NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3401 8.2729 122.0524 56.2425 34.1286 174.6076 3 K 4.9048 8.5824 128.8606 53.4259 33.3562 174.6326 4 L 4.9526 8.7674 124.3777 52.2791 45.9103 174.8852 5 T 5.0410 9.7723 118.0620 60.4718 69.6629 173.0612 6 I 4.9137 8.9195 129.5221 59.4970 40.6679 174.6597 7 G 4.4608 8.8182 113.8312 44.8495 0.0000 172.0751 8 L 5.1979 9.0559 126.3076 53.2761 44.2348 175.0633 9 I 4.8904 8.7413 126.3338 59.7247 41.9473 174.0525 10 G 4.4314 8.1643 114.1364 46.4100 0.0000 172.1315 11 N 5.0764 8.7543 116.4283 51.6089 39.3055 173.2812 12 P 4.3189 0.0000 0.0000 63.0913 31.9184 175.6134 13 N 4.2481 8.5787 111.4589 54.5475 35.9816 175.1136 14 S 4.5952 7.6485 109.7685 58.2764 63.6265 175.1823 15 G 3.9226 8.3304 107.7639 46.2796 0.0000 175.8894 16 K 3.9593 7.9838 122.2178 59.6670 32.1442 179.0156 17 T 3.9530 7.8388 115.5490 66.8307 68.4694 176.5759 18 T 3.8807 7.9443 117.2398 66.7144 68.4656 176.1709 19 L 4.2056 8.0497 123.4290 57.3597 42.0777 178.5574 20 F 4.0147 8.2341 120.7047 61.6078 39.2761 176.9826 21 N 4.3290 8.5090 115.9637 56.3313 37.9269 177.3929 22 Q 3.9311 8.1053 119.4489 59.0672 28.5769 179.0844 23 L 3.7513 7.7691 119.1424 57.0554 41.9932 178.6686 24 T 4.4941 7.3724 109.8180 59.7210 69.7128 176.3034 25 G 3.6444 8.4460 110.9898 47.0660 0.0000 174.8773 26 S 4.4319 8.6846 118.3288 58.6374 64.0056 175.0885 27 R 4.3775 7.8981 123.9260 54.7398 28.3917 175.0777 28 Q 5.1126 7.4586 115.3333 54.6640 32.5910 175.8328 29 R 4.6848 9.1223 120.3385 54.4665 33.4862 174.7497 30 V 4.3166 8.4543 123.3823 61.6762 32.7597 174.8140 31 G 4.2465 8.7655 117.8046 45.4423 0.0000 170.4680 32 N 5.4032 8.3357 119.6666 51.7370 42.4793 175.4821 33 W 4.3262 9.3473 126.4295 56.2323 30.3733 175.5704 34 A 4.0472 9.0836 127.0457 54.1736 17.9248 177.9854 35 G 3.9777 9.0971 110.6659 45.6922 0.0000 172.6818 36 V 4.5421 7.7790 111.8945 59.9370 34.9191 175.3465 37 T 4.5771 8.2556 107.9489 61.5701 69.0343 174.6114 38 V 3.8601 7.6029 123.6132 62.9002 32.6716 174.8147 39 E 4.4478 8.9883 129.3365 56.4493 30.5048 175.7341 40 R 4.2259 8.2670 126.7117 54.4035 32.3429 174.2646 41 K 4.7938 8.2597 126.5375 55.4995 33.8417 175.9244 42 E 5.3794 8.9919 123.4333 54.9899 33.7804 174.9514 43 G 4.4646 8.8308 107.8251 45.5901 0.0000 171.6247 44 Q 5.2733 9.0003 118.5424 53.9221 32.5289 175.0664 45 F 5.1592 8.7973 117.6923 55.3741 42.0658 173.2593 46 S 5.0400 8.8349 113.0782 57.1116 65.7984 173.5254 47 T 4.9122 8.4561 116.3293 60.8094 69.7271 173.6564 48 T 4.0646 8.3822 116.1887 66.4024 68.3975 175.2421 49 D 4.8159 8.0579 117.7616 54.3407 42.3930 175.6646 50 H 5.2633 7.7373 115.5091 53.9883 33.8945 171.8087 51 Q 4.7032 9.1405 122.7775 54.4934 31.0882 174.2184 52 V 4.5364 8.5087 127.2830 61.3656 33.9154 174.3435 53 T 4.8203 8.4833 124.9903 62.1976 70.1895 173.2945 54 L 5.0695 8.8871 130.0782 53.4084 44.4149 175.1124 55 V 4.5169 8.7735 127.3736 61.0010 33.3018 174.1225 56 D 4.7213 8.5559 129.4994 54.2267 41.3145 175.4831 57 L 4.7462 8.3737 126.4675 52.5348 43.3207 175.1945 58 P 4.2063 0.0000 0.0000 62.4182 31.8620 176.6047 59 G 3.7665 8.4057 110.8649 46.7439 0.0000 172.4190 60 T 4.4560 8.2741 115.4789 61.1116 70.5494 173.7889 61 Y 4.5932 8.3445 122.7806 58.4952 38.7965 175.6904 62 S 4.9794 7.5599 111.8991 57.4839 65.6880 174.6866 63 L 4.3980 9.6444 126.4476 57.3902 41.8243 178.6720 64 T 4.2169 7.9168 115.6142 63.5108 67.6287 174.7608 *71 S 4.2877 7.9007 115.2297 57.8306 65.4596 173.3224 72 L 3.9419 8.2250 121.8394 58.4912 41.3767 178.9208 73 D 4.2027 8.2381 117.7594 57.6113 40.5871 178.2983 74 E 3.8657 7.7854 115.7905 60.0278 29.6095 179.6008 75 Q 4.0736 7.9356 117.2736 58.7374 28.6097 178.7117 76 I 3.3349 7.6519 120.7376 64.1276 37.0074 177.8819 77 A 3.8566 7.7695 121.0659 55.6845 18.0147 179.1743 78 C 4.0158 7.8391 116.5584 62.8187 31.6791 175.1606 79 H 4.3570 8.4711 121.4790 58.7761 29.1783 176.6771 80 Y 4.0117 8.3326 121.5817 60.9242 38.5227 177.6701 81 I 3.6951 7.8288 119.6509 64.2290 37.2761 177.2981 82 L 4.1553 7.2365 118.7526 56.2509 42.6025 178.3047 83 S 4.1890 7.7830 114.4327 59.4209 62.6429 176.0826 84 G 3.7852 7.1820 109.1392 45.1777 0.0000 173.5536 85 D 4.3173 7.2558 118.5832 57.0109 41.2663 177.0944 86 A 4.5212 7.1974 119.7206 51.1757 19.2527 176.9639 87 D 4.6003 8.8646 122.6499 57.0865 41.7129 176.5852 88 L 4.5725 7.5271 117.7674 53.8488 45.7187 173.8663 89 L 5.2006 8.7886 123.7054 53.0483 45.1652 175.3973 90 I 4.6858 8.6441 123.6148 59.8269 39.4068 174.1886 91 N 5.1411 9.2164 127.5276 51.9148 40.6157 174.0262 92 V 4.3781 8.6075 128.4482 62.4634 32.8162 174.7306 93 V 4.3099 8.4764 128.7491 60.9046 34.1570 174.1035 94 D 4.9159 9.4416 128.1574 53.7280 40.9825 176.6963 95 A 4.0733 8.7157 130.9778 54.7074 18.5262 178.1511 96 S 4.5597 8.5571 109.0912 59.1137 64.0813 174.1943 97 N 5.0814 8.4013 120.0355 51.2970 39.7813 175.8815 98 L 3.9558 8.2529 122.4714 58.4212 42.3208 177.1436 99 E 3.9471 8.0822 117.0280 59.4087 30.1555 178.2216 100 R 4.1177 8.0163 118.2332 59.6174 30.3798 178.0624 101 N 4.6426 8.4666 116.2636 55.9805 38.5439 176.9636 102 L 4.4859 8.2084 120.8611 55.9142 41.6310 178.4895 103 Y 3.9056 7.7603 119.4282 60.5652 38.8196 177.6469 104 L 4.1851 7.8353 120.1468 58.5206 42.0816 179.0335 105 T 3.8649 7.8319 115.2613 66.5143 68.3511 176.1034 106 L 3.9231 8.0709 122.3071 58.2164 42.0003 179.1382 107 Q 4.0176 7.5922 117.4677 58.8094 28.1884 178.3842 108 L 3.7549 7.5403 119.5069 58.0852 41.8687 179.8264 109 L 3.9916 7.9987 118.5596 57.7419 41.2628 179.5061 110 E 4.0382 8.2392 118.2888 59.3174 29.5222 179.1070 111 L 3.8518 7.6846 118.2408 55.4677 41.5009 178.2445 112 G 3.8392 7.4306 105.8202 45.8899 0.0000 173.3307 113 I 3.9658 7.0809 119.7785 59.5678 37.8802 174.2193 114 P 4.5120 0.0000 0.0000 63.7990 32.1363 174.7097 115 C 5.2459 9.0320 123.1329 57.8465 35.3476 173.2094 116 I 4.6238 8.4337 124.3156 59.6288 41.0873 174.3739 117 V 4.4339 8.5804 127.6472 62.1059 32.9783 174.6196 118 A 4.9698 9.0208 131.4006 50.3229 20.3325 175.7649 119 L 4.5103 8.8493 123.3275 55.5058 42.9817 176.3563 120 N 4.8550 9.3717 125.2239 52.1293 39.3882 174.9380 *122 L 4.3108 8.3673 126.6723 54.8104 44.0641 179.5132 123 D 3.9846 7.9223 117.8121 57.1385 40.4625 178.7982 124 I 3.7351 7.6692 119.1968 64.1523 37.5289 177.6935 125 A 4.1703 8.1259 123.5466 55.8565 18.3296 179.5800 126 E 3.9183 8.9204 117.5721 61.6613 29.5215 181.7789 127 K 4.2362 7.7382 117.8403 58.4260 30.7620 178.3381 128 Q 4.5595 8.0859 116.6722 55.5589 29.2684 175.5622 129 N 4.2453 7.9743 115.0278 55.1226 36.6082 174.1506 130 I 4.2586 7.2917 120.2056 60.5053 38.2413 176.2516 131 R 4.7224 8.3681 123.7163 54.1731 31.9823 171.2670 132 I 4.8531 8.0493 121.3260 58.9592 39.6295 176.3179 133 E 4.2296 9.2315 126.7891 55.0099 28.7816 177.0411 134 I 3.6826 8.0975 126.9650 64.5370 37.4822 177.7906 135 D 4.3650 8.0802 118.7222 57.0124 40.6450 178.6164 136 A 3.9871 7.9057 121.1259 54.8773 18.4843 179.2232 137 L 3.8500 8.1089 119.0366 58.3787 42.1710 179.0614 138 S 4.1634 8.4116 113.2065 61.4428 62.0852 175.9234 139 A 3.9798 8.1586 122.6084 55.3639 18.1927 179.5614 140 R 4.0432 7.7043 115.0253 58.7977 30.2268 178.6152 141 L 4.3039 7.8803 118.2392 54.9537 42.1212 177.8780 142 G 3.9280 9.2806 106.5802 45.5133 0.0000 172.0703 143 C 5.0718 7.5269 111.8499 55.5114 33.0775 171.8837 144 P 4.4932 0.0000 0.0000 62.7230 32.4465 175.5125 145 V 4.6980 8.3047 121.9329 61.2564 34.0287 174.6207 146 I 4.5401 8.9853 129.6788 58.5238 39.5656 173.3283 147 P 4.5151 0.0000 0.0000 62.9404 31.5778 177.4228 148 L 4.3908 8.7861 127.7979 52.8577 39.9851 175.6847 149 V 3.6617 7.7253 121.5329 62.7838 32.5690 177.0176 150 S 4.2328 8.6809 121.7339 60.7137 63.8687 174.4895 151 T 3.9928 7.9679 118.4975 65.2244 68.3530 173.9454 152 R 3.8393 9.7308 124.6510 57.0373 28.1214 176.8524 153 G 3.9172 8.0301 102.3399 46.7884 0.0000 176.7492 154 R 3.9342 8.3024 120.7852 59.0354 30.0222 178.8234 155 G 3.8353 8.3091 105.7836 48.1310 0.0000 175.4059 156 I 3.5899 7.6789 121.8901 64.0139 37.1028 177.9866 157 E 3.9083 8.0740 118.9857 59.6205 29.3273 179.4767 158 A 3.9726 8.2290 120.7219 54.9174 18.3267 179.3306 159 L 3.8935 8.3860 119.2640 58.3479 42.1605 179.3908 160 K 4.0306 8.6681 118.6704 59.2707 31.7512 178.8621 161 L 3.9149 7.9963 119.5495 58.3542 42.3823 178.4640 162 A 4.1878 8.4309 120.8837 55.4012 18.3506 179.6478 163 I 3.7499 8.1363 118.2959 64.8071 37.0161 178.4862 164 D 4.6536 8.1511 118.3233 56.5853 40.6167 177.9950 165 R 4.5414 7.3845 116.1695 54.9903 30.6866 176.0868 166 Y 4.3725 7.2712 117.4157 57.2505 38.4906 175.0098 167 K 4.0640 8.1610 118.7151 55.3982 35.3013 174.9522 168 A 4.0838 8.3296 121.9239 52.2575 18.6156 177.4161 169 N 4.5805 8.5776 118.5488 53.2048 39.2882 175.0566 170 E 4.0514 8.8376 121.2526 56.7318 30.5018 177.5772 171 N 4.6963 8.4039 123.1359 52.7422 38.3164 175.3915 172 V 3.8662 7.2022 118.1054 61.0855 32.9634 176.0410 173 E 4.0847 8.5922 122.8578 56.2526 30.1360 174.4380 174 L 4.2577 8.1344 124.9736 55.0991 43.2848 176.7417 175 V 3.7073 7.8972 121.4105 62.6860 33.0293 175.6205 176 H 4.5469 8.1111 126.6430 54.6972 28.8449 173.5371 177 Y 4.3439 7.8556 122.6032 56.4975 39.1618 175.7820 178 A 4.0974 8.6567 125.5281 52.5428 19.4088 178.1726 179 Q 3.9931 9.1000 123.0853 59.3480 28.8829 177.9382 180 P 4.5661 0.0000 0.0000 64.9999 31.2560 178.7551 181 L 3.9200 7.8113 117.9255 57.7322 41.5340 179.1458 182 L 3.9254 7.9512 118.3974 57.9125 41.5535 179.1698 183 N 4.2822 8.5428 116.5041 56.4690 38.2552 177.0404 184 E 3.8977 8.4089 120.5104 59.2910 29.6859 178.7316 185 A 3.9471 8.2548 121.0238 55.0004 18.4731 179.2592 186 D 4.3183 8.2963 117.8910 57.5392 40.7058 179.2272 187 S 4.1065 7.7574 113.3108 61.5882 62.9347 176.1949 188 L 4.0521 8.0027 122.6627 57.2558 41.0743 179.4077 189 A 4.0420 7.8617 120.3288 54.7608 18.4532 179.2318 190 K 4.1995 7.8819 114.8309 57.7758 34.1930 177.8553 191 V 4.0637 6.9324 120.2652 60.4503 30.6239 171.8057 *193 P 4.1626 0.0000 0.0000 61.9124 32.5740 177.8264 194 S 4.3127 8.7253 117.9853 59.9804 62.5645 174.4295 195 D 4.4956 8.1174 118.5170 55.4645 39.2670 175.9850 196 I 4.4087 7.1228 121.2976 58.8236 38.9128 174.4110 197 P 4.3449 0.0000 0.0000 62.5035 33.0556 177.0619 198 L 3.9276 8.6437 122.6219 58.4981 41.8543 179.4817 199 K 3.9382 7.9930 118.7149 59.7841 32.2189 178.6995 200 Q 4.1344 8.0273 117.7651 58.7220 28.6622 178.5954 201 R 3.9677 8.4320 119.7083 59.2998 30.2042 179.0994 202 R 3.9064 8.2156 117.9596 59.0773 30.0957 178.8228 203 W 4.0760 8.2352 127.9242 60.5366 30.4811 177.8664 204 L 3.9388 8.4565 118.1519 57.8161 41.1499 179.4579 205 G 3.6739 8.0004 104.6106 47.6298 0.0000 175.1814 206 L 3.9379 7.5061 122.4749 57.6922 42.0089 179.8214 207 Q 3.8030 7.2498 116.0011 56.1978 28.2424 178.1897 *209 L 4.1868 7.9171 121.7553 54.5326 43.5558 177.6229 210 E 4.0744 7.4880 117.7023 56.2436 29.8098 176.7062 211 G 4.0937 8.2390 105.3011 45.4611 0.0000 173.2989 212 D 4.4304 7.9778 119.9289 54.2641 41.9330 176.5533 213 I 4.1756 8.5177 129.0458 64.6224 37.6200 178.4215 *214 Y 4.1400 8.0524 121.0103 62.3529 36.5247 180.5846 215 S 4.5562 8.1478 116.1031 61.7968 63.0245 176.6552 216 R 3.9558 7.9501 120.3518 59.5479 29.5654 178.7434 217 A 3.9504 7.6273 119.3052 55.0694 18.7319 178.6276 218 Y 4.2325 8.2639 114.2409 59.4106 38.2786 176.8091 219 A 4.5059 7.9368 121.6678 51.2468 20.2240 179.4783 220 G 3.8817 7.4764 106.9732 46.5925 0.0000 176.4009 221 E 4.0720 9.1902 124.9569 58.9050 29.1492 177.4239 222 A 3.9912 8.0467 121.2902 55.5343 18.0831 179.6512 223 S 4.1639 8.0305 110.8488 60.6836 63.3222 175.6297 224 Q 4.2161 7.9208 119.8071 57.8040 29.0559 176.5184 225 H 4.6257 8.2836 117.8727 56.3095 29.2687 176.8129 226 L 3.9237 7.7070 122.7499 58.2721 42.0970 178.2177 227 D 4.2755 8.1159 118.1242 57.2610 40.7863 178.5019 228 A 3.9331 7.9775 120.4247 55.0627 18.4153 179.1877 229 A 4.1578 8.1413 120.8480 54.8833 18.5134 179.9048 230 L 3.8898 8.6671 117.6425 57.8675 41.4448 179.6185 231 A 4.0100 8.2587 120.2495 54.9769 18.4567 179.4765 232 R 3.9562 8.0416 117.1772 59.6911 30.1757 178.6650 233 L 3.9958 8.0512 118.8781 57.9768 41.4242 179.5513 234 R 4.0218 7.6716 115.5896 58.2835 30.0374 178.2445 235 N 4.5331 7.8610 116.0487 55.3553 38.6807 175.5332 236 E 4.3201 7.9799 117.5240 56.8817 30.0463 176.4401 *238 D 4.6830 7.8785 118.4911 54.3211 42.9178 175.7987 239 D 4.7086 7.5019 118.3100 50.9621 43.1099 173.3869 240 P 4.1949 0.0000 0.0000 66.0238 31.2864 178.3743 241 A 4.0409 7.9404 120.0476 54.3904 18.2662 179.1779 242 L 4.0060 7.8763 118.6491 58.4850 42.3392 178.5066 243 H 4.0544 8.7549 116.6575 58.8653 28.5962 177.9010 244 I 3.9861 7.8789 120.9835 64.3216 37.0033 178.1900 245 A 4.1290 8.0521 121.6007 55.5462 18.1864 179.4408 246 D 4.4378 8.8686 117.5931 57.4584 40.7771 179.0154 247 A 3.9681 8.1639 121.3333 54.9901 18.4190 179.7974 248 R 3.8222 8.0186 116.5998 59.5653 30.1718 178.6510 249 Y 4.1301 8.1876 119.1264 60.7222 38.8652 177.4400 250 Q 3.6993 8.3374 120.7619 59.5066 29.1855 178.2406 251 C 3.9802 8.0955 119.3076 62.5621 31.4983 175.7108 252 I 3.6545 7.7271 120.9504 64.4167 36.7907 178.3742 253 A 3.8038 7.9945 121.7550 54.8876 17.9983 179.5718 254 A 3.8930 7.9799 119.4759 55.1841 18.4120 179.9042 255 I 3.7153 7.5347 117.8786 64.9200 37.2634 178.5851 256 C 4.2293 8.2916 117.5261 62.6556 27.6634 175.8589 257 D 4.3642 7.9375 120.1193 57.2708 40.4212 178.5600 258 V 3.7649 7.2580 116.5321 65.4974 31.8242 177.7651 259 V 3.8749 7.8801 118.0117 64.4817 31.3750 175.9687 260 S 5.0546 7.9293 116.4457 57.5851 63.1512 173.6558 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 K 8.27 4.34 0.00 1.88 1.79 0.00 1.77 0.00 0.00 1.91 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.50 7.81 3 K 8.58 4.90 0.00 1.66 1.57 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.29 1.11 7.81 4 L 8.77 4.95 0.00 1.39 1.37 0.64 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.77 5.04 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 1.21 0.00 0.00 6 I 8.92 4.91 1.90 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 1.01 0.57 0.96 0.00 0.00 7 G 8.82 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.06 5.20 0.00 1.93 1.60 1.13 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.74 4.89 1.89 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 1.15 1.24 0.99 0.00 0.00 10 G 8.16 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.75 5.08 0.00 2.69 2.40 0.00 0.00 7.37 8.03 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 12 P 0.00 4.32 0.00 2.15 2.11 0.00 2.27 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 13 N 8.58 4.25 0.00 2.90 2.94 0.00 0.00 6.69 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.65 4.60 0.00 4.08 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 15 G 8.33 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 16 K 7.98 3.96 0.00 1.82 1.80 0.00 1.86 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.56 7.81 17 T 7.84 3.95 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 1.24 0.00 0.00 18 T 7.94 3.88 4.43 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 1.22 0.00 0.00 19 L 8.05 4.21 0.00 1.77 1.85 0.85 0.56 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 20 F 8.23 4.01 0.00 3.34 3.32 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 21 N 8.51 4.33 0.00 2.81 2.87 0.00 0.00 7.11 7.27 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 22 Q 8.11 3.93 0.00 2.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 31 G 8.77 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 0.00 0.00 0.00 0.00 32 N 8.34 5.40 0.00 2.66 2.60 0.00 0.00 6.84 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.35 4.33 0.00 3.35 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 34 A 9.08 4.05 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 35 G 9.10 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 36 V 7.78 4.54 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 0.79 0.00 0.00 1.12 0.00 0.00 37 T 8.26 4.58 4.26 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 1.23 0.00 0.00 38 V 7.60 3.86 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 1.15 0.00 0.00 0.96 0.00 0.00 39 E 8.99 4.45 0.00 2.03 1.86 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 48 T 8.38 4.06 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 49 D 8.06 4.82 0.00 2.55 2.51 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 50 H 7.74 5.26 0.00 3.06 3.05 0.00 5.77 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 51 Q 9.14 4.70 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 52 V 8.51 4.54 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 0.46 0.00 0.00 0.55 0.00 0.00 53 T 8.48 4.82 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 54 L 8.89 5.07 0.00 1.91 1.63 1.17 0.80 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 55 V 8.77 4.52 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 0.44 0.00 0.00 1.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 *71 S 7.90 4.29 0.00 4.08 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 72 L 8.22 3.94 0.00 1.70 1.73 0.93 0.97 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 73 D 8.24 4.20 0.00 2.68 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 74 E 7.79 3.87 0.00 2.12 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 2.36 2.44 0.00 75 Q 7.94 4.07 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 76 I 7.65 3.33 1.51 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.43 -1.02 0.00 0.00 77 A 7.77 3.86 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 78 C 7.84 4.02 0.00 3.09 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 87 D 8.86 4.60 0.00 2.50 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 88 L 7.53 4.57 0.00 1.11 1.05 0.80 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.79 5.20 0.00 1.59 1.53 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.64 4.69 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.71 0.93 0.00 0.00 91 N 9.22 5.14 0.00 2.79 2.70 0.00 0.00 6.40 7.62 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 92 V 8.61 4.38 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 0.88 0.00 0.00 0.95 0.00 0.00 93 V 8.48 4.31 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 0.78 0.00 0.00 0.95 0.00 0.00 94 D 9.44 4.92 0.00 2.82 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 95 A 8.72 4.07 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.56 4.56 0.00 3.98 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 97 N 8.40 5.08 0.00 2.73 2.81 0.00 0.00 6.56 6.30 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 98 L 8.25 3.96 0.00 1.77 1.69 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.08 3.95 0.00 2.04 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 0.00 2.38 2.40 0.00 100 R 8.02 4.12 0.00 1.96 1.98 0.00 3.13 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.76 0.00 101 N 8.47 4.64 0.00 3.11 2.90 0.00 0.00 7.03 6.01 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 0.00 102 L 8.21 4.49 0.00 1.91 1.74 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.76 3.91 0.00 3.30 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 0.00 104 L 7.84 4.19 0.00 2.19 1.88 1.00 0.90 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 0.00 105 T 7.83 3.86 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 106 L 8.07 3.92 0.00 1.82 1.63 0.89 0.57 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 0.00 107 Q 7.59 4.02 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.52 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 108 L 7.54 3.75 0.00 1.77 1.65 0.90 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 0.00 109 L 8.00 3.99 0.00 1.78 1.69 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.24 4.04 0.00 2.14 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 2.49 2.56 0.00 111 L 7.68 3.85 0.00 1.45 1.39 0.19 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 112 G 7.43 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 0.00 113 I 7.08 3.97 1.78 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.44 0.85 0.00 0.00 114 P 0.00 4.51 0.00 2.26 2.25 0.00 3.54 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.20 0.00 115 C 9.03 5.25 0.00 3.10 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 0.00 116 I 8.43 4.62 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.55 0.93 0.00 0.00 117 V 8.58 4.43 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 0.93 0.00 0.00 0.94 0.00 0.00 118 A 9.02 4.97 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 0.00 119 L 8.85 4.51 0.00 1.78 1.63 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 120 N 9.37 4.85 0.00 2.78 2.72 0.00 0.00 6.76 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *122 L 8.37 4.31 0.00 1.74 1.74 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 123 D 7.92 3.98 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.67 3.74 1.88 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 1.58 0.35 0.92 0.00 0.00 125 A 8.13 4.17 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 0.00 126 E 8.92 3.92 0.00 1.91 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 2.26 2.26 0.00 127 K 7.74 4.24 0.00 2.01 1.92 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.61 7.81 128 Q 8.09 4.56 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.26 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 129 N 7.97 4.25 0.00 2.92 2.95 0.00 0.00 6.78 7.02 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 0.00 130 I 7.29 4.26 1.88 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 1.17 0.71 0.97 0.00 0.00 131 R 8.37 4.72 0.00 1.71 1.76 0.00 3.19 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.18 0.00 132 I 8.05 4.85 1.88 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 1.31 1.36 0.92 0.00 0.00 133 E 9.23 4.23 0.00 2.19 1.86 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 2.29 2.38 0.00 134 I 8.10 3.68 1.87 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 1.64 0.42 0.96 0.00 0.00 135 D 8.08 4.37 0.00 2.76 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.91 3.99 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 0.00 137 L 8.11 3.85 0.00 1.76 1.86 0.92 0.98 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 0.00 138 S 8.41 4.16 0.00 3.91 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 0.00 139 A 8.16 3.98 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 0.00 140 R 7.70 4.04 0.00 1.86 1.98 0.00 3.31 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 141 L 7.88 4.30 0.00 1.63 1.71 0.92 0.98 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 0.00 142 G 9.28 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 0.00 143 C 7.53 5.07 0.00 3.14 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 0.00 144 P 0.00 4.49 0.00 2.12 2.03 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 145 V 8.30 4.70 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 0.82 0.00 0.00 0.96 0.00 0.00 146 I 8.99 4.54 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.91 0.00 0.00 147 P 0.00 4.52 0.00 2.07 2.08 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 148 L 8.79 4.39 0.00 1.61 1.66 0.96 0.92 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 0.00 149 V 7.73 3.66 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 1.11 0.00 0.00 0.93 0.00 0.00 150 S 8.68 4.23 0.00 4.03 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 0.00 151 T 7.97 3.99 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 1.21 0.00 0.00 152 R 9.73 3.84 0.00 1.89 1.96 0.00 3.31 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 153 G 8.03 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 0.00 154 R 8.30 3.93 0.00 1.92 1.99 0.00 3.15 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 1.64 1.80 0.00 155 G 8.31 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 0.00 156 I 7.68 3.59 1.95 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 1.57 0.92 0.76 0.00 0.00 157 E 8.07 3.91 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 2.49 2.48 0.00 158 A 8.23 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.39 3.89 0.00 1.78 1.82 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 160 K 8.67 4.03 0.00 1.97 1.92 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.56 1.54 7.81 161 L 8.00 3.91 0.00 1.62 1.92 0.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 162 A 8.43 4.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 I 8.14 3.75 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.15 0.94 0.00 0.00 164 D 8.15 4.65 0.00 2.87 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 0.00 165 R 7.38 4.54 0.00 1.84 1.96 0.00 3.19 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 166 Y 7.27 4.37 0.00 3.11 3.20 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 0.00 167 K 8.16 4.06 0.00 1.73 1.66 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.40 7.81 168 A 8.33 4.08 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 0.00 169 N 8.58 4.58 0.00 2.72 2.93 0.00 0.00 7.02 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 0.00 170 E 8.84 4.05 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 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187 S 7.76 4.11 0.00 4.03 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 0.00 188 L 8.00 4.05 0.00 1.84 1.73 0.88 0.72 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 0.00 189 A 7.86 4.04 1.37 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 0.00 0.00 190 K 7.88 4.20 0.00 1.95 1.94 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.42 7.81 191 V 6.93 4.06 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 0.77 0.00 0.00 0.87 0.00 0.00 *193 P 0.00 4.16 0.00 2.34 2.06 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.10 0.00 194 S 8.73 4.31 0.00 3.83 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 0.00 195 D 8.12 4.50 0.00 2.83 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 0.00 196 I 7.12 4.41 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.65 0.93 0.00 0.00 197 P 0.00 4.34 0.00 2.14 1.97 0.00 3.60 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 198 L 8.64 3.93 0.00 1.75 1.69 0.93 0.67 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 0.00 199 K 7.99 3.94 0.00 1.87 1.78 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.56 7.81 200 Q 8.03 4.13 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 201 R 8.43 3.97 0.00 2.01 2.00 0.00 3.37 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 202 R 8.22 3.91 0.00 2.08 2.01 0.00 3.16 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 203 W 8.24 4.08 0.00 3.39 3.38 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 0.00 0.00 0.00 0.00 204 L 8.46 3.94 0.00 1.85 1.76 1.01 1.04 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 0.00 205 G 8.00 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 0.00 206 L 7.51 3.94 0.00 1.73 1.31 0.50 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 207 Q 7.25 3.80 0.00 1.83 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.15 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 *209 L 7.92 4.19 0.00 1.70 1.70 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 210 E 7.49 4.07 0.00 1.93 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 2.29 2.39 0.00 211 G 8.24 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 0.00 212 D 7.98 4.43 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 I 8.52 4.18 1.88 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 1.50 1.28 0.91 0.00 0.00 *214 Y 8.05 4.14 0.00 2.31 2.32 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 0.00 215 S 8.15 4.56 0.00 3.85 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 0.00 216 R 7.95 3.96 0.00 2.03 2.01 0.00 3.27 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 217 A 7.63 3.95 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 0.00 218 Y 8.26 4.23 0.00 3.17 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 0.00 219 A 7.94 4.51 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 G 7.48 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 0.00 0.00 0.00 221 E 9.19 4.07 0.00 2.26 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 2.42 2.39 0.00 222 A 8.05 3.99 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 0.00 223 S 8.03 4.16 0.00 4.04 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 0.00 224 Q 7.92 4.22 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.32 0.00 225 H 8.28 4.63 0.00 3.27 3.37 0.00 5.62 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 0.00 226 L 7.71 3.92 0.00 1.75 1.80 0.89 1.25 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 0.00 227 D 8.12 4.28 0.00 2.79 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 A 7.98 3.93 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 0.00 229 A 8.14 4.16 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 L 8.67 3.89 0.00 1.85 1.71 0.90 1.14 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 0.00 231 A 8.26 4.01 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 0.00 232 R 8.04 3.96 0.00 2.12 2.05 0.00 3.26 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 233 L 8.05 4.00 0.00 1.87 1.69 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 234 R 7.67 4.02 0.00 1.77 1.98 0.00 3.15 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 235 N 7.86 4.53 0.00 2.88 2.87 0.00 0.00 6.92 9.01 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 0.00 236 E 7.98 4.32 0.00 1.97 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 2.45 2.40 0.00 *238 D 7.88 4.68 0.00 2.71 2.79 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 0.00 239 D 7.50 4.71 0.00 2.77 2.59 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 0.00 240 P 0.00 4.19 0.00 2.23 2.29 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 241 A 7.94 4.04 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 0.00 242 L 7.88 4.01 0.00 1.72 1.81 0.95 1.08 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 0.00 243 H 8.75 4.05 0.00 3.51 3.44 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 I 7.88 3.99 2.11 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.98 1.04 0.00 0.00 245 A 8.05 4.13 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 0.00 246 D 8.87 4.44 0.00 2.83 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 0.00 247 A 8.16 3.97 1.24 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 0.00 248 R 8.02 3.82 0.00 2.28 2.15 0.00 3.35 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.99 0.00 249 Y 8.19 4.13 0.00 3.17 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 0.00 250 Q 8.34 3.70 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 251 C 8.10 3.98 0.00 2.92 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 0.00 0.00 0.00 0.00 252 I 7.73 3.65 1.87 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 1.69 0.83 0.95 0.00 0.00 253 A 7.99 3.80 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 A 7.98 3.89 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 0.00 255 I 7.53 3.72 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.68 0.90 0.00 0.00 256 C 8.29 4.23 0.00 2.93 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 0.00 257 D 7.94 4.36 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 V 7.26 3.76 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 0.78 0.00 0.00 0.95 0.00 0.00 259 V 7.88 3.87 2.26 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 1.00 0.00 0.00 0.95 0.00 0.00 260 S 7.93 5.05 0.00 4.03 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 * Residues marked with a * may have inaccurate shift predictions.