NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.1909 8.3033 118.7978 55.1463 31.4122 176.4515 10 N 3.9661 8.3844 114.9771 53.3947 36.1733 172.7659 11 A 4.1360 7.7204 123.1801 51.5322 19.9566 177.8214 12 A 4.1745 8.3284 123.8686 51.2629 19.1361 176.2211 13 P 4.3994 0.0000 0.0000 62.0639 32.1576 176.2840 14 A 4.1488 8.3324 123.1398 52.6618 18.8675 177.2868 15 Q 4.5154 8.2873 120.0639 53.9154 32.9422 174.8558 16 A 4.2205 8.4644 124.6970 51.1737 19.4101 176.0302 17 P 4.3577 0.0000 0.0000 62.8400 33.0891 178.1694 18 V 3.6494 8.4984 121.8810 65.1961 31.1745 178.5185 19 S 4.2020 8.1444 113.0985 61.4224 62.2545 175.8300 20 D 4.5357 8.0471 121.0405 57.3090 40.6429 178.8264 21 R 3.9427 8.1885 118.4263 59.1540 30.1360 178.9155 22 A 3.8992 8.3841 120.9007 55.1284 18.3465 179.8377 23 W 4.3443 8.2974 117.1632 59.6161 28.9673 178.6870 24 A 4.1050 8.3801 121.0617 55.0242 17.8419 179.2408 25 L 3.8875 8.0792 118.8454 58.3047 42.1762 178.7644 26 F 4.1173 8.2464 120.3544 61.7080 39.3401 177.3708 27 R 3.8869 8.7520 117.6640 59.0103 29.6140 178.9034 28 A 3.9841 8.1178 120.1645 55.1823 18.7591 179.4458 29 L 4.0234 7.6315 116.9683 57.9140 41.7852 179.2048 30 D 4.2266 8.2628 118.4868 56.9982 40.8464 178.2651 31 G 3.7365 8.3106 105.3449 46.3864 0.0000 174.6528 32 K 4.4962 7.5135 118.8385 55.4379 32.4921 176.7793 33 G 3.8728 7.6631 107.0370 46.3089 0.0000 174.8319 34 L 4.1727 7.7736 118.0752 54.6625 42.2181 176.6012 35 V 4.1136 7.2892 118.5637 59.9019 33.0148 173.3140 36 P 4.4062 0.0000 0.0000 62.3655 31.8872 175.6474 37 D 4.5686 8.7372 120.3786 56.3657 41.1927 177.2050 38 G 4.1740 9.1641 110.1553 46.5546 0.0000 174.7153 39 Y 3.9986 8.1482 121.2255 60.8851 38.7618 178.7044 40 V 3.8656 8.1410 112.8040 64.3158 31.6733 178.3705 41 E 4.0640 8.3065 118.2907 59.2445 29.3820 179.3931 42 G 3.3674 8.2452 105.9650 47.5038 0.0000 175.7893 43 W 3.4973 7.6254 121.3672 58.9110 28.9382 178.3059 44 K 3.9334 8.2352 119.9092 59.4892 31.5317 178.5384 45 K 3.7977 7.8669 119.5429 59.7927 32.1305 178.6991 46 T 3.6254 7.4474 115.7500 66.6839 68.0689 176.5482 47 F 4.3206 7.7507 118.3690 60.6682 38.9631 177.2215 48 E 4.2124 8.2435 117.1419 58.2350 29.4930 177.9249 49 E 4.5037 8.1802 116.7237 56.9166 31.6010 177.0275 50 D 4.4805 7.6778 116.9983 56.3669 41.6914 176.9347 51 F 4.8107 7.7914 118.7701 57.7669 39.1545 174.9907 52 S 4.6203 8.4748 119.9808 55.1809 65.6031 173.3767 53 P 4.5966 0.0000 0.0000 65.2609 31.0591 178.7395 54 R 3.8585 7.9063 118.6293 59.2503 29.8663 179.0883 55 R 3.8030 7.8514 117.9599 59.0787 30.0430 179.0774 56 G 3.6126 7.9279 105.3142 47.7904 0.0000 175.3534 57 A 3.8678 8.1458 123.3557 54.8353 18.4028 179.2372 58 E 3.8023 8.1095 117.6678 59.4675 29.6105 179.0809 59 L 3.7061 7.7128 118.8882 57.5837 41.5672 179.7188 60 V 3.1765 7.6657 117.8697 65.8069 31.1933 177.9037 61 A 3.9738 7.4966 119.1360 55.0318 18.5775 179.3014 62 R 3.9274 8.0112 116.8972 59.5706 30.1412 178.4389 63 A 4.3083 8.2970 120.7599 55.3897 18.1402 179.7131 64 W 4.6469 8.5731 116.7834 59.0771 29.1922 177.1663 65 T 4.5344 7.7970 105.9941 61.3604 69.2929 174.6314 66 D 4.6689 7.9111 120.1783 51.1024 42.6945 173.0246 67 P 4.2905 0.0000 0.0000 65.3886 31.4722 177.7904 68 E 3.9521 8.2744 117.4807 59.3648 29.7407 178.5355 69 F 4.1096 8.7868 120.7621 61.1157 39.4356 176.9750 70 R 3.9214 8.4693 118.7326 59.4965 29.7653 178.3089 71 Q 3.9298 8.1654 119.3126 58.9693 29.0703 177.9274 72 L 3.8255 7.7853 121.3806 57.9852 41.6420 178.5336 73 L 3.6455 7.8145 120.5358 58.1875 41.7569 178.7664 74 L 4.1827 7.7756 116.8712 56.4817 41.7076 178.2435 75 T 4.5134 7.2499 108.8313 61.8611 71.6146 174.3990 76 D 4.5608 8.4375 121.0439 50.6485 41.7301 175.1034 77 G 3.7452 8.0711 111.7441 46.5331 0.0000 172.0896 78 T 3.7389 7.6282 117.2472 66.4356 68.3661 176.1239 79 A 3.9378 8.1406 122.0653 55.0452 18.1636 179.4092 80 A 3.8890 7.5084 117.8534 55.4857 18.8360 179.7263 81 V 3.7856 8.1171 116.7477 66.1538 31.5935 178.0304 82 A 4.0739 8.2988 120.5593 55.2339 17.9273 179.5559 83 Q 3.9476 7.8523 115.7665 58.9635 28.8553 177.8186 84 Y 3.8546 7.9163 115.2992 57.2046 38.1719 175.9775 85 G 3.8490 7.7388 107.8249 46.9729 0.0000 173.8000 86 Y 4.9972 7.9202 114.1506 57.3440 38.3289 176.2202 87 L 4.3384 8.0290 120.2586 54.9881 42.5623 176.6412 88 G 4.0873 8.1718 107.9415 44.8812 0.0000 170.7540 89 P 4.4897 0.0000 0.0000 64.4171 31.8306 176.2780 90 Q 3.1795 8.6922 119.8249 56.3376 26.7257 174.6433 91 G 4.0503 7.6614 101.3092 44.7196 0.0000 175.3895 92 E 4.2885 8.1694 117.8628 56.3902 31.7077 175.8304 93 Y 4.4564 7.7467 119.1196 55.8321 40.9056 173.9036 94 I 4.8421 8.1869 128.3303 59.3633 40.0799 175.1008 95 V 4.5771 8.2077 125.9824 60.9558 34.1113 173.9545 96 A 5.0186 8.5960 129.7447 50.9565 20.4231 176.3560 97 V 4.3157 8.6602 115.6299 59.3810 34.6509 174.4500 98 E 4.7401 8.7389 126.6186 54.9742 29.9122 175.5185 99 D 5.0250 8.9175 127.8764 54.8409 42.4830 175.5168 100 T 4.7063 8.8586 111.1135 59.2977 72.5316 172.9688 101 P 4.3406 0.0000 0.0000 65.0146 31.5737 177.5367 102 T 4.5809 7.9065 106.4766 60.7142 69.2704 172.8159 103 L 5.1097 8.0940 124.7197 54.0050 45.8983 174.2039 104 K 4.9550 9.5149 128.1125 54.8095 34.2393 174.3918 105 N 5.5249 9.6364 125.4236 52.2333 41.0289 174.3608 106 V 4.8271 8.8845 121.1161 61.5302 35.5580 173.6889 107 I 5.2723 8.8261 127.7867 59.8053 39.6590 175.1874 108 V 4.4956 8.8717 124.1913 60.6815 34.9383 173.4484 109 C 5.2331 7.8408 118.6276 57.2880 32.2501 174.4118 110 S 4.3480 9.5837 121.9533 60.6372 62.8956 176.1867 111 L 4.0930 7.2247 120.7405 56.2235 41.9053 177.1771 *113 S 4.2778 7.7631 111.9570 58.2625 63.9809 173.2773 *115 T 4.0712 8.2544 119.4238 63.2775 69.7832 175.0193 116 A 4.9173 7.9972 127.3048 50.5305 16.4762 177.7062 117 W 4.6562 8.2363 123.5898 59.0126 29.7187 177.4751 118 P 3.9478 0.0000 0.0000 64.2843 31.1315 177.7823 119 I 4.2180 7.6507 109.6655 60.4904 39.0936 176.6044 120 L 4.3506 8.0387 119.3937 53.8265 42.9926 177.7795 121 G 4.1288 8.1134 102.6028 44.8804 0.0000 173.3087 122 L 3.6514 8.0457 119.0305 53.6178 42.0778 175.9570 123 P 3.9856 0.0000 0.0000 62.0764 32.0499 174.4747 124 P 4.3963 0.0000 0.0000 62.3041 32.5146 177.0812 125 T 3.8346 8.6536 116.5977 66.9339 68.3974 176.6034 126 W 4.2937 8.0848 117.7654 59.7901 27.9133 177.5757 127 Y 3.1954 6.4426 119.1703 59.6231 38.1684 177.1570 128 K 4.3247 7.5412 116.8612 55.8679 33.0600 177.3710 129 S 4.2854 7.3342 115.0654 57.7625 63.8936 175.4634 130 F 4.5737 8.4564 120.8879 60.7627 38.5942 177.8087 131 E 4.0501 8.3355 117.9565 59.6751 29.3764 178.6438 132 Y 4.1802 8.1480 119.3091 60.9132 38.7444 177.9840 133 R 3.7970 8.1061 117.5480 59.0689 30.1928 178.5874 134 A 4.1402 8.1781 119.9814 54.7603 18.9607 179.2777 135 R 4.1706 7.9501 116.3408 58.6386 30.4183 179.4981 136 V 3.6943 7.2899 118.0412 64.6497 31.2673 177.8083 137 V 3.5951 7.5379 118.2622 65.0826 31.7624 176.4308 138 R 4.2535 7.8655 118.5123 57.3676 31.4672 176.0074 139 E 4.7593 8.4817 114.8970 53.4500 29.4236 174.4725 140 P 4.2667 0.0000 0.0000 66.4502 31.7859 178.5492 141 R 3.8469 7.8892 118.0078 59.1722 30.0578 178.2386 142 K 3.9111 7.9803 118.9445 59.3690 32.2168 178.6818 143 V 3.5949 7.8927 118.4335 66.1219 31.5027 177.9321 144 L 3.9864 8.2781 119.0700 57.7957 41.4502 179.4086 145 S 4.2574 8.1694 114.4066 61.0265 62.1262 176.1744 146 E 3.9926 8.2104 119.9672 59.5462 29.2919 178.6448 147 M 4.2320 7.9077 116.4959 55.8549 32.1448 177.1042 148 G 4.0018 8.0687 108.0235 45.2933 0.0000 173.4950 149 T 4.3789 8.5251 116.9906 61.3290 70.3089 172.7853 150 E 4.4059 8.7566 128.1945 54.8700 30.2648 175.1798 151 I 4.3050 8.1432 127.2071 59.0672 38.9528 175.5934 152 A 4.2195 8.3870 128.3814 51.9731 18.9476 178.1071 153 S 4.1613 8.6379 116.0207 61.7335 62.9342 175.6630 154 D 4.5963 8.0531 116.4374 53.8763 39.4523 175.4279 155 I 4.4869 7.2842 121.2803 59.4078 39.3353 175.1005 156 E 4.1158 8.9763 129.1367 56.2903 30.6877 175.2845 157 I 4.8548 8.3254 127.5940 59.8620 39.1565 174.8404 158 R 4.4641 9.0129 127.4478 54.4651 32.6059 174.1304 159 V 4.7240 8.2742 126.4459 61.5527 33.3600 174.2518 160 Y 4.1388 9.2903 126.7356 56.7711 39.2075 174.1433 161 D 5.0357 8.5644 125.2124 53.4333 42.1896 176.9641 162 T 4.7157 9.2424 125.2623 63.2491 66.4810 174.5398 163 T 4.5028 8.4726 113.3830 61.3894 71.3511 175.4323 164 A 4.6234 7.3469 126.6715 52.1354 18.7468 177.8732 165 E 4.3449 8.7049 116.9547 59.0660 30.4126 176.4192 166 T 4.1977 7.6880 115.7929 63.8497 69.3432 173.7781 167 R 4.4366 8.6342 124.1823 54.6145 33.2081 174.2694 168 Y 5.8587 8.8877 121.3920 55.9471 40.3631 175.0009 169 M 4.8966 8.3097 118.2122 53.5340 35.1414 174.0970 170 V 4.2731 8.5749 121.7685 62.3156 33.0055 175.4660 171 L 4.4231 8.9603 131.1028 53.1499 42.2898 174.0773 172 P 5.2045 0.0000 0.0000 61.3173 32.6013 176.3265 173 Q 4.2506 8.6255 120.2294 55.9318 29.4538 176.5702 174 R 2.5100 8.0575 123.9131 54.5137 30.0910 174.5095 175 P 4.1648 0.0000 0.0000 61.9773 32.1300 175.8244 176 A 3.9489 8.0384 123.5085 53.7116 18.7349 178.0122 177 G 3.8332 8.8180 108.7843 45.5117 0.0000 174.2305 178 T 2.4800 6.6732 108.2404 60.2049 68.8806 173.8421 179 E 4.0532 7.6605 121.9774 58.2758 29.6529 177.6012 180 G 4.0740 8.9526 111.4749 45.1266 0.0000 173.7630 181 W 4.5912 8.0309 119.7875 56.7766 29.7958 176.7626 182 S 4.5385 9.2576 117.2939 58.0265 64.6230 175.4981 183 Q 4.1051 8.6648 121.2266 59.2760 28.2693 178.9117 184 E 3.9676 8.1741 119.7499 59.3900 29.5347 178.7538 185 Q 3.9196 7.9315 117.2114 58.8649 29.0775 178.4290 186 L 4.6815 8.4779 120.1552 58.0776 41.7920 179.3212 187 Q 4.0202 8.5736 118.4342 59.1946 28.4480 178.7647 188 E 4.0374 7.9434 119.4025 58.6149 29.7161 177.9341 189 I 4.5575 7.6627 110.0033 60.0716 38.4440 175.7754 190 V 3.9940 7.4794 121.7579 62.2667 31.0157 175.7564 191 T 4.5013 8.0154 118.4641 59.6835 72.1767 174.9473 192 K 3.8146 8.5487 121.1265 60.2369 31.9779 178.1528 193 D 4.6110 8.1643 118.1149 57.4000 40.5289 178.4218 194 C 4.8510 7.4503 117.3216 62.3904 28.3506 175.7529 195 L 4.1530 7.9297 120.3005 57.7651 41.1248 179.5827 196 I 3.9215 7.9215 120.0499 63.1605 36.9311 177.4736 197 G 4.3817 7.9917 104.6370 46.1652 0.0000 174.8717 198 V 3.9089 7.9635 112.0441 62.4841 32.4676 175.7753 199 A 4.9068 7.7033 121.1687 49.0390 22.0042 174.4337 200 I 4.7577 8.0073 120.0582 58.4961 39.3247 174.4279 201 P 4.4962 0.0000 0.0000 63.2312 31.7565 175.5467 202 Q 4.6304 8.6167 121.0159 54.0504 30.8269 175.0340 203 V 4.3728 8.1095 122.0353 60.3995 32.9260 173.9059 204 P 4.4929 0.0000 0.0000 62.6933 31.9683 176.4524 205 T 4.0850 8.4055 116.0698 64.1177 68.3152 174.4947 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 9 E 8.30 4.19 0.00 2.17 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 0.00 2.26 2.43 0.00 10 N 8.38 3.97 0.00 2.99 2.99 0.00 0.00 6.99 6.46 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 11 A 7.72 4.14 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 12 A 8.33 4.17 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 13 P 0.00 4.40 0.00 2.20 2.08 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 14 A 8.33 4.15 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 15 Q 8.29 4.52 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 16 A 8.46 4.22 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 17 P 0.00 4.36 0.00 2.33 2.03 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 18 V 8.50 3.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.92 0.00 0.00 19 S 8.14 4.20 0.00 4.02 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 20 D 8.05 4.54 0.00 2.97 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.19 3.94 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 22 A 8.38 3.90 1.09 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 23 W 8.30 4.34 0.00 3.63 3.33 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 24 A 8.38 4.11 1.49 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 25 L 8.08 3.89 0.00 1.79 1.91 0.93 0.77 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 26 F 8.25 4.12 0.00 3.16 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 27 R 8.75 3.89 0.00 1.99 2.03 0.00 3.28 0.00 0.00 3.30 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.19 0.00 28 A 8.12 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.63 4.02 0.00 1.69 1.63 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.26 4.23 0.00 1.60 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 0.00 0.00 0.00 0.00 31 G 8.31 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 0.00 0.00 0.00 32 K 7.51 4.50 0.00 1.84 1.80 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.16 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.55 7.81 33 G 7.66 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 34 L 7.77 4.17 0.00 1.69 1.66 0.88 0.84 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 35 V 7.29 4.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.86 0.00 0.00 36 P 0.00 4.41 0.00 2.38 2.02 0.00 3.18 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 1.92 2.02 0.00 37 D 8.74 4.57 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.16 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 39 Y 8.15 4.00 0.00 3.40 3.16 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 40 V 8.14 3.87 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 0.92 0.00 0.00 41 E 8.31 4.06 0.00 2.21 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 0.00 2.42 2.46 0.00 42 G 8.25 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 W 7.63 3.50 0.00 3.25 2.46 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 44 K 8.24 3.93 0.00 1.92 1.99 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.51 7.81 45 K 7.87 3.80 0.00 1.86 1.80 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.49 7.81 46 T 7.45 3.63 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 47 F 7.75 4.32 0.00 3.03 2.82 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 48 E 8.24 4.21 0.00 1.99 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 2.33 2.46 0.00 49 E 8.18 4.50 0.00 1.94 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 2.19 2.25 0.00 50 D 7.68 4.48 0.00 2.55 2.70 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 51 F 7.79 4.81 0.00 3.07 3.15 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 52 S 8.47 4.62 0.00 3.74 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 53 P 0.00 4.60 0.00 2.28 2.39 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 54 R 7.91 3.86 0.00 1.81 2.00 0.00 3.27 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 55 R 7.85 3.80 0.00 1.74 1.38 0.00 3.01 0.00 0.00 2.54 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 56 G 7.93 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 0.00 0.00 0.00 57 A 8.15 3.87 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.11 3.80 0.00 2.20 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 0.00 2.21 2.40 0.00 59 L 7.71 3.71 0.00 1.83 1.71 0.95 0.49 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 60 V 7.67 3.18 1.71 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 -0.45 0.00 0.00 0.75 0.00 0.00 61 A 7.50 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.01 3.93 0.00 1.83 1.87 0.00 3.06 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 63 A 8.30 4.31 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 0.00 0.00 0.00 0.00 0.00 64 W 8.57 4.65 0.00 3.59 3.15 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 65 T 7.80 4.53 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 1.40 0.00 0.00 66 D 7.91 4.67 0.00 2.82 2.82 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 67 P 0.00 4.29 0.00 2.24 2.15 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 68 E 8.27 3.95 0.00 2.08 2.20 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 2.44 2.40 0.00 69 F 8.79 4.11 0.00 3.26 3.24 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 70 R 8.47 3.92 0.00 2.33 2.09 0.00 3.23 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 71 Q 8.17 3.93 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 72 L 7.79 3.83 0.00 1.70 1.46 0.85 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.81 3.65 0.00 1.26 1.62 0.81 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.78 4.18 0.00 1.65 1.69 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.25 4.51 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 76 D 8.44 4.56 0.00 2.51 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.07 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 0.00 0.00 0.00 78 T 7.63 3.74 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 79 A 8.14 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.51 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.12 3.79 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 1.13 0.00 0.00 1.01 0.00 0.00 82 A 8.30 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.85 3.95 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.74 0.00 84 Y 7.92 3.85 0.00 2.60 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.74 3.85 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 0.00 0.00 0.00 86 Y 7.92 5.00 0.00 3.00 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 87 L 8.03 4.34 0.00 1.69 1.64 0.94 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4.18 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 *115 T 8.25 4.07 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 116 A 8.00 4.92 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 0.00 117 W 8.24 4.66 0.00 3.11 2.70 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 0.00 118 P 0.00 3.95 0.00 2.28 2.02 0.00 3.38 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 1.67 0.00 119 I 7.65 4.22 1.84 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 1.38 0.72 0.95 0.00 0.00 120 L 8.04 4.35 0.00 1.80 1.65 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.11 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 0.00 122 L 8.05 3.65 0.00 1.34 1.17 -1.21 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 3.99 0.00 2.10 1.75 0.00 3.55 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.25 0.00 124 P 0.00 4.40 0.00 1.97 2.12 0.00 3.03 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.63 0.00 125 T 8.65 3.83 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 1.20 0.00 0.00 126 W 8.08 4.29 0.00 3.53 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 0.00 127 Y 6.44 3.20 0.00 1.43 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.54 4.32 0.00 1.84 1.85 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.56 1.62 7.81 129 S 7.33 4.29 0.00 4.28 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 0.00 130 F 8.46 4.57 0.00 3.09 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 0.00 131 E 8.34 4.05 0.00 2.19 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 0.00 2.47 2.52 0.00 132 Y 8.15 4.18 0.00 3.40 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 0.00 133 R 8.11 3.80 0.00 2.00 2.13 0.00 3.28 0.00 0.00 3.52 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 134 A 8.18 4.14 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 R 7.95 4.17 0.00 2.01 1.97 0.00 3.16 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 136 V 7.29 3.69 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.91 0.00 0.00 137 V 7.54 3.60 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.82 0.00 0.00 138 R 7.87 4.25 0.00 1.76 1.88 0.00 3.20 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 139 E 8.48 4.76 0.00 2.07 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 2.24 2.21 0.00 140 P 0.00 4.27 0.00 2.30 2.49 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 141 R 7.89 3.85 0.00 1.90 1.96 0.00 3.18 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 142 K 7.98 3.91 0.00 1.86 1.92 0.00 1.78 0.00 0.00 2.02 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.61 1.50 7.81 143 V 7.89 3.59 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 1.16 0.00 0.00 0.98 0.00 0.00 144 L 8.28 3.99 0.00 1.91 1.93 1.09 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.17 4.26 0.00 3.92 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 0.00 146 E 8.21 3.99 0.00 2.13 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 0.00 2.35 2.53 0.00 147 M 7.91 4.23 0.00 1.77 2.13 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.32 0.00 148 G 8.07 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 0.00 149 T 8.53 4.38 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 150 E 8.76 4.41 0.00 1.90 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 151 I 8.14 4.31 1.89 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 1.37 1.05 0.93 0.00 0.00 152 A 8.39 4.22 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 0.00 153 S 8.64 4.16 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 0.00 154 D 8.05 4.60 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 7.28 4.49 1.99 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 1.30 0.66 0.92 0.00 0.00 156 E 8.98 4.12 0.00 2.07 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 0.00 2.30 2.28 0.00 157 I 8.33 4.85 1.87 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 1.25 0.73 0.93 0.00 0.00 158 R 9.01 4.46 0.00 1.80 1.78 0.00 3.11 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.21 0.00 159 V 8.27 4.72 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.92 0.00 0.00 160 Y 9.29 4.14 0.00 2.57 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 0.00 0.00 0.00 0.00 161 D 8.56 5.04 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 T 9.24 4.72 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 1.33 0.00 0.00 163 T 8.47 4.50 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 164 A 7.35 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 E 8.70 4.34 0.00 1.81 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 166 T 7.69 4.20 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 0.53 0.00 0.00 167 R 8.63 4.44 0.00 1.68 1.67 0.00 3.23 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 168 Y 8.89 5.86 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 M 8.31 4.90 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 170 V 8.57 4.27 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 0.78 0.00 0.00 1.08 0.00 0.00 171 L 8.96 4.42 0.00 1.75 1.71 0.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 172 P 0.00 5.20 0.00 2.30 2.12 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 173 Q 8.63 4.25 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 174 R 8.06 2.51 0.00 0.67 1.12 0.00 2.63 0.00 0.00 2.83 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 175 P 0.00 4.16 0.00 2.04 2.03 0.00 2.95 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 1.76 2.00 0.00 176 A 8.04 3.95 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 0.00 177 G 8.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 T 6.67 2.48 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 0.04 0.00 0.00 179 E 7.66 4.05 0.00 1.91 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 2.25 2.27 0.00 180 G 8.95 4.07 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 0.00 0.00 0.00 181 W 8.03 4.59 0.00 3.38 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 0.00 182 S 9.26 4.54 0.00 4.06 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 0.00 183 Q 8.66 4.11 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 184 E 8.17 3.97 0.00 2.05 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 2.36 2.41 0.00 185 Q 7.93 3.92 0.00 2.28 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 1.94 2.20 0.00 186 L 8.48 4.68 0.00 2.12 2.23 1.26 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 8.57 4.02 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 188 E 7.94 4.04 0.00 2.11 2.20 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 2.37 2.34 0.00 189 I 7.66 4.56 2.19 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.10 1.32 0.00 0.00 190 V 7.48 3.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.74 0.00 0.00 191 T 8.02 4.50 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 1.26 0.00 0.00 192 K 8.55 3.81 0.00 1.86 1.93 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.71 7.81 193 D 8.16 4.61 0.00 2.82 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 0.00 194 C 7.45 4.85 0.00 3.19 3.05 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 0.00 195 L 7.93 4.15 0.00 1.90 1.70 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 196 I 7.92 3.92 2.09 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.70 1.28 0.00 0.00 197 G 7.99 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 V 7.96 3.91 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 1.02 0.00 0.00 1.01 0.00 0.00 199 A 7.70 4.91 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 0.00 200 I 8.01 4.76 1.90 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 1.46 0.73 0.94 0.00 0.00 201 P 0.00 4.50 0.00 2.21 2.40 0.00 3.77 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 2.47 2.35 0.00 202 Q 8.62 4.63 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 203 V 8.11 4.37 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 0.84 0.00 0.00 0.76 0.00 0.00 204 P 0.00 4.49 0.00 2.17 2.03 0.00 4.06 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 205 T 8.41 4.08 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.