00 0.00 3.11 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 *105 D 8.17 4.63 0.00 3.00 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 0.00 106 A 8.77 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.64 4.48 0.00 2.01 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 2.31 2.41 0.00 108 K 8.72 3.42 0.00 1.44 1.33 0.00 1.54 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 118 H 8.17 4.52 0.00 3.32 3.55 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 7.47 3.03 1.65 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.30 0.28 0.00 0.00 120 H 7.71 4.26 0.00 3.33 3.40 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.70 3.87 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 1.14 0.00 0.00 0.99 0.00 0.00 122 S 7.90 3.85 0.00 3.73 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 *124 A 8.29 4.81 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 0.00 125 S 8.00 4.23 0.00 4.12 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 0.00 126 L 7.53 4.45 0.00 1.81 2.03 0.86 0.45 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 0.00 127 K 8.28 4.02 0.00 1.85 1.84 0.00 1.65 0.00 0.00 1.94 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.53 7.81 128 F 8.11 4.71 0.00 3.19 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 8.46 4.36 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.70 4.05 0.00 3.03 3.18 0.00 5.74 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.42 0.00 2.00 1.90 0.00 3.48 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 132 P 0.00 4.48 0.00 2.02 1.95 0.00 3.50 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 2.05 2.07 0.00 133 V 8.08 4.46 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 0.79 0.00 0.00 0.96 0.00 0.00 134 D 9.20 4.70 0.00 2.77 2.60 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 0.00 135 P 0.00 4.73 0.00 2.19 2.28 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.49 0.00 136 L 8.14 4.45 0.00 1.58 1.33 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.14 3.97 0.00 3.30 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 7.31 4.05 0.00 2.90 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 6.62 3.67 0.00 1.71 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 0.00 1.47 1.83 0.00 140 N 7.58 4.83 0.00 2.57 2.69 0.00 0.00 5.80 7.13 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 0.00 141 K 7.08 4.45 0.00 1.14 1.33 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.74 0.48 7.81 142 D 8.39 4.32 0.00 2.46 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 7.87 4.27 1.78 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.34 0.96 0.00 0.00 144 Y 7.62 4.01 0.00 1.58 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 6.94 4.60 0.00 1.80 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.40 0.00 146 A 8.25 4.94 1.08 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 0.00 0.00 147 L 8.75 4.90 0.00 1.48 0.99 1.02 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.40 4.74 0.00 1.61 1.38 0.51 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 149 F 9.09 5.32 0.00 2.93 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 0.00 150 C 8.03 4.73 0.00 2.78 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 0.00 151 R 9.56 4.58 0.00 1.84 2.02 0.00 3.17 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.51 0.00 152 A 8.32 4.66 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 0.00 153 E 8.17 4.07 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 154 E 8.00 4.53 0.00 2.00 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 2.32 2.31 0.00 155 E 8.05 4.24 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.29 0.00 156 E 7.86 3.70 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 157 P 0.00 4.11 0.00 1.65 1.86 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 1.92 2.06 0.00 158 Y 7.33 4.51 0.00 2.60 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 0.00 0.00 0.00 0.00 159 V 7.32 3.58 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.82 0.00 0.00 160 R 8.07 4.05 0.00 2.01 1.98 0.00 3.51 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 161 N 8.89 4.50 0.00 2.55 2.42 0.00 0.00 6.86 7.34 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 0.00 162 Y 8.19 5.46 0.00 3.62 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 0.00 163 P 0.00 4.59 0.00 2.19 2.21 0.00 3.81 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 1.96 1.93 0.00 164 E 8.04 4.15 0.00 1.84 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 0.00 1.87 1.88 0.00 165 F 7.90 5.63 0.00 2.85 2.33 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 0.00 166 R 9.09 4.62 0.00 1.89 1.74 0.00 3.19 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 167 F 9.20 5.03 0.00 2.99 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 0.00 168 V 8.49 4.39 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 1.00 0.00 0.00 0.97 0.00 0.00 169 R 8.99 4.63 0.00 1.87 1.81 0.00 3.01 0.00 0.00 3.91 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.36 0.00 170 W 8.31 5.13 0.00 3.57 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 H 7.08 4.56 0.00 1.43 1.84 0.00 5.59 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 D 7.99 4.33 0.00 2.53 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 0.00 173 V 7.64 4.52 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 0.70 0.00 0.00 0.97 0.00 0.00 174 S 7.39 4.60 0.00 3.58 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 0.00 175 T 8.54 4.74 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 1.29 0.00 0.00 176 D 9.53 4.83 0.00 2.74 2.52 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 0.00 177 V 8.60 4.03 1.77 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 -0.05 0.00 0.00 0.64 0.00 0.00 178 L 8.20 5.17 0.00 1.61 1.52 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 5.13 0.00 2.21 2.29 0.00 3.83 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 2.14 2.06 0.00 180 A 8.56 4.16 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 G 9.23 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 0.00 182 G 7.72 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 0.00 0.00 0.00 183 S 7.89 4.60 0.00 4.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 K 8.47 4.02 0.00 1.98 2.10 0.00 1.49 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.45 7.81 185 A 7.79 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 E 7.60 3.66 0.00 1.82 2.11 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 2.23 2.21 0.00 187 G 7.69 3.63 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 0.00 0.00 0.00 188 I 7.46 3.60 1.77 0.00 0.00 0.40 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 0.34 0.54 0.00 0.00 189 R 7.35 4.24 0.00 1.36 1.77 0.00 3.14 0.00 0.00 2.92 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 *192 I 7.42 4.19 2.11 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.02 1.17 0.00 0.00 193 E 8.19 3.93 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 194 K 7.94 3.97 0.00 1.64 1.80 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.39 7.81 195 L 7.71 3.86 0.00 1.53 1.57 0.48 -0.54 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 0.00 196 G 7.54 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 I 7.92 4.40 1.94 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 1.03 0.00 0.00 198 D 8.47 4.48 0.00 2.90 2.54 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 0.00 0.00 0.00 0.00 199 K 8.82 3.75 0.00 1.60 1.66 0.00 1.45 0.00 0.00 1.52 0.00 0.00 2.13 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 0.93 7.81 200 K 7.92 3.90 0.00 1.81 1.83 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.41 7.81 201 D 8.49 4.90 0.00 2.67 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 0.00 202 V 7.76 4.84 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 1.17 0.00 0.00 1.02 0.00 0.00 203 Y 9.22 5.26 0.00 2.91 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 0.00 204 A 8.66 5.29 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 F 9.44 5.26 0.00 3.02 3.19 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 0.00 206 G 9.41 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 9.14 4.63 0.00 2.78 2.64 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 0.00 0.00 0.00 0.00 208 G 8.47 4.32 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 0.00 209 L 8.37 4.12 0.00 1.70 1.71 0.85 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.11 4.60 0.00 2.83 2.94 0.00 0.00 5.97 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 0.00 211 D 8.13 4.73 0.00 2.87 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 0.00 212 I 7.72 3.82 1.97 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 1.19 0.95 0.92 0.00 0.00 213 E 8.11 3.99 0.00 1.99 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 2.33 2.31 0.00 *215 L 8.03 4.31 0.00 2.06 1.74 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.10 4.27 0.00 4.01 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 0.00 217 F 8.22 4.27 0.00 3.03 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 0.00 218 V 7.50 3.48 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 0.79 0.00 0.00 0.97 0.00 0.00 219 G 8.41 3.60 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 0.00 220 T 7.71 4.59 3.86 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 1.22 0.00 0.00 221 G 9.69 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 0.00 0.00 0.00 0.00 222 V 8.77 4.85 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 0.00 0.00 0.89 0.00 0.00 0.53 0.00 0.00 223 A 7.99 5.06 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 *225 G 8.79 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 0.00 226 N 7.93 4.90 0.00 2.73 2.84 0.00 0.00 6.86 7.35 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 0.00 227 A 7.82 4.59 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 H 8.11 4.23 0.00 3.23 3.18 0.00 5.60 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 E 8.55 4.04 0.00 2.00 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 2.37 2.34 0.00 230 E 8.47 4.12 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 231 V 7.87 3.85 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 1.06 0.00 0.00 1.00 0.00 0.00 232 K 7.99 4.03 0.00 1.96 1.82 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.70 7.81 233 R 7.88 3.86 0.00 1.91 2.12 0.00 3.26 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 234 V 7.20 3.87 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 0.71 0.00 0.00 1.03 0.00 0.00 235 A 7.34 4.23 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 D 8.77 4.65 0.00 2.66 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 0.00 237 F 7.89 4.74 0.00 3.03 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 0.00 238 V 7.44 4.57 1.83 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 0.79 0.00 0.00 0.82 0.00 0.00 239 T 8.49 4.70 4.73 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 1.59 0.00 0.00 240 K 8.68 4.20 0.00 1.89 1.69 0.00 1.48 0.00 0.00 1.56 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.08 7.81 241 P 0.00 4.62 0.00 2.28 1.99 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 242 V 8.47 3.70 2.33 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 0.78 0.00 0.00 1.01 0.00 0.00 243 D 8.04 4.82 0.00 2.81 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 0.00 244 K 7.64 4.59 0.00 1.87 1.79 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.50 7.81 245 E 8.53 3.92 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 246 G 8.52 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 0.00 0.00 0.00 247 I 7.89 3.86 1.89 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 1.47 0.67 0.70 0.00 0.00 248 W 8.32 4.10 0.00 3.66 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 0.00 249 Y 8.95 4.21 0.00 3.25 3.37 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 0.00 0.00 0.00 0.00 250 G 8.69 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 0.00 0.00 0.00 251 L 8.23 3.97 0.00 1.60 1.51 0.90 1.06 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 0.00 252 K 7.51 3.77 0.00 1.47 1.52 0.00 1.25 0.00 0.00 0.99 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.11 7.81 253 Q 7.56 3.64 0.00 1.68 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 254 L 7.56 3.90 0.00 1.39 1.54 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 255 Q 7.50 3.51 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.97 0.00 0.00 0.00 0.00 0.00 2.15 2.37 0.00 256 L 7.82 4.07 0.00 1.48 1.47 0.02 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 257 I 7.15 3.98 1.33 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.95 0.39 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.