NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2528 7.8827 121.4566 61.2401 38.5693 173.8002 17 V 4.1293 8.8748 126.4899 61.9577 32.4664 174.5991 18 G 3.9508 8.5349 114.3491 46.8298 0.0000 173.3012 19 G 4.2324 7.7425 109.9845 44.1920 0.0000 172.6717 20 Y 4.9770 7.8044 117.0236 55.1574 42.3377 175.0354 21 T 4.1857 8.5666 117.0304 63.9812 68.8662 176.0349 22 C 4.1686 8.6968 125.6580 58.8313 36.0325 175.7227 23 G 3.9351 7.9239 103.3318 45.1773 0.0000 172.6591 24 A 4.2662 8.4847 125.8975 53.8336 18.5680 176.8030 25 N 4.2789 8.8721 119.4735 54.5872 36.0593 175.4236 26 T 4.1976 7.7236 108.0501 62.7641 69.7655 175.2000 27 V 4.0386 7.0649 122.3678 60.1518 31.2916 173.5407 28 P 4.5074 0.0000 0.0000 64.0690 32.0978 178.0996 29 Y 5.1094 6.9788 115.9417 56.5787 38.7777 174.5719 30 Q 4.6774 7.3804 123.4164 56.2122 29.6320 175.3790 31 V 4.8470 8.9571 118.8050 59.6434 36.0668 174.1680 32 S 4.8936 8.7100 117.1524 56.5808 64.7639 172.7144 33 L 4.5965 8.4838 127.8951 53.5654 43.0498 175.1009 34 N 5.7511 8.8905 122.6896 49.9651 42.0307 175.0036 *37 S 4.2726 8.4643 120.9670 58.2796 64.1687 174.5783 38 G 3.9991 10.0585 109.2208 46.0780 0.0000 172.9572 39 Y 4.5393 6.6468 114.8439 56.1542 39.9656 172.7292 40 H 4.4954 8.8649 121.9995 56.2985 30.3473 174.8185 41 F 5.0401 7.9285 119.7906 56.6910 39.4850 173.8598 42 C 4.7488 6.8576 115.1429 56.1121 44.7235 173.4251 43 G 4.2149 8.6052 109.6513 45.5368 0.0000 172.2165 44 G 4.5374 7.9506 105.7235 46.4459 0.0000 172.5894 45 S 5.4105 8.5030 115.2385 56.3487 66.7523 173.7890 46 L 4.6969 9.3267 128.1621 55.1199 42.2893 177.1340 47 I 4.5177 8.7925 119.6841 61.0240 39.3503 174.5632 48 N 4.8477 7.5667 116.9920 52.4693 39.2371 174.3719 49 S 4.2526 8.7675 111.1122 60.3112 63.7355 174.2642 50 Q 4.5609 9.1007 121.5760 55.4016 30.8373 174.3130 51 W 5.5484 8.3101 117.4232 55.6115 33.6142 174.2181 52 V 4.9291 9.1898 123.8672 61.1729 34.2923 174.1529 53 V 4.8541 8.7114 127.0230 61.8344 33.7758 174.7736 54 S 5.0105 8.9982 120.8654 57.3827 66.3514 172.1695 55 A 4.6299 8.5120 121.2290 51.1824 19.5972 178.5152 56 A 3.7729 8.4102 124.7040 55.4115 18.3751 179.1265 57 H 4.5766 8.1157 108.5955 57.0869 28.6989 175.2552 58 C 4.6957 7.6809 117.1485 57.0737 40.6138 173.3157 59 Y 4.2231 7.6991 122.3216 57.9842 38.5868 175.3294 60 K 3.7668 7.4162 124.3636 55.8012 35.3273 174.6913 61 S 4.3090 7.9479 113.5334 58.3164 64.2503 173.7117 62 G 3.7085 8.5501 108.0292 46.3877 0.0000 173.2546 63 I 4.1261 7.6066 120.4088 60.3529 38.7955 174.6216 64 Q 4.7880 9.0510 128.9709 54.2865 31.1895 174.2557 65 V 4.1968 8.8429 127.2699 62.0297 33.4438 174.6519 66 R 4.9862 8.9588 127.2818 54.6678 32.3638 175.0037 67 L 4.7236 9.1948 124.9065 52.8011 44.5486 177.7866 *69 G 4.1680 8.2977 108.3845 45.3071 0.0000 172.8567 70 E 4.3466 8.1797 118.4655 55.7378 29.8646 174.1188 71 D 4.8738 7.9381 117.3282 55.3053 44.5134 174.4796 72 N 5.0724 9.0296 120.1647 52.9477 39.1322 176.2475 73 I 3.8388 8.2904 119.8788 62.2935 37.9788 176.3227 74 N 4.7253 8.5240 117.8768 53.1751 39.2138 174.9678 75 V 4.3500 7.3237 116.4416 60.6523 34.4694 174.9656 76 V 4.0889 8.4319 126.4724 62.6923 31.1666 175.2145 77 E 4.4602 9.9118 126.9600 55.5578 31.0667 177.3506 78 G 3.8903 8.1450 105.5326 46.6840 0.0000 173.9589 79 N 4.5598 8.8567 116.2577 52.8135 36.5296 174.3270 80 E 4.5088 7.7111 117.4816 56.3699 30.7336 176.2217 81 Q 4.5199 9.1215 121.4748 54.1709 32.5957 174.1639 82 F 5.5860 8.8423 122.6103 55.9699 41.1599 175.2066 83 I 4.6608 8.7843 124.4999 59.2730 40.9690 175.4139 84 S 4.5085 8.7846 122.7558 58.3610 64.1661 173.4372 85 A 4.4355 8.4253 126.0103 52.2332 18.0510 177.8947 86 S 4.4867 8.8920 118.4344 60.3560 64.3638 174.7708 87 K 4.7078 7.5835 117.1861 55.5870 35.7397 174.9941 88 S 5.1603 8.7717 117.3528 56.9700 66.1045 173.6636 89 I 4.4679 9.2633 125.7986 59.3940 38.9656 174.9513 90 V 4.0712 8.2763 127.3340 62.2798 32.6134 175.1745 91 H 3.8760 8.7745 127.1885 56.1830 29.9203 174.3930 92 P 4.3058 0.0000 0.0000 65.2477 31.3684 177.1618 93 S 4.6565 7.9082 111.5686 57.9774 63.1593 173.3660 94 Y 4.3473 7.8747 122.7649 57.9265 38.9367 174.9564 95 N 4.5263 8.2616 125.6703 51.4488 40.3731 175.1376 96 S 3.7844 8.0010 120.2113 59.9862 63.8301 175.1574 97 N 4.3614 8.9341 119.7336 55.8754 38.5046 176.2840 98 T 3.9586 7.7571 104.7879 61.0152 69.6913 175.2044 99 L 3.7297 7.9573 121.0866 55.1813 39.9109 173.9582 100 N 4.4383 7.4430 117.6024 54.7166 39.4643 174.5908 101 N 4.1877 8.6898 120.1552 54.1308 35.8677 175.5469 102 D 4.6909 7.9634 117.5483 52.9938 39.6337 174.5885 103 I 4.7476 7.1238 120.8542 59.4143 42.2399 172.7246 104 M 5.5041 9.1616 126.9476 54.1467 36.2931 173.3039 105 L 5.4135 9.2572 124.8911 53.2610 44.7993 175.3777 106 I 4.9420 9.2457 123.6831 59.4271 40.3787 174.3008 107 K 3.7026 8.4152 128.7544 54.5899 33.4511 175.7335 108 L 4.4758 8.4034 130.4996 54.9355 41.8851 178.1692 109 K 4.2485 8.7183 126.4787 57.7816 32.1394 177.3104 110 S 4.5962 7.6993 111.2512 56.0179 66.1288 173.2788 111 A 4.3698 8.3951 123.3810 51.7320 18.6950 177.5129 112 A 4.1340 8.9885 124.4524 52.1754 19.5253 177.5771 113 S 4.5270 9.0915 117.5192 57.2800 63.4154 174.5182 114 L 4.4596 8.5158 125.8729 54.5288 42.1018 176.4452 115 N 4.7911 8.8339 118.9481 52.4915 39.7535 174.8502 116 S 4.3114 8.7340 111.6237 60.6837 63.3517 174.7440 117 R 4.3558 9.1404 119.7378 55.9445 31.4714 176.0430 118 V 4.4213 7.7555 116.1733 60.9919 33.1792 173.7008 119 A 5.1322 8.5463 128.4149 50.4734 22.9948 175.1326 120 S 5.0762 8.6783 113.9956 57.7123 64.9841 173.0737 121 I 4.4257 8.2557 121.3309 59.1047 39.4271 175.4966 122 S 4.4045 8.4003 124.3712 58.3190 64.0646 173.8058 123 L 4.2131 8.3696 123.4797 53.6053 42.3166 175.4036 124 P 4.5009 0.0000 0.0000 63.0054 32.3233 176.2621 125 T 4.1539 8.2336 108.8776 62.4968 69.9512 174.6113 *127 S 4.8601 7.5614 114.7375 57.9833 64.0556 173.9258 128 C 4.3989 8.4031 117.9789 56.6519 40.6601 173.7229 129 A 4.3548 8.0885 125.9561 51.5102 19.5402 177.3950 130 S 4.3308 8.1014 114.5704 57.0021 64.8895 173.1802 *132 A 4.2248 8.1902 123.2740 53.4896 19.1666 177.4832 133 G 3.9455 9.1859 110.5762 45.2375 0.0000 174.0960 134 T 3.9993 7.5456 117.4775 63.7677 69.4474 173.4718 135 Q 4.7595 8.5689 124.9415 55.1800 30.2716 175.6674 136 C 5.2416 9.2171 119.7669 55.1300 45.9022 172.3881 137 L 5.1710 9.0357 122.8500 53.5292 43.9825 175.0660 138 I 5.1470 9.1740 127.2247 58.6510 40.1736 174.8094 139 S 4.9064 8.6140 119.7626 56.4805 66.4443 173.1106 140 G 3.8038 7.6339 108.6261 46.1755 0.0000 173.0784 141 W 4.5532 8.7057 117.3987 56.2862 29.3261 177.2097 142 G 4.1992 8.5533 109.7227 44.2940 0.0000 173.4812 143 N 4.2443 9.2126 118.4909 54.2384 39.0596 174.8135 144 T 5.1688 8.4241 115.4564 61.1361 69.4779 174.9583 145 K 4.6882 7.7741 123.3416 52.8305 34.7653 181.1346 146 S 4.2989 8.6877 117.0619 59.4926 63.5915 174.2360 147 S 4.4197 8.1955 115.3323 57.7010 63.4509 173.9034 148 G 3.9018 8.9691 114.1898 45.0644 0.0000 171.3103 149 T 4.5242 7.8170 114.2650 61.6528 71.0870 174.8932 150 S 4.2488 9.1499 121.7889 57.9755 64.9693 172.0740 151 Y 5.1457 8.4120 125.5603 55.8741 39.0944 174.3789 152 P 4.7021 0.0000 0.0000 62.3304 33.0721 176.0693 153 D 4.5410 8.7994 119.0691 56.7637 41.1971 177.0146 154 V 5.4633 7.4096 109.5500 58.3860 34.7761 175.5817 155 L 3.2533 8.3983 123.7607 54.9211 42.9933 175.9350 156 K 4.9674 8.2058 125.0634 54.9232 35.1768 174.5930 157 C 5.2556 8.5759 119.4601 55.1254 42.2919 173.0214 158 L 4.9384 8.7241 123.2851 53.6658 45.4577 174.7768 159 K 5.0851 9.0361 125.6522 55.6122 33.3089 176.0110 160 A 4.8743 9.3308 126.0184 49.4479 23.0204 173.4785 161 P 5.0565 0.0000 0.0000 61.6582 34.1570 175.0322 162 I 4.3300 8.2512 122.5840 61.4199 37.9256 175.9190 163 L 4.7395 8.6943 127.6525 53.5423 43.0558 177.1417 164 S 4.3113 8.6283 117.6593 58.7524 63.9356 175.7525 165 D 4.4785 8.7011 123.9812 58.6044 39.4297 180.1293 166 S 4.3959 8.0104 114.6239 61.5669 63.1934 176.6787 167 S 4.0937 8.0555 118.6557 61.2869 62.6608 175.7450 168 C 4.2992 8.3339 121.1262 59.9006 41.7338 175.9794 169 K 3.9715 8.5473 120.1803 59.3795 31.3238 179.6285 170 S 4.2378 8.0765 115.0388 61.3504 62.7694 176.1240 171 A 4.0046 7.8960 122.9058 53.8786 19.6690 177.3815 172 Y 4.8766 7.7898 113.3883 55.4308 38.4623 173.2372 173 P 4.5810 0.0000 0.0000 63.5658 32.2677 177.6587 174 G 4.0358 9.1884 111.0728 45.6397 0.0000 173.4621 175 Q 4.5157 8.0899 116.3661 55.3836 30.4199 175.3192 176 I 4.4120 7.8654 119.7324 59.9502 38.2689 175.4811 177 T 4.5458 8.2319 115.9588 59.6661 70.7393 175.6061 178 S 4.2807 8.5008 115.4540 60.7392 63.1572 174.5341 179 N 4.9234 7.9275 117.5486 53.4476 38.3470 173.9391 180 M 5.5834 7.9110 117.0014 53.7352 36.0945 174.5257 181 F 5.1196 8.7975 115.2643 55.8199 42.2430 172.5098 182 C 5.4371 8.9958 116.2913 55.8358 40.9166 172.7056 183 A 5.0102 9.4440 122.7673 51.0255 22.3944 174.5457 184 G 3.6949 7.4982 106.2244 44.4853 0.0000 173.8538 184A Y 4.6431 8.5193 120.4027 56.1077 41.2045 176.2431 185 L 4.2105 8.6723 125.6627 57.2359 42.0172 178.6751 186 E 4.1385 8.2245 114.9032 56.8557 30.0370 177.2604 187 G 3.8716 7.6452 106.2522 45.3910 0.0000 172.8931 188 G 4.0012 9.7899 106.4270 44.7006 0.0000 173.4459 188A K 4.7737 7.3977 117.3115 55.2271 35.4641 175.1250 189 D 4.7586 8.9098 123.6115 53.4012 45.4737 174.7206 190 S 4.8407 8.7529 117.0561 58.4541 64.8676 173.1041 191 C 4.7240 9.3860 118.6993 55.3706 41.5194 171.9341 192 Q 4.2463 8.7648 120.2450 58.3329 28.6027 177.7108 193 G 4.3299 9.3463 113.5558 45.6570 0.0000 173.6845 194 D 4.7109 8.5591 118.6673 54.8767 41.6960 176.6543 195 S 4.4019 8.0725 115.6810 60.6051 63.4546 175.5500 196 G 3.8923 9.4586 113.7878 45.1399 0.0000 173.6109 197 G 4.4522 7.8015 107.5482 44.9449 0.0000 171.2284 198 P 5.1183 0.0000 0.0000 62.2962 33.4261 175.6030 199 V 4.6209 8.6330 121.7960 61.4504 33.9619 174.0885 200 V 4.7878 8.7688 128.9042 61.2502 34.1639 173.7156 201 C 5.0686 8.9253 124.7365 55.5347 43.9267 174.6297 202 S 3.5601 9.6968 121.3516 59.7249 59.9921 173.2914 203 G 3.9232 8.2856 104.0496 45.7127 0.0000 173.4660 204 K 4.7224 7.6849 118.1315 53.0582 35.2389 175.4434 *209 L 4.3669 8.2618 122.4927 55.4987 42.1136 175.8895 210 Q 4.5877 8.9799 125.8735 56.3909 31.2355 175.7768 211 G 5.3084 8.0156 104.5740 45.7928 0.0000 171.4386 212 I 5.2850 8.1935 119.7178 58.8458 41.0565 175.2261 213 V 3.5677 9.0265 127.5842 64.0470 31.7837 174.1929 214 S 4.9887 8.4937 121.0651 58.5476 64.3613 174.1286 215 W 5.0399 7.8429 114.0283 55.9764 32.3252 172.1915 216 G 3.8105 8.1821 105.3054 46.4455 0.0000 172.9113 217 S 4.6677 8.5684 114.7172 56.4278 63.0728 172.8119 *219 G 4.2262 7.9878 117.8306 45.5297 0.0000 170.5572 220 C 5.0065 8.0664 115.5337 56.3603 42.9012 173.9026 221 A 4.3577 9.1572 125.1905 53.2293 16.2200 177.3546 221A Q 4.5007 7.5375 119.6362 57.1344 29.6298 176.8827 222 K 4.1941 8.3859 121.9984 55.9646 32.3006 177.3768 223 N 4.2974 9.3745 120.8946 54.2205 36.8654 176.2748 224 K 4.3604 7.4898 119.0232 51.8825 32.1894 177.4233 225 P 4.7105 0.0000 0.0000 61.8699 33.1684 177.2192 226 G 3.6683 8.4267 106.2395 46.1306 0.0000 172.7463 227 V 4.3964 7.7203 122.1903 60.6659 33.9767 174.0872 228 Y 4.9369 8.0664 124.3835 55.9291 41.9309 175.0660 229 T 4.2901 8.4672 120.5305 63.6492 69.9957 174.0806 230 K 4.9670 9.3184 128.3492 55.5148 31.8872 177.3333 231 V 3.9545 9.0603 127.6280 65.7977 31.3993 175.0426 232 C 4.6533 8.2922 112.7004 58.0718 41.5741 174.7780 233 N 4.2523 8.0609 117.4363 54.5143 38.3546 174.9848 234 Y 4.7646 8.1024 117.8523 57.5932 39.1619 177.6811 235 V 3.7081 7.9613 121.6835 66.1994 31.6035 178.0317 236 S 4.1358 8.1212 114.4793 61.3114 62.6548 176.3143 237 W 4.1778 8.3013 130.5320 60.5271 30.4878 177.9196 238 I 3.2762 8.4341 122.4522 64.7440 36.5517 179.1839 239 K 3.7999 8.0565 124.4969 59.9705 31.3103 181.0158 240 Q 4.1102 7.7879 118.3609 58.8104 28.7400 178.6373 241 T 3.6852 7.5135 117.0000 66.5237 68.4487 176.9275 242 I 2.6566 7.3662 121.8064 63.8135 36.7233 178.3407 243 A 4.0747 7.6867 120.7739 53.8676 18.1831 178.6963 244 S 4.6565 7.3108 110.7088 58.1784 63.5372 174.0282 245 N 4.6797 7.8589 125.0805 53.8569 39.1789 174.0431 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 4.25 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.59 0.87 0.00 0.00 17 V 8.87 4.13 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 0.97 0.00 0.00 0.90 0.00 0.00 18 G 8.53 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.74 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 0.00 0.00 0.00 0.00 20 Y 7.80 4.98 0.00 2.94 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 4.19 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 1.26 0.00 0.00 22 C 8.70 4.17 0.00 2.75 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 G 7.92 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 24 A 8.48 4.27 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.87 4.28 0.00 2.90 2.93 0.00 0.00 7.15 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 7.72 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 1.25 0.00 0.00 27 V 7.06 4.04 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 0.23 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.51 0.00 2.39 2.29 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.99 0.00 29 Y 6.98 5.11 0.00 3.23 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 30 Q 7.38 4.68 0.00 1.81 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.72 0.00 0.00 0.00 0.00 0.00 1.99 2.51 0.00 31 V 8.96 4.85 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 0.79 0.00 0.00 0.97 0.00 0.00 32 S 8.71 4.89 0.00 3.19 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 33 L 8.48 4.60 0.00 0.31 1.00 0.78 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.89 5.75 0.00 2.40 2.45 0.00 0.00 6.77 7.16 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 *37 S 8.46 4.27 0.00 3.78 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 38 G 10.06 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 39 Y 6.65 4.54 0.00 3.04 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 40 H 8.86 4.50 0.00 2.81 3.10 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.93 5.04 0.00 3.02 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 42 C 6.86 4.75 0.00 2.20 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 43 G 8.61 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 0.00 0.00 0.00 0.00 44 G 7.95 4.54 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 0.00 0.00 0.00 45 S 8.50 5.41 0.00 3.84 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 9.33 4.70 0.00 1.86 1.68 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.79 4.52 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.93 0.96 0.00 0.00 48 N 7.57 4.85 0.00 3.00 3.02 0.00 0.00 6.04 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 8.77 4.25 0.00 4.22 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 50 Q 9.10 4.56 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 1.86 2.14 0.00 51 W 8.31 5.55 0.00 3.47 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 52 V 9.19 4.93 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 0.83 0.00 0.00 0.98 0.00 0.00 53 V 8.71 4.85 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 0.95 0.00 0.00 1.02 0.00 0.00 54 S 9.00 5.01 0.00 3.89 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.51 4.63 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 56 A 8.41 3.77 0.27 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 57 H 8.12 4.58 0.00 3.40 3.55 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.68 4.70 0.00 3.21 3.31 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 59 Y 7.70 4.22 0.00 2.93 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 60 K 7.42 3.77 0.00 1.51 1.39 0.00 0.66 0.00 0.00 0.61 0.00 0.00 2.42 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.92 0.99 7.81 61 S 7.95 4.31 0.00 3.92 3.80 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 62 G 8.55 3.71 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 0.00 0.00 0.00 63 I 7.61 4.13 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.91 0.90 0.00 0.00 64 Q 9.05 4.79 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.08 2.21 0.00 65 V 8.84 4.20 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 0.96 0.00 0.00 0.88 0.00 0.00 66 R 8.96 4.99 0.00 1.59 1.68 0.00 2.63 0.00 0.00 2.48 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.14 0.00 67 L 9.19 4.72 0.00 1.64 1.63 1.05 0.75 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 *69 G 8.30 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.18 4.35 0.00 2.11 1.90 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 2.36 2.04 0.00 71 D 7.94 4.87 0.00 2.78 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 5.07 0.00 2.84 2.85 0.00 0.00 7.17 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 73 I 8.29 3.84 1.41 0.00 0.00 0.44 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 0.51 -0.48 0.00 0.00 74 N 8.52 4.73 0.00 2.83 2.89 0.00 0.00 6.63 8.01 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 75 V 7.32 4.35 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.43 4.09 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 0.84 0.00 0.00 0.94 0.00 0.00 77 E 9.91 4.46 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 78 G 8.14 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 79 N 8.86 4.56 0.00 2.96 3.07 0.00 0.00 6.96 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.71 4.51 0.00 1.58 1.78 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 2.53 2.47 0.00 81 Q 9.12 4.52 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 82 F 8.84 5.59 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 83 I 8.78 4.66 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.69 0.88 0.00 0.00 84 S 8.78 4.51 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 8.43 4.44 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.89 4.49 0.00 3.80 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 87 K 7.58 4.71 0.00 1.84 1.89 0.00 1.46 0.00 0.00 1.95 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.46 7.81 88 S 8.77 5.16 0.00 4.06 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 89 I 9.26 4.47 2.06 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.04 1.08 0.00 0.00 90 V 8.28 4.07 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 0.71 0.00 0.00 91 H 8.77 3.88 0.00 2.96 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.69 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 4.31 0.00 2.08 2.15 0.00 3.33 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 93 S 7.91 4.66 0.00 3.92 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 94 Y 7.87 4.35 0.00 2.94 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 95 N 8.26 4.53 0.00 2.58 2.43 0.00 0.00 6.62 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.00 3.78 0.00 3.93 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 97 N 8.93 4.36 0.00 2.65 2.78 0.00 0.00 6.91 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 98 T 7.76 3.96 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 7.96 3.73 0.00 1.47 1.84 0.33 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.44 4.44 0.00 2.85 2.65 0.00 0.00 7.23 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 8.69 4.19 0.00 2.93 2.61 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.96 4.69 0.00 3.07 2.67 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 0.00 103 I 7.12 4.75 1.45 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.23 0.09 0.00 0.00 104 M 9.16 5.50 0.00 2.24 1.82 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 105 L 9.26 5.41 0.00 1.82 1.93 0.32 0.98 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 0.00 106 I 9.25 4.94 1.91 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 1.18 0.87 0.87 0.00 0.00 107 K 8.42 3.70 0.00 0.79 1.09 0.00 1.16 0.00 0.00 1.33 0.00 0.00 2.64 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.40 4.48 0.00 1.45 1.56 0.96 0.80 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 0.00 109 K 8.72 4.25 0.00 1.54 1.73 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.39 1.27 7.81 110 S 7.70 4.60 0.00 3.88 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 0.00 111 A 8.40 4.37 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.99 4.13 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 0.00 113 S 9.09 4.53 0.00 3.74 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 0.00 114 L 8.52 4.46 0.00 1.66 1.62 0.96 1.12 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 0.00 115 N 8.83 4.79 0.00 2.88 2.93 0.00 0.00 6.58 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.73 4.31 0.00 4.02 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 0.00 117 R 9.14 4.36 0.00 1.85 2.02 0.00 3.12 0.00 0.00 3.24 7.38 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.56 4.86 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.40 4.40 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.09 4.35 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.10 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 8.19 4.22 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 0.00 133 G 9.19 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.55 4.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.57 4.76 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 136 C 9.22 5.24 0.00 2.84 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 0.00 137 L 9.04 5.17 0.00 1.75 1.57 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.17 5.15 1.87 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 0.76 1.33 0.97 0.00 0.00 139 S 8.61 4.91 0.00 3.49 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.63 3.80 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 0.00 0.00 0.00 141 W 8.71 4.55 0.00 3.11 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 0.00 142 G 8.55 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 9.21 4.24 0.00 2.38 2.69 0.00 0.00 7.11 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 0.00 144 T 8.42 5.17 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 1.32 0.00 0.00 145 K 7.77 4.69 0.00 1.76 1.58 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 0.95 7.81 146 S 8.69 4.30 0.00 4.05 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 0.00 147 S 8.20 4.42 0.00 3.81 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 0.00 148 G 8.97 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 0.00 0.00 0.00 149 T 7.82 4.52 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 150 S 9.15 4.25 0.00 3.78 3.62 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 0.00 0.00 0.00 0.00 151 Y 8.41 5.15 0.00 2.98 2.88 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 0.00 152 P 0.00 4.70 0.00 2.48 2.11 0.00 4.21 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 2.19 2.07 0.00 153 D 8.80 4.54 0.00 2.81 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.41 5.46 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 1.11 0.00 0.00 0.97 0.00 0.00 155 L 8.40 3.25 0.00 1.30 1.25 -0.82 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.21 4.97 0.00 1.68 1.52 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.49 7.81 157 C 8.58 5.26 0.00 1.64 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 0.00 0.00 0.00 0.00 158 L 8.72 4.94 0.00 1.66 1.44 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.04 5.09 0.00 1.83 1.83 0.00 1.85 0.00 0.00 1.78 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.54 1.69 7.81 160 A 9.33 4.87 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 0.00 161 P 0.00 5.06 0.00 2.02 2.08 0.00 3.12 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 162 I 8.25 4.33 1.73 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.73 0.00 0.00 163 L 8.69 4.74 0.00 1.57 1.60 0.93 1.07 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 0.00 164 S 8.63 4.31 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.70 4.48 0.00 2.71 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 0.00 166 S 8.01 4.40 0.00 4.05 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 0.00 167 S 8.06 4.09 0.00 4.07 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 0.00 168 C 8.33 4.30 0.00 3.20 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 0.00 169 K 8.55 3.97 0.00 1.94 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.64 7.81 170 S 8.08 4.24 0.00 3.94 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 7.90 4.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.79 4.88 0.00 3.15 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.58 0.00 2.08 2.05 0.00 3.82 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 174 G 9.19 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 0.00 175 Q 8.09 4.52 0.00 2.43 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 176 I 7.87 4.41 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.97 1.01 0.00 0.00 177 T 8.23 4.55 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 1.24 0.00 0.00 178 S 8.50 4.28 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.93 4.92 0.00 2.96 3.10 0.00 0.00 6.58 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 7.91 5.58 0.00 1.86 2.11 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 2.65 2.61 0.00 181 F 8.80 5.12 0.00 3.08 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 0.00 182 C 9.00 5.44 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.44 5.01 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 0.00 184 G 7.50 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 0.00 0.00 0.00 184A Y 8.52 4.64 0.00 3.08 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 0.00 185 L 8.67 4.21 0.00 1.74 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.22 4.14 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 187 G 7.65 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 0.00 0.00 0.00 188 G 9.79 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 188A K 7.40 4.77 0.00 1.38 1.69 0.00 1.46 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.22 7.81 189 D 8.91 4.76 0.00 2.85 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.75 4.84 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 0.00 191 C 9.39 4.72 0.00 2.95 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.76 4.25 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.15 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 193 G 9.35 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 0.00 0.00 0.00 0.00 194 D 8.56 4.71 0.00 2.95 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 8.07 4.40 0.00 3.98 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 0.00 196 G 9.46 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 0.00 197 G 7.80 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 0.00 0.00 0.00 0.00 198 P 0.00 5.12 0.00 2.34 2.38 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 199 V 8.63 4.62 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 0.94 0.00 0.00 0.62 0.00 0.00 200 V 8.77 4.79 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 0.74 0.00 0.00 0.66 0.00 0.00 201 C 8.93 5.07 0.00 2.78 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 0.00 202 S 9.70 3.56 0.00 3.94 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 0.00 203 G 8.29 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 7.68 4.72 0.00 1.70 1.64 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.40 7.81 *209 L 8.26 4.37 0.00 1.51 1.63 1.01 0.74 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 8.98 4.59 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 211 G 8.02 5.31 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 0.00 212 I 8.19 5.28 1.91 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 1.29 0.73 0.95 0.00 0.00 213 V 9.03 3.57 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.22 0.00 0.00 214 S 8.49 4.99 0.00 3.89 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 0.00 215 W 7.84 5.04 0.00 3.34 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.18 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 0.00 217 S 8.57 4.67 0.00 4.21 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 *219 G 7.99 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 0.00 0.00 0.00 0.00 220 C 8.07 5.01 0.00 2.96 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 9.16 4.36 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 7.54 4.50 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 222 K 8.39 4.19 0.00 1.77 1.60 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.03 7.81 223 N 9.37 4.30 0.00 2.77 2.86 0.00 0.00 6.60 7.49 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 0.00 224 K 7.49 4.36 0.00 1.72 1.55 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.21 7.81 225 P 0.00 4.71 0.00 2.13 2.14 0.00 3.58 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 226 G 8.43 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 0.00 227 V 7.72 4.40 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 0.29 0.00 0.00 -0.74 0.00 0.00 228 Y 8.07 4.94 0.00 1.43 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 0.00 0.00 0.00 229 T 8.47 4.29 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 0.00 230 K 9.32 4.97 0.00 2.12 1.93 0.00 1.81 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.66 7.81 231 V 9.06 3.95 2.34 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 1.09 0.00 0.00 1.11 0.00 0.00 232 C 8.29 4.65 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.06 4.25 0.00 2.46 2.42 0.00 0.00 6.81 7.49 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 0.00 234 Y 8.10 4.76 0.00 3.18 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 0.00 235 V 7.96 3.71 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.03 0.00 0.00 236 S 8.12 4.14 0.00 3.96 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.30 4.18 0.00 3.51 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.43 3.28 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 1.53 1.07 0.77 0.00 0.00 239 K 8.06 3.80 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.36 7.81 240 Q 7.79 4.11 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 241 T 7.51 3.69 3.31 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 0.76 0.00 0.00 242 I 7.37 2.66 1.37 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.01 0.35 0.00 0.00 243 A 7.69 4.07 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 0.00 244 S 7.31 4.66 0.00 3.96 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.86 4.68 0.00 3.08 3.03 0.00 0.00 6.74 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.