NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.4777 8.1633 118.3310 55.3065 34.6195 173.4291 4 L 4.9641 8.5424 117.3263 52.2374 44.7723 170.4070 5 V 4.4848 9.8069 125.6061 61.1734 34.5641 174.3724 6 E 5.1626 8.7569 127.7108 56.3887 31.6687 175.3488 7 S 4.7490 9.3866 115.5008 58.3526 66.4073 175.8905 8 G 3.8936 9.4920 108.3368 44.7526 0.0000 174.2744 9 G 3.8053 7.4296 106.6822 47.1181 0.0000 173.1402 10 G 3.9957 7.8317 107.6245 45.9690 0.0000 171.1883 11 L 5.2015 8.5510 122.0641 53.5913 43.2240 176.1497 12 V 4.5957 8.6778 119.7212 59.2974 35.3308 175.6152 13 K 4.8577 8.4169 122.4939 54.6387 33.6345 174.8847 14 P 4.4237 0.0000 0.0000 64.6286 31.6131 177.0380 15 G 3.9372 9.3384 112.2933 44.9915 0.0000 173.7131 16 G 4.1295 7.9973 107.3788 45.5492 0.0000 172.6139 17 S 5.2059 8.3237 112.6828 56.5816 66.2741 173.2146 18 L 4.6802 8.4913 122.2375 53.2493 46.0896 174.7746 19 K 4.7587 8.3731 124.4394 54.6681 34.2712 175.2799 20 L 4.6469 8.2670 127.8542 53.6555 43.9608 175.7063 21 S 5.3055 9.1514 115.3130 57.0119 66.8786 172.4353 22 C 5.2889 9.0407 123.7683 55.1472 41.6316 172.4639 23 A 4.6303 9.5803 130.4214 51.1899 19.5060 175.7423 24 A 5.2749 7.7243 124.2098 50.3230 21.5864 175.6030 25 S 4.1362 8.7805 114.0430 57.8993 66.2232 174.8223 26 G 3.9580 9.5077 109.1162 44.5991 0.0000 172.6893 27 F 4.4886 6.7724 112.5335 56.4520 39.2166 174.0439 28 T 4.1659 8.1669 117.7906 62.7290 67.2024 175.2693 29 F 4.2195 8.5760 129.8367 61.1267 39.4978 176.8787 30 S 4.1450 8.2154 113.5575 60.2669 63.0658 174.3716 31 S 4.7809 7.6134 115.3283 57.9265 63.3348 173.3757 32 Y 4.8423 7.6121 116.5176 57.3645 41.9649 175.0788 33 A 4.4743 8.7361 124.8071 52.1026 20.3709 176.1533 34 M 5.3027 8.9942 119.3728 53.7988 36.3959 174.9025 35 S 5.1953 8.9288 115.8927 56.8408 68.3821 172.8581 36 W 5.1785 9.3165 121.2913 55.0362 32.0405 175.1070 37 V 5.0319 9.1708 124.2003 61.0092 34.6660 174.3056 38 R 4.9656 8.9016 122.3342 54.3287 33.0831 174.5224 39 Q 5.1048 8.9678 122.5706 54.3007 31.0840 175.2256 40 T 4.2755 8.7479 117.6589 61.0469 69.2537 173.7502 41 P 4.0638 0.0000 0.0000 64.9755 31.4048 177.1469 42 E 4.2360 8.0860 116.1222 56.3218 29.7149 176.9658 43 R 4.0517 8.7657 117.9876 56.6916 28.1845 175.7827 44 R 4.4752 7.8914 117.9461 55.3675 31.6821 175.4848 45 L 4.9909 8.5179 123.7029 53.9422 43.2051 176.0149 46 E 4.7245 9.2622 123.0085 53.9999 33.2370 175.0374 47 W 4.6166 9.2334 135.0000 58.0347 30.9927 175.6057 48 V 4.0722 8.0405 123.1819 61.6041 33.0064 175.0455 49 A 3.9622 6.2663 121.1221 52.2694 22.1801 175.2526 50 T 5.0191 7.1530 114.9042 62.0667 73.5473 172.8684 51 I 4.8463 8.9502 125.7367 59.5385 41.2489 174.9165 52 T 4.7234 9.0540 125.6552 62.9442 69.9370 175.9839 53 T 3.6446 8.6915 120.0373 67.1039 68.5312 176.4438 *55 R 4.5606 7.3125 115.8451 55.6468 31.6105 176.2049 56 G 4.0353 8.2772 106.8886 44.8501 0.0000 173.6212 57 Y 4.5246 7.8706 121.1189 58.1631 40.1436 174.6818 58 T 5.0087 7.3006 120.2881 61.8282 72.8162 173.1617 59 F 5.0282 7.8671 118.3758 56.0411 41.6470 172.6818 60 Y 4.8656 8.7166 117.4808 55.8591 42.5554 172.6372 61 P 4.9578 0.0000 0.0000 61.6555 33.4176 176.4674 62 D 4.3892 8.9992 120.1567 57.8271 40.7251 179.5246 63 S 4.1359 8.0952 111.1397 60.3057 63.0126 174.7658 64 V 3.6446 7.4331 118.8772 61.9305 32.9364 175.3915 65 K 3.7108 7.3289 118.9667 58.2585 32.2015 177.2175 66 G 3.9108 8.6391 109.9075 45.8695 0.0000 174.0190 67 R 4.5911 7.7750 117.0961 55.8746 33.6945 175.2890 68 F 5.5238 8.0140 115.3550 55.9507 42.2694 175.5647 69 T 4.7069 8.7380 118.0466 62.1095 72.1837 173.2459 70 V 4.7218 9.0424 127.6643 62.3223 32.7936 175.2172 71 S 4.9740 8.7583 120.3998 57.1628 66.8205 172.9023 72 R 5.1599 8.5721 116.5866 54.7640 32.4348 174.6484 73 D 4.8871 9.9861 123.5863 52.2569 41.1342 176.0415 74 N 4.6869 8.9001 122.8249 55.7183 38.8567 177.1205 75 A 4.0592 7.8847 120.6289 55.4095 18.7053 178.1825 76 R 4.1589 9.4807 112.9512 55.6635 30.5106 176.6863 77 N 3.9090 7.6172 114.8983 54.9938 36.5942 173.6536 78 T 4.7299 8.0442 113.1456 61.4822 73.1624 174.1081 79 L 5.5817 8.5066 125.7708 53.5952 44.8114 175.1158 80 N 5.7782 9.8750 122.9397 51.6023 43.0379 173.6667 81 L 4.4560 8.3642 121.6202 53.6886 44.7227 174.3519 82 Q 4.2863 8.8564 129.3545 55.5161 30.4177 174.1977 83 M 4.5706 8.7404 126.5552 53.5061 34.7041 175.2022 84 S 4.8196 8.7660 118.4220 56.5375 67.3809 173.5822 85 S 3.7002 8.6533 114.3912 59.3830 60.4720 173.2293 86 L 4.4376 7.8348 118.9163 55.2020 42.5066 177.2907 87 R 4.9820 9.5052 120.0534 53.9510 34.1023 176.7556 88 S 4.3796 9.1522 114.6865 60.9293 62.6971 176.1095 89 E 4.2933 8.1079 115.2759 57.2556 29.4134 177.1667 90 D 4.6313 8.6888 120.9366 57.0029 41.2972 177.0928 91 T 4.2664 7.6350 109.1231 62.5562 69.1573 173.5946 92 A 4.3040 8.4170 125.5169 51.8179 23.9351 174.5123 93 M 4.5277 8.0982 119.4254 54.9876 33.2407 175.0194 94 F 5.1037 9.4835 126.8049 56.9640 40.6589 174.8167 95 Y 5.5626 9.8042 121.8294 56.3907 41.5473 172.2841 96 C 4.8308 8.8450 116.1170 53.8649 45.1482 172.5759 97 T 5.5400 8.5075 110.0924 59.2600 72.4834 172.1215 98 R 4.6656 8.1517 121.7476 54.6348 32.8579 174.9035 99 E 4.5080 8.9448 126.5319 55.5052 28.2264 176.9646 100 G 4.3664 8.6092 112.6717 48.1436 0.0000 172.5401 101 L 4.2012 7.9820 124.9137 54.0105 39.2051 177.6899 102 L 3.3754 7.2117 118.4469 56.9529 42.7125 178.6151 103 L 4.5079 7.0742 120.4806 53.4060 42.1148 178.0086 104 D 4.0030 8.3439 116.0814 54.5470 42.9396 174.2706 105 Y 2.7700 8.4174 124.0111 57.8177 39.5375 171.6340 106 F 4.2786 6.9088 122.7837 57.3531 39.7606 175.5082 107 T 4.3066 8.6240 120.7682 63.4844 72.9304 172.0437 108 M 4.2703 8.6891 127.2247 56.4793 32.4770 174.1987 109 D 4.1023 10.2728 127.0048 55.4256 41.3570 175.9284 110 Y 5.0926 8.6508 112.4172 56.3850 41.6823 175.3272 111 W 5.2622 9.0111 120.1655 55.1937 33.0616 176.3060 112 G 4.5128 8.7625 110.2765 43.8553 0.0000 173.4707 113 Q 4.1466 8.8432 116.1871 56.9896 29.2099 176.9898 114 G 3.5510 8.8609 104.2868 45.7129 0.0000 172.4794 115 T 4.6021 8.5147 114.9285 59.9448 70.8924 172.5743 116 S 4.8372 8.6155 123.1486 57.7172 64.3046 172.8458 117 V 4.7300 8.6766 119.5693 59.8525 35.1673 174.5783 118 T 4.8450 8.8624 121.5320 61.7024 71.3898 173.1806 119 V 5.1410 8.3313 126.1785 61.2570 32.8840 174.0141 120 S 4.6612 8.2914 121.0945 57.6797 65.6149 175.1857 121 S 4.1811 8.7569 119.0552 59.9849 63.3268 174.1418 *127 A 4.0844 7.5484 121.4435 51.7014 19.2472 175.5690 128 K 4.5342 7.9788 120.8715 54.7297 33.8688 176.2158 129 T 4.4869 8.5684 119.7914 62.8250 68.1307 173.2811 130 T 4.8079 9.4829 125.3671 61.0400 71.8188 172.0544 131 P 4.8949 0.0000 0.0000 62.0281 32.2419 174.3405 132 P 4.9332 0.0000 0.0000 62.4038 33.3523 174.9637 133 S 4.5760 8.7381 116.3781 56.6067 65.5557 173.5026 134 V 4.3387 8.0914 124.5358 61.5482 32.6015 174.0715 135 Y 5.1043 8.4706 126.6953 55.8307 40.3103 173.6986 136 P 4.7281 0.0000 0.0000 62.5521 32.7394 176.3992 137 L 4.7679 9.6066 124.5182 52.7519 42.7503 174.8174 138 A 4.9535 8.3287 124.3003 50.6923 21.8093 173.2540 139 P 3.9087 0.0000 0.0000 64.7306 29.8864 178.0273 *148 M 4.4987 9.0652 114.4092 54.8448 33.6900 176.0566 149 V 4.3748 8.4791 123.7503 60.4057 34.5320 175.2933 150 T 4.9226 8.3327 118.3658 62.1021 70.8442 173.4189 151 L 4.8091 8.6414 127.1051 53.5340 44.4094 176.0511 152 G 4.7909 9.4554 107.7643 45.1529 0.0000 170.4677 153 C 5.5438 9.6990 119.6852 54.5219 46.4228 172.4944 154 L 4.7790 9.4481 128.6675 53.4850 43.7857 175.5175 155 V 4.4285 8.9790 129.1197 61.8057 32.2131 174.5179 156 K 4.8294 8.7983 129.8638 54.6138 35.7296 175.7188 157 G 4.0990 8.2317 111.7032 47.1096 0.0000 172.8371 158 Y 5.1654 7.1567 115.8981 55.2705 41.7307 174.4958 159 F 4.9178 9.1136 120.1350 57.1374 43.3154 171.7452 160 P 3.5203 0.0000 0.0000 61.9338 33.8423 174.8476 161 E 4.2928 8.2306 119.0161 55.1909 30.8983 173.3648 162 P 4.7956 0.0000 0.0000 61.2235 33.8218 174.4782 163 V 4.6445 7.7645 116.3852 60.4350 34.2139 174.5934 164 T 4.6350 8.7916 113.9208 60.0507 71.5919 173.4273 165 V 4.8821 8.1575 122.6499 61.4934 34.3353 174.4244 166 T 4.8448 8.9544 117.2653 59.7309 72.9619 172.4660 167 W 4.8520 8.6240 121.4317 55.3861 32.2660 175.7798 168 N 4.2234 9.8374 122.5297 55.3558 36.0997 174.7631 169 S 3.7840 9.6944 106.1621 59.6111 61.5368 174.3935 170 G 4.0947 8.7648 110.1976 45.4874 0.0000 175.7518 171 S 4.2497 8.0690 115.9984 61.5274 62.9905 175.1668 172 L 4.4669 7.8001 118.7117 54.2510 42.4359 176.0308 173 S 4.5441 8.5593 116.8978 59.9749 67.1714 175.1508 174 S 4.1047 8.0576 113.4362 59.2983 63.3858 173.7616 175 G 3.7760 8.5461 110.0397 46.8611 0.0000 172.5876 176 V 4.5642 7.6031 118.1332 61.0993 33.9556 175.0684 177 H 4.6491 9.2787 124.6107 54.2273 30.7971 170.9692 178 T 4.7803 8.0746 118.5445 62.3557 69.3469 174.5461 179 F 4.6685 9.0127 125.8115 55.8114 40.5850 174.1243 180 P 4.5621 0.0000 0.0000 62.3923 31.6421 176.5210 181 A 4.5932 8.8675 125.8114 52.3949 19.4542 176.5547 182 V 4.5705 8.6604 118.6713 60.9629 35.2538 174.0193 183 L 4.6878 8.4557 126.9982 53.5088 43.0571 175.3777 184 Q 4.4426 8.2534 125.7545 56.8833 31.1044 175.7528 185 S 4.5523 7.6595 109.1311 58.8196 65.5867 173.4754 186 D 4.6645 8.4776 120.3085 54.0206 43.0270 175.1948 187 L 5.0239 7.3509 117.7914 53.3686 46.2502 175.5534 188 Y 4.9796 9.0904 120.5192 56.6859 40.9221 175.0961 189 T 5.1822 8.0646 116.5724 62.8033 72.9158 173.0083 190 L 5.4208 9.7210 127.1826 53.9647 44.4869 175.5088 191 S 5.4097 8.7581 113.4247 57.0008 67.1116 172.4322 192 S 5.5271 9.1880 114.4983 57.1082 66.0783 172.8202 193 S 5.5673 9.3323 120.4394 56.6414 66.6768 173.0823 194 V 4.6523 8.7647 119.6611 60.2090 34.7954 174.1946 195 T 5.0202 8.2190 118.6390 62.0462 71.3517 173.7541 196 V 4.5505 8.6166 117.8346 58.6135 36.8978 173.1727 197 P 4.4924 0.0000 0.0000 62.9752 31.4117 177.7956 198 S 4.1080 8.9803 119.2819 61.9650 62.8460 176.2925 199 S 4.3340 7.8817 111.1925 58.9778 63.3500 174.8869 200 S 4.2434 9.7471 117.4860 60.3902 62.4479 173.6730 201 R 4.8670 7.2449 118.0730 53.6110 32.6967 173.0492 202 P 4.5119 0.0000 0.0000 63.3680 30.9046 177.4080 203 S 3.8911 7.4960 113.3952 62.1342 63.2091 174.5055 204 E 4.5384 9.7501 121.3289 55.2142 31.1085 176.2711 205 T 4.2332 8.1375 110.8893 61.1509 70.1140 174.6259 206 V 4.6011 8.3056 123.3637 61.7443 34.4777 173.7591 207 T 5.3146 9.4029 125.6340 61.7500 71.6482 170.9547 208 C 4.2456 8.7516 121.6854 54.0429 42.1679 172.2245 209 N 5.4204 9.0429 120.9397 51.3715 40.7353 173.8319 210 V 4.8533 8.4858 123.7039 59.6311 34.4219 174.4874 211 A 5.0246 8.9992 125.6338 50.5001 22.0646 174.6104 212 H 4.6503 8.9888 122.7396 52.9708 30.2185 171.9447 213 P 4.0583 0.0000 0.0000 65.2446 31.6978 178.1422 214 A 3.8259 7.8910 118.9394 55.4717 18.0003 178.4042 215 S 4.4149 7.6745 106.2222 57.6553 63.9211 174.3383 216 S 3.6551 8.0725 116.3273 60.2048 60.3255 172.1545 217 T 4.6725 8.1332 115.7126 61.6654 72.9078 174.7156 218 K 4.9113 8.7593 125.2898 54.5044 34.9821 175.7154 219 V 4.3922 8.5945 124.2779 61.1629 34.6699 173.6964 220 D 5.3664 8.7575 126.9455 52.5264 43.6300 176.0083 221 K 4.4850 8.6123 120.9581 54.4999 35.8725 175.3980 222 K 4.9432 8.6672 127.0889 55.4344 33.1545 175.9200 223 I 4.4094 8.7694 129.1840 60.4162 37.9041 175.7730 224 V 4.5503 8.2885 119.3917 58.6061 35.0956 173.9603 225 P 4.4491 0.0000 0.0000 63.0149 31.2262 176.6785 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 3 M 8.16 4.48 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 4 L 8.54 4.96 0.00 1.73 1.59 1.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 5 V 9.81 4.48 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 6 E 8.76 5.16 0.00 2.09 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 2.52 2.36 0.00 7 S 9.39 4.75 0.00 3.81 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 8 G 9.49 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 9 G 7.43 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 0.00 0.00 0.00 10 G 7.83 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 0.00 0.00 0.00 11 L 8.55 5.20 0.00 1.61 1.59 1.11 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.68 4.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.95 0.00 0.00 13 K 8.42 4.86 0.00 1.72 1.73 0.00 1.97 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.32 7.81 14 P 0.00 4.42 0.00 2.05 2.03 0.00 3.67 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 2.05 2.13 0.00 15 G 9.34 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.00 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 17 S 8.32 5.21 0.00 3.90 3.72 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 18 L 8.49 4.68 0.00 1.56 1.17 0.81 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.37 4.76 0.00 1.62 1.54 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.70 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 1.30 7.81 20 L 8.27 4.65 0.00 0.81 1.11 0.56 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.15 5.31 0.00 3.84 3.68 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 22 C 9.04 5.29 0.00 2.86 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 23 A 9.58 4.63 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.72 5.27 0.91 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 25 S 8.78 4.14 0.00 3.77 3.68 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 26 G 9.51 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 27 F 6.77 4.49 0.00 3.13 2.92 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 28 T 8.17 4.17 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 29 F 8.58 4.22 0.00 2.50 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 30 S 8.22 4.14 0.00 4.18 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 31 S 7.61 4.78 0.00 3.83 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.61 4.84 0.00 2.86 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 33 A 8.74 4.47 1.38 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 2.10 2.17 0.00 42 E 8.09 4.24 0.00 1.97 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 2.32 2.42 0.00 43 R 8.77 4.05 0.00 1.95 2.11 0.00 3.33 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 44 R 7.89 4.48 0.00 1.82 1.88 0.00 3.14 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 45 L 8.52 4.99 0.00 1.63 1.80 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.26 4.72 0.00 1.87 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 47 W 9.23 4.62 0.00 3.27 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 48 V 8.04 4.07 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 1.13 0.00 0.00 0.99 0.00 0.00 49 A 6.27 3.96 1.27 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 0.00 0.00 0.00 50 T 7.15 5.02 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 1.16 0.00 0.00 51 I 8.95 4.85 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.87 1.02 0.00 0.00 52 T 9.05 4.72 4.71 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 1.41 0.00 0.00 53 T 8.69 3.64 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 1.20 0.00 0.00 *55 R 7.31 4.56 0.00 1.88 2.06 0.00 3.23 0.00 0.00 2.25 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 56 G 8.28 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.87 4.52 0.00 3.15 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 58 T 7.30 5.01 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 1.13 0.00 0.00 59 F 7.87 5.03 0.00 3.26 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 60 Y 8.72 4.87 0.00 2.62 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 61 P 0.00 4.96 0.00 2.28 2.44 0.00 3.40 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 62 D 9.00 4.39 0.00 2.74 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 63 S 8.10 4.14 0.00 3.90 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 64 V 7.43 3.64 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.08 0.00 0.00 65 K 7.33 3.71 0.00 1.73 1.65 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.51 7.81 66 G 8.64 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 67 R 7.77 4.59 0.00 1.70 2.18 0.00 3.01 0.00 0.00 3.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 68 F 8.01 5.52 0.00 2.49 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 69 T 8.74 4.71 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 1.28 0.00 0.00 70 V 9.04 4.72 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 1.00 0.00 0.00 0.99 0.00 0.00 71 S 8.76 4.97 0.00 3.90 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.57 5.16 0.00 1.96 2.00 0.00 2.96 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 73 D 9.99 4.89 0.00 2.63 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 74 N 8.90 4.69 0.00 2.90 2.96 0.00 0.00 6.90 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 75 A 7.88 4.06 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 76 R 9.48 4.16 0.00 1.73 1.91 0.00 3.31 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 77 N 7.62 3.91 0.00 2.69 2.43 0.00 0.00 6.77 6.72 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 78 T 8.04 4.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 79 L 8.51 5.58 0.00 2.04 1.61 0.58 1.05 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 80 N 9.88 5.78 0.00 2.66 2.68 0.00 0.00 6.00 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 81 L 8.36 4.46 0.00 0.27 0.21 0.67 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.86 4.29 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 83 M 8.74 4.57 0.00 1.20 1.48 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.81 0.00 84 S 8.77 4.82 0.00 3.77 3.69 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 85 S 8.65 3.70 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 86 L 7.83 4.44 0.00 1.81 1.62 0.82 0.65 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 87 R 9.51 4.98 0.00 1.81 1.94 0.00 3.15 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 88 S 9.15 4.38 0.00 4.05 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 89 E 8.11 4.29 0.00 2.13 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 0.00 2.31 2.29 0.00 90 D 8.69 4.63 0.00 3.01 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 91 T 7.63 4.27 4.45 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 1.35 0.00 0.00 92 A 8.42 4.30 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 93 M 8.10 4.53 0.00 2.28 1.98 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.33 0.00 94 F 9.48 5.10 0.00 3.10 3.29 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 95 Y 9.80 5.56 0.00 3.14 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 96 C 8.84 4.83 0.00 2.23 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 97 T 8.51 5.54 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 0.07 0.00 0.00 98 R 8.15 4.67 0.00 1.70 1.62 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 99 E 8.94 4.51 0.00 2.06 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 2.57 2.73 0.00 100 G 8.61 4.37 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 0.00 101 L 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 8.65 5.09 0.00 2.85 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 9.01 5.26 0.00 3.00 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 0.00 112 G 8.76 4.51 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 0.00 113 Q 8.84 4.15 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 114 G 8.86 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.51 4.60 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 1.39 0.00 0.00 116 S 8.62 4.84 0.00 3.91 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 0.00 117 V 8.68 4.73 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 0.64 0.00 0.00 1.03 0.00 0.00 118 T 8.86 4.84 4.18 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 1.31 0.00 0.00 119 V 8.33 5.14 2.21 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 0.93 0.00 0.00 1.02 0.00 0.00 120 S 8.29 4.66 0.00 4.11 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 0.00 121 S 8.76 4.18 0.00 3.91 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *127 A 7.55 4.08 0.58 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 0.00 0.00 128 K 7.98 4.53 0.00 1.70 1.72 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.37 7.81 129 T 8.57 4.49 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 1.29 0.00 0.00 130 T 9.48 4.81 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 131 P 0.00 4.89 0.00 1.96 2.01 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 132 P 0.00 4.93 0.00 1.96 1.93 0.00 3.69 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.73 0.00 133 S 8.74 4.58 0.00 3.40 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.09 4.34 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 0.69 0.00 0.00 0.78 0.00 0.00 135 Y 8.47 5.10 0.00 2.98 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 0.00 136 P 0.00 4.73 0.00 2.01 2.06 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 137 L 9.61 4.77 0.00 1.80 1.67 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 138 A 8.33 4.95 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 0.00 139 P 0.00 3.91 0.00 2.20 1.87 0.00 3.82 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 1.99 1.99 0.00 *148 M 9.07 4.50 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 149 V 8.48 4.37 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 0.71 0.00 0.00 0.92 0.00 0.00 150 T 8.33 4.92 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 1.26 0.00 0.00 151 L 8.64 4.81 0.00 1.34 1.61 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 152 G 9.46 4.79 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 0.00 153 C 9.70 5.54 0.00 2.96 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 0.00 154 L 9.45 4.78 0.00 1.86 1.72 1.14 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 155 V 8.98 4.43 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 156 K 8.80 4.83 0.00 1.92 1.60 0.00 2.03 0.00 0.00 1.94 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.43 7.81 157 G 8.23 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 0.00 158 Y 7.16 5.17 0.00 3.05 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 0.00 159 F 9.11 4.92 0.00 3.33 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 0.00 160 P 0.00 3.52 0.00 1.57 0.86 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 161 E 8.23 4.29 0.00 1.62 1.67 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 1.47 1.47 0.00 162 P 0.00 4.80 0.00 2.08 1.99 0.00 3.63 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.86 0.00 163 V 7.76 4.64 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 0.51 0.00 0.00 0.61 0.00 0.00 164 T 8.79 4.63 4.18 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 1.16 0.00 0.00 165 V 8.16 4.88 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 0.62 0.00 0.00 0.84 0.00 0.00 166 T 8.95 4.84 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 1.18 0.00 0.00 167 W 8.62 4.85 0.00 3.27 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 N 9.84 4.22 0.00 3.01 2.89 0.00 0.00 6.74 7.40 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 0.00 169 S 9.69 3.78 0.00 4.01 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 0.00 170 G 8.76 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 0.00 171 S 8.07 4.25 0.00 3.91 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 0.00 172 L 7.80 4.47 0.00 1.91 1.58 1.05 0.72 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 0.00 173 S 8.56 4.54 0.00 3.78 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 0.00 174 S 8.06 4.10 0.00 3.93 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 0.00 175 G 8.55 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 0.00 176 V 7.60 4.56 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 0.00 177 H 9.28 4.65 0.00 2.94 2.41 0.00 5.66 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 T 8.07 4.78 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 1.27 0.00 0.00 179 F 9.01 4.67 0.00 3.01 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 0.00 180 P 0.00 4.56 0.00 2.04 2.07 0.00 3.90 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 181 A 8.87 4.59 1.46 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 0.00 182 V 8.66 4.57 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 0.95 0.00 0.00 0.99 0.00 0.00 183 L 8.46 4.69 0.00 1.40 1.40 -0.11 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 184 Q 8.25 4.44 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.58 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 185 S 7.66 4.55 0.00 3.73 3.48 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 0.00 186 D 8.48 4.66 0.00 2.34 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 0.00 0.00 0.00 187 L 7.35 5.02 0.00 1.44 1.41 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 188 Y 9.09 4.98 0.00 1.43 2.40 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 0.00 189 T 8.06 5.18 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 1.32 0.00 0.00 190 L 9.72 5.42 0.00 1.98 1.94 1.01 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 191 S 8.76 5.41 0.00 4.00 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 0.00 192 S 9.19 5.53 0.00 4.07 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 0.00 193 S 9.33 5.57 0.00 4.05 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 V 8.76 4.65 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 -0.50 0.00 0.00 0.44 0.00 0.00 195 T 8.22 5.02 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 196 V 8.62 4.55 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 0.63 0.00 0.00 0.87 0.00 0.00 197 P 0.00 4.49 0.00 2.16 1.97 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 198 S 8.98 4.11 0.00 3.87 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 0.00 199 S 7.88 4.33 0.00 3.97 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 0.00 200 S 9.75 4.24 0.00 3.86 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 0.00 201 R 7.24 4.87 0.00 1.58 1.73 0.00 3.35 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 202 P 0.00 4.51 0.00 2.23 2.15 0.00 3.86 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 1.99 0.00 203 S 7.50 3.89 0.00 4.03 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 0.00 204 E 9.75 4.54 0.00 2.05 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 2.39 2.38 0.00 205 T 8.14 4.23 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 0.00 206 V 8.31 4.60 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 1.21 0.00 0.00 0.95 0.00 0.00 207 T 9.40 5.31 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 1.18 0.00 0.00 208 C 8.75 4.25 0.00 2.02 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 0.00 209 N 9.04 5.42 0.00 2.55 2.81 0.00 0.00 6.27 8.34 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 0.00 210 V 8.49 4.85 1.89 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 0.67 0.00 0.00 0.73 0.00 0.00 211 A 9.00 5.02 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 H 8.99 4.65 0.00 3.02 3.08 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.06 0.00 2.10 2.04 0.00 3.71 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 2.04 2.04 0.00 214 A 7.89 3.83 1.12 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 0.00 0.00 215 S 7.67 4.41 0.00 4.05 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 0.00 216 S 8.07 3.66 0.00 3.94 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 0.00 217 T 8.13 4.67 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 1.18 0.00 0.00 218 K 8.76 4.91 0.00 1.55 1.64 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.34 7.81 219 V 8.59 4.39 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 0.90 0.00 0.00 0.87 0.00 0.00 220 D 8.76 5.37 0.00 2.54 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.61 4.49 0.00 1.55 1.67 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.57 7.81 222 K 8.67 4.94 0.00 1.79 1.73 0.00 1.61 0.00 0.00 2.38 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.35 7.81 223 I 8.77 4.41 2.02 0.00 0.00 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 1.82 1.32 1.01 0.00 0.00 224 V 8.29 4.55 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 0.78 0.00 0.00 0.96 0.00 0.00 225 P 0.00 4.45 0.00 2.05 1.97 0.00 3.73 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 2.04 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.