NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2138 7.8827 121.4424 61.1988 38.6464 173.7576 17 V 4.3080 8.7435 126.1777 61.8212 32.6331 174.5333 18 G 4.1319 8.5245 114.2282 46.6590 0.0000 173.4448 19 G 4.2536 7.7362 109.8787 44.4463 0.0000 172.5715 20 Y 4.9578 7.9227 117.7943 55.2855 41.9092 175.0108 21 T 4.2258 8.5651 116.9449 64.1666 68.8492 176.0085 22 C 4.1822 8.6083 125.5494 58.9844 35.1951 175.6603 23 G 3.9789 7.8877 102.3019 44.9270 0.0000 172.6931 24 A 4.2754 8.4623 124.9204 53.7029 18.5608 176.9697 25 N 4.2504 8.8787 119.3761 54.5605 36.1626 175.2984 26 T 4.2008 7.6512 106.8506 62.6669 69.8858 175.1001 27 V 4.0647 7.0091 121.8419 60.4468 31.3111 173.6749 28 P 4.4929 0.0000 0.0000 64.2028 32.1593 178.2963 29 Y 5.1818 6.8632 116.1625 57.2931 38.8152 174.7030 30 Q 4.5223 7.4404 123.5611 56.3331 29.4841 175.6332 31 V 4.8367 9.0353 119.5333 59.7047 35.7164 174.2557 32 S 4.9804 8.8269 117.3341 56.6280 64.7022 172.7369 33 L 4.6782 8.6099 127.6667 53.5829 43.1437 175.0961 34 N 5.8799 9.2660 122.5384 50.0045 42.1018 174.8881 *37 S 4.1326 8.3975 120.2910 58.3584 64.1122 174.4765 38 G 3.9679 9.5538 109.0241 46.3179 0.0000 172.9445 39 Y 4.6078 6.4630 114.9637 56.0331 40.1143 172.9974 40 H 4.6212 8.8325 121.7835 56.4528 30.4072 174.8545 41 F 5.1022 8.0759 118.8444 56.5440 39.4760 173.6188 42 C 4.7954 6.9376 115.0604 56.2128 43.5846 173.4673 43 G 4.3236 9.0313 109.6577 45.9138 0.0000 172.3129 44 G 4.4937 8.2661 105.6082 46.2712 0.0000 172.3988 45 S 5.3816 9.0426 115.5936 56.3580 66.7620 173.8079 46 L 4.7593 9.2091 127.9632 55.0983 42.3428 177.1633 47 I 4.4844 8.5074 119.4807 60.9807 38.9159 174.4161 48 N 4.6333 7.4970 117.1091 52.4544 39.4399 174.7746 49 S 4.2802 8.5875 111.5652 60.5654 63.3534 175.1610 50 Q 4.4755 8.9578 119.3402 55.3727 30.2128 174.8494 51 W 5.5905 8.1270 117.4682 54.8123 33.7826 174.2583 52 V 5.0879 9.2318 123.6342 61.0942 34.3588 174.3528 53 V 4.9257 8.8994 126.8949 60.5428 33.9691 174.9546 54 S 4.7461 8.8640 117.0962 57.3714 66.4111 172.3222 55 A 4.6858 8.5109 121.4034 51.0855 19.6651 178.5937 56 A 3.8343 8.2658 123.7915 55.1776 18.4348 179.3648 57 H 4.5754 8.2461 109.8136 57.5270 28.8157 175.4604 58 C 4.7126 7.8174 117.0202 57.3903 40.4728 173.3046 59 Y 4.3250 7.7530 122.3542 57.7856 38.7662 175.1078 60 K 3.3387 7.1044 123.5915 55.7623 34.8284 174.6887 61 S 4.3138 7.9611 114.7515 58.3675 64.1893 173.3050 62 G 3.7276 8.4003 106.1247 46.7247 0.0000 173.6664 63 I 4.1843 7.5902 119.8507 60.3299 39.1015 174.8360 64 Q 4.8612 8.8889 128.0701 54.3241 31.2943 174.2451 65 V 4.3166 8.7352 127.2454 62.0052 33.4120 174.6573 66 R 5.0987 9.0117 127.1592 54.7174 32.5213 174.9447 67 L 4.7097 9.1018 124.8586 52.7141 44.6690 177.7023 *69 G 4.1946 8.2697 108.1099 44.6355 0.0000 172.6991 70 E 4.3247 8.2710 118.7784 55.6463 29.3977 174.1737 71 D 4.8898 8.0225 118.9873 55.2141 44.6274 174.4699 72 N 5.1259 9.0346 118.5910 53.2019 39.4208 176.0499 73 I 4.0379 8.4991 119.6554 61.9331 38.0484 176.1316 74 N 4.7592 8.6720 118.1634 53.0432 39.1396 174.7704 75 V 4.3223 7.4080 118.1967 60.6889 34.2682 174.9724 76 V 4.0923 8.4855 126.9008 62.7301 31.1913 175.1502 77 E 4.4262 9.3057 127.3706 55.3981 30.5298 176.8099 78 G 3.9906 7.9989 105.4184 45.3673 0.0000 174.1613 79 N 4.9574 8.1360 115.8890 52.8853 40.2868 174.3064 80 E 4.4533 8.0757 118.5606 56.4341 30.7079 176.2031 81 Q 4.4342 8.9682 121.0168 54.1518 32.4484 174.2622 82 F 5.5855 8.7638 122.7835 55.9732 41.0521 175.2307 83 I 4.6680 8.8118 124.6886 59.3523 41.0283 175.4868 84 S 4.7073 8.7711 122.7495 58.3625 64.1527 173.4124 85 A 4.6193 8.6998 126.0136 52.1692 18.2441 177.8337 86 S 4.5638 8.9475 117.2549 59.8977 64.4981 174.4710 87 K 4.6994 7.5213 117.2579 55.9046 35.5073 174.8976 88 S 5.2462 8.6894 116.4762 57.0884 67.0885 174.0760 89 I 4.5741 9.2572 123.6618 59.6416 40.3587 174.6736 90 V 4.1418 8.4080 127.4568 62.2251 32.6086 175.2085 91 H 3.6744 8.7299 127.3642 55.8836 29.9997 174.5001 92 P 4.2973 0.0000 0.0000 65.2972 31.3100 177.0820 93 S 4.6178 7.8365 112.8239 58.0020 62.9976 173.3620 94 Y 4.3614 8.0134 123.5261 57.9200 38.9819 174.6114 95 N 4.5046 8.3102 125.4963 51.2994 40.0777 175.1100 96 S 3.7192 7.7271 120.5616 60.0842 63.4451 175.4127 97 N 4.3862 8.3160 119.0908 55.2537 38.4113 175.8868 98 T 4.0873 7.6525 104.9614 60.2582 70.2502 174.3091 99 L 3.7758 7.9956 120.8266 55.4366 40.0799 173.9420 100 N 4.3478 7.5068 116.6890 54.9788 39.5015 174.6151 101 N 4.7190 8.7234 121.4726 54.0168 35.7943 175.7920 102 D 4.6508 7.8443 117.7774 52.7185 40.1003 174.8164 103 I 4.8341 7.2369 121.1358 59.5662 42.0165 172.5754 104 M 5.5156 9.1744 124.3808 54.2360 35.2256 173.2142 105 L 5.3957 9.4036 120.2430 53.2316 44.9762 175.5596 106 I 5.0757 8.9753 123.2769 59.4785 40.7285 174.2222 107 K 3.9782 8.5923 128.5323 54.4055 33.9517 175.2431 108 L 4.4345 8.3086 130.3539 54.7966 41.7584 178.2171 109 K 4.2365 8.9961 127.8769 57.4526 32.2173 175.4373 110 S 4.6084 7.7535 111.2757 55.9302 66.0068 173.4874 111 A 4.3265 8.4623 123.9568 51.9868 18.7451 177.3174 112 A 4.1852 8.7804 124.3668 51.9625 19.4518 177.6555 113 S 4.3490 8.8503 116.7427 57.4899 62.5572 173.9309 114 L 4.4724 8.4722 128.2699 54.5220 42.4992 176.2363 115 N 4.8797 8.8348 119.3875 52.0346 40.0474 174.9508 116 S 4.3448 8.6356 111.6274 60.2819 63.3862 174.7274 117 R 4.3907 8.8422 120.0123 56.1578 31.0249 175.7950 118 V 4.5877 7.8378 117.5972 61.0426 32.6890 173.2068 119 A 5.1728 8.6659 127.7664 49.9290 22.9559 175.2036 120 S 5.0407 8.7444 114.2073 57.9247 64.8067 173.0508 121 I 4.4049 8.3091 121.8872 59.1036 39.2131 175.5924 122 S 4.3754 8.4573 124.8615 58.4247 63.9903 173.9100 123 L 4.1953 8.3507 123.0729 53.6597 42.3290 175.4157 124 P 4.4341 0.0000 0.0000 62.8695 32.0028 176.8853 125 T 4.0070 8.3292 111.6346 63.4884 69.5798 174.7715 *127 S 4.4707 7.5441 114.1907 57.8362 63.9378 173.4796 128 C 4.6546 8.4298 118.2775 56.7196 40.8486 172.6684 129 A 4.8037 7.9177 122.8038 50.4237 21.3011 176.2358 130 S 4.3319 8.0581 113.9063 57.0519 64.8102 173.3071 *132 A 4.1306 8.2053 123.6683 53.5148 19.2187 177.4108 133 G 3.9667 8.8236 110.5892 45.2443 0.0000 174.1874 134 T 4.0473 7.5477 117.5849 63.6282 69.4847 173.8398 135 Q 4.4999 8.6038 125.1051 55.8630 29.9156 175.8186 136 C 5.2557 9.2133 120.0460 55.0500 44.9149 172.3505 137 L 5.2076 9.1436 122.5870 53.5572 43.9578 174.9695 138 I 5.2748 9.0651 127.4370 58.8545 39.8924 174.8750 139 S 4.8676 8.4417 119.4571 56.5760 66.4831 173.1283 140 G 3.7319 7.5290 108.0197 46.3369 0.0000 173.0571 141 W 4.6969 8.6909 116.9158 56.3234 29.3542 177.0501 142 G 4.0837 8.5123 109.6880 44.1644 0.0000 173.4351 143 N 3.6613 8.1511 118.2290 54.1685 38.9544 174.8286 144 T 4.9058 8.2708 114.9826 61.1181 69.7777 174.9295 145 K 4.6481 7.9202 123.7453 52.9096 34.0717 181.6426 146 S 4.4078 8.5226 116.2071 59.2134 63.7512 174.2269 147 S 4.4088 7.8919 114.9965 57.9565 64.7200 173.4953 148 G 3.8865 9.9065 115.7355 44.4764 0.0000 171.3404 149 T 4.8469 8.0454 115.1162 62.2031 72.6108 173.8555 150 S 4.6243 9.5309 121.3885 57.3085 66.0693 171.9686 151 Y 4.9517 8.8583 125.1605 55.6912 39.4929 174.1465 152 P 4.6854 0.0000 0.0000 62.7273 32.7786 175.3508 153 D 5.0228 8.5758 116.3018 54.4698 42.9889 176.8798 154 V 4.9801 7.7584 111.0884 59.0244 33.7328 175.5893 155 L 3.1692 8.4049 124.4995 54.9532 42.9824 175.9710 156 K 4.8627 8.2530 124.8840 54.8393 35.2280 174.5430 157 C 5.2239 8.4847 119.6908 55.0801 42.8922 173.0430 158 L 4.9718 8.7269 123.5299 53.5388 45.3685 174.6553 159 K 4.9591 9.0853 127.9015 55.8604 33.2308 175.6593 160 A 4.7665 8.9862 128.7241 49.9181 23.0146 173.3808 161 P 5.0071 0.0000 0.0000 61.7073 33.8118 175.4187 162 I 4.2979 8.4250 123.0698 61.7459 37.9045 175.7156 163 L 4.8755 8.7631 127.5380 53.0791 43.3884 176.9940 164 S 4.2867 8.5230 115.2735 58.5760 63.7086 175.3592 165 D 4.4356 8.7085 122.2586 57.4351 40.5400 179.2504 166 S 4.2717 8.0575 114.9510 61.3697 63.0584 176.5629 167 S 4.1283 8.1899 118.0011 61.0570 62.5892 175.7271 168 C 4.2651 8.3175 122.1615 59.7032 43.2871 175.8592 169 K 4.0000 8.3821 118.9146 59.4904 31.6493 179.3250 170 S 4.2548 8.1321 114.7973 61.4113 62.7603 176.1931 171 A 4.0035 7.6185 122.5733 53.8629 19.6865 177.3907 172 Y 4.9587 7.5345 113.6480 55.6941 38.5745 173.2476 173 P 4.5227 0.0000 0.0000 63.9426 32.3887 177.6224 174 G 3.9951 9.0002 109.8237 46.0903 0.0000 173.7394 175 Q 4.5352 8.1420 117.1541 55.5258 30.7076 175.6883 176 I 4.4527 7.8719 119.1105 60.0969 38.6196 175.1181 177 T 4.6573 8.2109 114.6512 59.4752 71.1830 174.9458 178 S 4.3641 8.4920 114.7991 60.3313 63.2620 174.3814 179 N 4.9075 7.9812 117.6903 53.6996 38.3912 173.9858 180 M 5.5610 8.0205 117.5136 53.6562 36.0592 174.5937 181 F 5.1245 8.8308 115.4566 55.7274 42.2373 172.5652 182 C 5.4664 8.9624 116.1015 55.6778 39.7237 172.7205 183 A 5.0433 9.4149 122.3247 50.7947 22.4145 174.3438 184 G 4.0521 7.2908 106.3828 44.4241 0.0000 174.3509 184A Y 4.6637 8.4566 121.2403 56.2205 41.4380 176.1317 185 L 4.0998 8.8264 127.5920 57.9904 42.0346 179.2684 186 E 4.0173 8.2182 112.8934 56.4766 30.0138 181.9370 187 G 3.9099 7.5877 104.3128 45.8110 0.0000 172.8889 188 G 4.0312 9.7263 105.8671 44.8063 0.0000 173.5554 188A K 5.1158 7.3332 117.5845 55.3049 35.7497 175.1271 189 D 4.6374 8.9970 123.6891 53.9230 45.7054 174.6227 190 S 4.9066 8.6698 116.7143 57.8783 65.5850 172.7399 191 C 4.7376 9.2014 118.5268 55.4947 45.4759 172.3506 192 Q 4.3611 8.5710 119.1045 58.0677 28.4818 178.4873 193 G 4.2801 9.2440 110.4028 45.6681 0.0000 173.8730 194 D 4.6829 8.4219 118.5526 55.5082 41.6917 176.3763 195 S 4.3538 7.8610 114.8569 59.6326 63.3897 175.2683 196 G 4.1613 9.0381 114.0997 46.3504 0.0000 173.6351 197 G 4.5274 7.8574 107.4795 44.5892 0.0000 171.2368 198 P 5.0531 0.0000 0.0000 62.4788 33.2500 175.6525 199 V 4.5821 8.7325 121.9926 61.4189 33.8208 174.1521 200 V 4.7792 8.7854 129.0354 61.3075 34.0526 173.7122 201 C 5.0313 8.6890 124.4959 55.6526 43.9935 174.5824 202 S 3.6266 9.8019 120.1713 59.7426 60.0817 173.3325 203 G 3.9237 8.4774 104.6040 45.6379 0.0000 173.9771 204 K 4.6925 7.5860 117.8346 52.9864 35.3064 175.5437 *209 L 4.4065 8.2688 122.7965 55.4924 42.0019 175.7460 210 Q 4.5622 8.9719 125.9078 56.2391 31.0674 175.8601 211 G 5.3001 8.0578 104.6177 45.5422 0.0000 171.3721 212 I 5.2161 8.1972 120.0687 58.8179 40.9646 175.1874 213 V 3.7612 8.9020 127.3827 64.0008 31.7880 174.0970 214 S 4.8693 8.5462 120.8436 58.5575 64.3985 174.5521 215 W 4.9797 7.4802 114.4492 56.1412 31.7885 172.6751 216 G 4.1447 8.3390 108.1025 46.8308 0.0000 172.2155 217 S 4.7835 8.3014 116.3766 56.8819 64.2421 173.6608 *219 G 4.3248 8.1470 114.7663 45.6117 0.0000 171.9282 220 C 4.8678 8.1900 116.9464 56.5024 45.4022 173.9108 221 A 3.9486 9.5407 126.9238 53.2369 16.7106 176.8446 221A Q 4.5367 7.4788 119.3940 56.7729 29.8120 176.8146 222 K 4.2695 8.5077 122.8305 56.3113 32.1330 175.9306 223 N 4.3040 9.1001 119.0659 53.4507 37.1235 175.4640 224 K 4.3993 7.6421 114.9694 54.2301 32.1839 173.2644 225 P 4.6346 0.0000 0.0000 62.1483 33.3700 177.7503 226 G 3.7009 8.4919 107.0034 45.8347 0.0000 172.8388 227 V 4.3695 7.5497 121.4020 60.6301 33.9939 174.0742 228 Y 4.9963 8.1833 124.7663 55.9253 41.8827 175.1558 229 T 4.2918 8.6215 120.2554 63.7718 69.9651 174.2738 230 K 5.2206 9.2927 128.1934 55.2731 30.8841 177.2279 231 V 3.9905 8.9569 125.5117 65.6836 31.4634 174.7841 232 C 4.3871 8.2515 112.6299 58.1042 41.6656 174.9338 233 N 4.1515 8.0942 117.8254 54.8357 38.3853 175.5818 234 Y 4.7999 7.9404 117.4294 57.6232 38.6892 177.5123 235 V 3.7185 7.7793 121.3281 66.1807 31.6421 178.0466 236 S 4.1275 8.0834 114.5370 61.1784 62.6837 176.1772 237 W 4.2039 8.3284 130.6229 60.5240 30.4368 177.8523 238 I 3.0352 8.5011 119.9127 64.2253 36.5167 178.5704 239 K 3.7682 8.1313 119.4330 59.6086 31.6403 179.5449 240 Q 3.9254 7.9445 117.3937 58.9477 28.9433 178.5735 241 T 3.7164 7.5767 117.2393 66.4651 68.2867 176.9119 242 I 2.6733 7.2313 114.9300 63.4518 37.1776 178.0568 243 A 4.0176 7.4711 121.2142 53.9635 18.1866 178.6864 244 S 4.6903 7.3123 110.9086 58.3374 63.4121 174.0434 245 N 4.6795 7.9535 125.5890 53.6238 39.5505 174.1322 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.21 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.87 0.85 0.00 0.00 17 V 8.74 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 1.02 0.00 0.00 0.97 0.00 0.00 18 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 19 G 7.74 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 20 Y 7.92 4.96 0.00 2.95 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 21 T 8.57 4.23 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 22 C 8.61 4.18 0.00 2.74 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 23 G 7.89 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 24 A 8.46 4.28 1.32 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 25 N 8.88 4.25 0.00 2.86 2.91 0.00 0.00 7.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.65 4.20 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 V 7.01 4.06 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.49 0.00 2.36 2.38 0.00 3.62 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.98 0.00 29 Y 6.86 5.18 0.00 3.18 3.40 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 30 Q 7.44 4.52 0.00 1.82 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.74 0.00 0.00 0.00 0.00 0.00 1.90 2.53 0.00 31 V 9.04 4.84 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 32 S 8.83 4.98 0.00 3.14 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 33 L 8.61 4.68 0.00 0.29 1.05 0.76 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.27 5.88 0.00 2.43 2.49 0.00 0.00 6.78 7.52 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 *37 S 8.40 4.13 0.00 3.68 3.61 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 38 G 9.55 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 0.00 0.00 0.00 39 Y 6.46 4.61 0.00 3.07 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 40 H 8.83 4.62 0.00 2.89 3.15 0.00 5.87 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 41 F 8.08 5.10 0.00 3.11 3.22 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 42 C 6.94 4.80 0.00 2.17 2.76 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 43 G 9.03 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 44 G 8.27 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 0.00 0.00 0.00 0.00 45 S 9.04 5.38 0.00 3.79 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 46 L 9.21 4.76 0.00 1.87 1.67 1.08 1.09 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 47 I 8.51 4.48 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 1.55 0.93 0.95 0.00 0.00 48 N 7.50 4.63 0.00 2.98 3.01 0.00 0.00 6.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.59 4.28 0.00 4.23 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.96 4.48 0.00 2.25 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 51 W 8.13 5.59 0.00 3.24 3.01 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 52 V 9.23 5.09 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 53 V 8.90 4.93 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.01 0.00 0.00 54 S 8.86 4.75 0.00 3.90 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 55 A 8.51 4.69 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 56 A 8.27 3.83 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.25 4.58 0.00 3.40 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.82 4.71 0.00 3.23 3.34 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 59 Y 7.75 4.32 0.00 2.93 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 60 K 7.10 3.34 0.00 1.43 1.31 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.69 0.96 7.81 61 S 7.96 4.31 0.00 3.96 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 62 G 8.40 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.59 4.18 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.80 0.95 0.00 0.00 64 Q 8.89 4.86 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 65 V 8.74 4.32 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 0.99 0.00 0.00 0.91 0.00 0.00 66 R 9.01 5.10 0.00 1.70 1.82 0.00 2.70 0.00 0.00 2.62 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.28 0.00 67 L 9.10 4.71 0.00 1.58 1.64 0.98 0.71 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 *69 G 8.27 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.27 4.32 0.00 2.17 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 2.39 2.11 0.00 71 D 8.02 4.89 0.00 2.74 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 72 N 9.03 5.13 0.00 2.81 2.83 0.00 0.00 7.18 7.56 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 73 I 8.50 4.04 1.42 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.50 -0.44 0.00 0.00 74 N 8.67 4.76 0.00 2.80 2.88 0.00 0.00 6.62 7.23 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 75 V 7.41 4.32 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 0.95 0.00 0.00 76 V 8.49 4.09 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 0.83 0.00 0.00 1.02 0.00 0.00 77 E 9.31 4.43 0.00 1.97 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 2.28 2.46 0.00 78 G 8.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.14 4.96 0.00 2.71 2.79 0.00 0.00 7.15 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.08 4.45 0.00 1.40 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 81 Q 8.97 4.43 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 82 F 8.76 5.59 0.00 2.81 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 83 I 8.81 4.67 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 1.24 0.87 0.93 0.00 0.00 84 S 8.77 4.71 0.00 3.75 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.70 4.62 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.95 4.56 0.00 3.78 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 87 K 7.52 4.70 0.00 1.86 1.90 0.00 1.58 0.00 0.00 1.89 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.48 7.81 88 S 8.69 5.25 0.00 4.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.26 4.57 2.02 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 1.10 0.00 0.00 90 V 8.41 4.14 1.99 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 0.66 0.00 0.00 0.78 0.00 0.00 91 H 8.73 3.67 0.00 2.79 3.02 0.00 5.64 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.30 0.00 2.17 2.18 0.00 2.43 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 93 S 7.84 4.62 0.00 3.95 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.01 4.36 0.00 2.87 2.90 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 95 N 8.31 4.50 0.00 2.59 2.45 0.00 0.00 6.65 7.75 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 96 S 7.73 3.72 0.00 3.95 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 97 N 8.32 4.39 0.00 2.76 2.79 0.00 0.00 6.82 8.40 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 98 T 7.65 4.09 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 8.00 3.78 0.00 1.62 1.92 0.87 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.51 4.35 0.00 2.88 2.68 0.00 0.00 7.24 6.59 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 0.00 101 N 8.72 4.72 0.00 3.08 2.68 0.00 0.00 7.22 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.84 4.65 0.00 3.11 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.24 4.83 1.48 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.17 0.05 0.00 0.00 104 M 9.17 5.52 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 105 L 9.40 5.40 0.00 1.60 1.81 -0.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.98 5.08 1.95 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 1.23 0.97 0.92 0.00 0.00 107 K 8.59 3.98 0.00 0.79 1.10 0.00 1.15 0.00 0.00 1.30 0.00 0.00 2.61 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.65 0.21 7.81 108 L 8.31 4.43 0.00 1.40 1.61 0.93 0.69 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 0.00 109 K 9.00 4.24 0.00 1.52 1.73 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.27 7.81 110 S 7.75 4.61 0.00 3.88 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 0.00 111 A 8.46 4.33 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 0.00 112 A 8.78 4.19 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 0.00 113 S 8.85 4.35 0.00 3.90 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.47 4.47 0.00 1.70 1.61 0.95 1.11 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 0.00 115 N 8.83 4.88 0.00 2.89 2.91 0.00 0.00 6.53 7.89 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 0.00 116 S 8.64 4.34 0.00 4.01 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 0.00 117 R 8.84 4.39 0.00 1.97 1.98 0.00 3.07 0.00 0.00 3.36 7.30 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.54 4.47 0.00 4.00 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 0.00 128 C 8.43 4.65 0.00 2.92 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 0.00 129 A 7.92 4.80 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.06 4.33 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.21 4.13 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.82 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 0.00 0.00 0.00 134 T 7.55 4.05 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 135 Q 8.60 4.50 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.21 5.26 0.00 2.84 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 9.14 5.21 0.00 1.76 1.56 1.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.07 5.27 1.86 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.60 0.93 0.00 0.00 139 S 8.44 4.87 0.00 3.55 3.58 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 0.00 140 G 7.53 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.69 4.70 0.00 3.24 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 0.00 142 G 8.51 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.15 3.66 0.00 2.07 2.53 0.00 0.00 7.08 7.29 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 0.00 144 T 8.27 4.91 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 145 K 7.92 4.65 0.00 1.77 1.60 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 0.96 7.81 146 S 8.52 4.41 0.00 4.16 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 0.00 147 S 7.89 4.41 0.00 3.79 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.91 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 0.00 149 T 8.05 4.85 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 150 S 9.53 4.62 0.00 3.85 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 0.00 151 Y 8.86 4.95 0.00 2.90 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.69 0.00 2.41 2.09 0.00 4.07 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 153 D 8.58 5.02 0.00 2.67 2.93 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 0.00 154 V 7.76 4.98 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 0.92 0.00 0.00 0.96 0.00 0.00 155 L 8.40 3.17 0.00 1.29 1.22 -0.74 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.25 4.86 0.00 1.62 1.48 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.45 7.81 157 C 8.48 5.22 0.00 1.40 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.73 4.97 0.00 1.67 1.45 1.03 0.55 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 0.00 159 K 9.09 4.96 0.00 1.95 1.84 0.00 1.87 0.00 0.00 1.79 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.51 7.81 160 A 8.99 4.77 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.01 0.00 2.02 2.08 0.00 3.02 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.71 0.00 162 I 8.43 4.30 1.92 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.76 0.85 0.00 0.00 163 L 8.76 4.88 0.00 1.55 1.59 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.52 4.29 0.00 4.01 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 0.00 165 D 8.71 4.44 0.00 2.77 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 0.00 166 S 8.06 4.27 0.00 4.06 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 0.00 167 S 8.19 4.13 0.00 4.08 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 0.00 168 C 8.32 4.27 0.00 3.20 3.39 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 0.00 169 K 8.38 4.00 0.00 1.76 1.92 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.66 7.81 170 S 8.13 4.25 0.00 4.01 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 0.00 171 A 7.62 4.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.53 4.96 0.00 3.07 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 0.00 173 P 0.00 4.52 0.00 2.08 2.04 0.00 3.84 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 2.06 2.11 0.00 174 G 9.00 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 0.00 175 Q 8.14 4.54 0.00 2.47 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.55 0.00 176 I 7.87 4.45 1.99 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 1.87 0.94 1.01 0.00 0.00 177 T 8.21 4.66 4.29 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 1.30 0.00 0.00 178 S 8.49 4.36 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.98 4.91 0.00 3.14 3.13 0.00 0.00 6.62 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 0.00 180 M 8.02 5.56 0.00 1.86 2.00 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 181 F 8.83 5.12 0.00 3.03 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 0.00 182 C 8.96 5.47 0.00 2.96 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 0.00 183 A 9.41 5.04 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.29 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 0.00 0.00 0.00 184A Y 8.46 4.66 0.00 2.97 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 0.00 185 L 8.83 4.10 0.00 1.74 1.88 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.22 4.02 0.00 1.99 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 2.23 1.87 0.00 187 G 7.59 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 0.00 188 G 9.73 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.33 5.12 0.00 1.53 1.73 0.00 1.15 0.00 0.00 1.49 0.00 0.00 2.55 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.41 1.23 7.81 189 D 9.00 4.64 0.00 2.78 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 0.00 190 S 8.67 4.91 0.00 4.11 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 0.00 191 C 9.20 4.74 0.00 2.93 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 0.00 192 Q 8.57 4.36 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.22 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 193 G 9.24 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 0.00 0.00 0.00 0.00 194 D 8.42 4.68 0.00 2.93 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 0.00 195 S 7.86 4.35 0.00 4.01 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 0.00 196 G 9.04 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.86 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.05 0.00 2.32 2.36 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 199 V 8.73 4.58 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.57 0.00 0.00 200 V 8.79 4.78 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 0.86 0.00 0.00 0.59 0.00 0.00 201 C 8.69 5.03 0.00 2.80 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.80 3.63 0.00 3.95 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 0.00 203 G 8.48 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.59 4.69 0.00 1.71 1.63 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.27 4.41 0.00 1.51 1.65 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.97 4.56 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 8.06 5.30 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 0.00 212 I 8.20 5.22 1.92 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 1.29 0.93 1.00 0.00 0.00 213 V 8.90 3.76 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.15 0.00 0.00 214 S 8.55 4.87 0.00 4.01 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 0.00 215 W 7.48 4.98 0.00 3.28 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 0.00 216 G 8.34 4.14 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 0.00 0.00 0.00 217 S 8.30 4.78 0.00 4.16 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 *219 G 8.15 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 0.00 220 C 8.19 4.87 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 9.54 3.95 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 221A Q 7.48 4.54 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 222 K 8.51 4.27 0.00 1.77 1.61 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.04 7.81 223 N 9.10 4.30 0.00 2.80 2.85 0.00 0.00 6.78 7.74 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 0.00 224 K 7.64 4.40 0.00 1.95 1.90 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.37 1.54 7.81 225 P 0.00 4.63 0.00 2.12 2.11 0.00 3.57 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 226 G 8.49 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.55 4.37 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 0.19 0.00 0.00 -0.74 0.00 0.00 228 Y 8.18 5.00 0.00 1.43 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 0.00 229 T 8.62 4.29 4.29 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 1.19 0.00 0.00 230 K 9.29 5.22 0.00 2.13 1.92 0.00 1.80 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.59 7.81 231 V 8.96 3.99 2.35 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 1.24 0.00 0.00 1.10 0.00 0.00 232 C 8.25 4.39 0.00 3.16 3.39 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 0.00 233 N 8.09 4.15 0.00 2.31 2.34 0.00 0.00 6.83 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.94 4.80 0.00 3.26 3.27 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 0.00 235 V 7.78 3.72 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.08 0.00 0.00 236 S 8.08 4.13 0.00 3.96 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 0.00 237 W 8.33 4.20 0.00 3.49 3.58 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 0.00 238 I 8.50 3.04 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.99 0.72 0.00 0.00 239 K 8.13 3.77 0.00 1.76 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.59 7.81 240 Q 7.94 3.93 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 241 T 7.58 3.72 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 242 I 7.23 2.67 0.76 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.79 -0.64 0.00 0.00 243 A 7.47 4.02 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 0.00 244 S 7.31 4.69 0.00 3.88 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 0.00 245 N 7.95 4.68 0.00 2.91 2.95 0.00 0.00 6.74 7.43 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 * Residues marked with a * may have inaccurate shift predictions.