NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4424 8.1633 120.3487 55.6742 34.6001 177.4171 2 S 3.9328 8.1270 114.7206 61.2368 62.9498 175.0869 3 A 4.0388 8.7289 124.2810 55.1188 18.5657 179.2884 4 Q 3.9232 8.0324 115.9711 59.0811 28.9048 178.5956 5 A 3.9672 8.4830 122.0401 54.8516 18.3384 179.3819 6 A 3.9050 8.0505 119.3034 55.3735 18.4113 179.8940 7 K 3.8555 7.8733 116.4710 59.6980 32.1051 179.6529 8 V 3.5744 7.9198 118.3697 66.1294 31.4288 178.2313 9 S 4.0967 8.5192 115.1292 61.4982 62.8590 176.7163 10 K 3.9110 8.1257 121.1289 59.3590 31.6188 179.0455 11 K 3.9348 7.9786 118.5057 59.8871 32.1788 178.2302 12 E 4.2007 8.1916 117.1463 58.2713 29.6592 178.1208 13 L 3.9478 8.4272 118.4724 56.5488 41.1715 178.0872 14 N 3.5656 8.8882 117.6865 57.7417 40.1475 174.9207 15 S 4.0449 7.6176 124.0318 59.0520 61.0727 174.2823 *21 D 4.5472 7.7071 125.9092 53.9596 42.9533 176.8046 22 E 4.1462 8.2348 118.3031 58.5201 30.1039 177.6746 23 T 4.3608 7.5754 115.0463 65.7967 70.1834 176.4469 24 S 4.0468 7.7127 113.9620 61.3298 62.6662 175.6792 25 E 3.8771 8.1895 121.9678 59.3237 29.4251 178.4417 26 K 3.7910 8.1099 119.0282 59.5736 32.0214 177.9688 27 E 3.8780 8.1683 119.2821 59.2974 29.6337 178.2818 28 Q 3.9476 8.0943 119.5165 59.7092 28.9552 178.7973 29 Q 4.0280 8.3068 118.7769 58.6930 28.6629 178.7088 30 E 3.8607 8.3556 119.6938 59.2133 29.5948 178.8804 31 A 4.0276 8.1698 121.0380 55.3472 18.3972 179.8013 32 I 3.6710 7.8553 118.1907 64.4876 37.1918 178.3123 33 E 3.9546 7.8776 120.2672 59.6103 29.5519 178.6235 34 H 4.3998 8.2847 116.3315 58.7405 28.7661 177.8502 35 I 3.7608 8.2892 122.3181 64.2918 36.8898 177.8772 36 D 4.3610 8.2087 118.9415 57.2717 41.1293 178.0600 37 E 3.9343 8.0211 118.6223 59.5084 29.5470 179.5364 38 V 3.6358 7.6313 117.5260 66.2256 31.5852 177.7546 39 Q 4.0239 8.5800 118.0740 59.4397 28.5953 179.0727 40 N 4.3745 8.2331 117.1699 56.2104 38.5515 177.4228 41 E 3.9405 7.7276 119.1949 59.4232 29.5789 179.0570 42 I 3.6964 7.7715 119.8190 64.7789 37.1165 178.2412 43 D 4.3390 8.7763 119.7740 57.2770 40.5983 178.7476 44 R 3.8812 7.9572 119.1565 59.4246 29.9970 178.6216 45 L 3.9935 7.9067 118.6398 57.8922 41.6256 179.1820 46 N 4.3343 8.5000 116.7766 56.3949 38.4651 177.3875 47 E 4.0039 8.5334 120.2735 59.3208 29.5217 179.2805 48 Q 3.9834 8.3063 117.9903 58.8816 28.7288 178.6153 49 A 3.9919 8.1450 121.7688 55.3867 18.3263 179.6292 50 S 4.0618 7.9990 113.4389 61.8859 62.9534 176.5299 51 E 3.9240 8.2160 121.6226 59.5523 29.3635 178.7557 52 E 3.9947 8.3051 118.4891 59.4740 29.4164 179.5227 53 I 3.7741 8.1505 120.1783 64.3583 37.1987 178.3536 54 L 4.0139 8.2046 120.0813 57.8367 41.4296 179.8776 55 K 4.0041 8.3106 118.4279 59.3129 31.9917 179.4782 56 V 3.7131 7.8816 118.5560 66.1583 31.4580 177.7324 57 E 4.0244 8.5923 119.3293 59.2713 29.5699 178.5031 58 Q 3.9636 8.2971 119.7078 58.9562 29.2041 178.1322 59 K 3.8392 8.0953 120.5822 59.8936 32.2982 178.3713 60 Y 4.1892 8.0697 116.2494 60.2974 37.7810 177.8932 61 N 4.4213 8.2746 118.2507 56.2644 38.4515 177.5030 62 K 4.0563 7.7509 118.3291 59.3897 32.1821 179.1556 63 L 4.2326 7.7130 118.3659 57.9143 41.9225 179.4690 64 R 4.4957 8.5025 118.2093 58.9962 29.9856 178.4298 65 Q 4.0863 8.2334 119.6695 59.2603 28.9512 177.2495 66 P 4.3774 0.0000 0.0000 65.5800 31.2078 178.6860 67 F 4.2800 8.0306 116.2632 60.5372 38.9040 177.6112 68 F 3.9534 8.6036 117.3678 60.3927 38.7724 177.4952 69 Q 4.0917 8.6081 118.1957 59.1529 28.5971 179.1510 70 K 3.8647 8.3949 120.6546 59.5461 32.1045 178.6870 71 R 3.7284 8.3406 119.2785 59.4339 29.9286 178.6141 72 S 4.1489 8.1876 114.9121 61.8010 62.6539 176.6285 73 E 3.9725 7.8741 119.8427 59.3353 29.4748 179.1414 74 L 4.0471 8.0214 119.1341 57.6698 41.5564 179.3723 75 I 3.0441 7.7483 119.8156 64.1681 36.8009 177.9958 76 A 4.2155 7.5553 119.0790 54.0327 18.2544 178.5990 77 K 4.4540 7.8170 115.3523 55.4513 32.9815 176.2893 78 I 4.3320 7.4202 122.0929 58.4706 37.8707 173.3965 79 P 4.4552 0.0000 0.0000 63.8530 32.0727 176.3089 80 N 4.4736 9.0788 116.5061 54.2344 36.3230 175.6392 81 F 3.7901 7.8878 120.3357 61.5600 39.1686 177.4197 82 W 4.0346 8.2312 117.6753 59.4804 28.9055 178.7340 83 V 3.7833 8.0076 112.0066 64.9777 31.0922 178.4879 84 T 3.8282 7.9683 115.0618 66.9279 68.0704 176.6398 85 T 3.8195 7.6749 116.5020 66.7661 68.6768 176.3474 86 F 4.7561 8.1520 119.5878 60.8295 38.7733 178.0478 87 V 3.7373 8.3583 118.3010 65.3007 31.4166 177.0205 88 N 4.6792 8.1784 113.6704 53.1703 39.0015 174.1419 89 H 4.5061 7.9467 122.5699 53.7215 30.9399 173.7334 90 P 4.3354 0.0000 0.0000 65.6287 31.4600 178.2863 91 Q 4.2727 8.0235 115.2519 58.0101 29.6469 177.8105 92 V 3.6571 7.7849 116.9615 65.6308 31.4806 177.7422 93 S 4.1047 8.7026 113.2462 61.4204 61.9921 176.0107 94 A 4.1942 7.4643 122.0477 54.0763 18.2109 178.4828 95 L 4.5876 7.5664 115.5528 53.8365 42.3168 176.3658 96 L 4.5412 7.2693 120.4126 53.3076 42.0056 177.5018 97 G 3.9766 9.3302 111.8576 43.8704 0.0000 173.4419 98 E 4.0998 8.6884 119.1484 59.3483 29.3262 179.4872 99 E 3.9922 8.1804 118.3476 59.6050 29.6400 178.6689 100 D 4.7991 8.3116 118.2666 57.7526 40.6655 178.9802 101 E 3.9869 8.0012 118.1400 59.5026 29.2928 178.7982 102 E 4.3724 8.1686 118.0181 59.4451 29.4451 179.3940 103 A 4.3662 8.1679 120.8135 55.4878 18.5167 179.2734 104 M 4.5928 8.7121 116.4254 57.7956 31.7602 178.2061 105 H 4.5776 8.0304 115.5818 58.0879 29.1226 176.0414 106 Y 4.8511 8.5788 117.5338 56.9893 38.0064 174.7584 107 L 4.2680 7.7029 123.0534 54.8832 41.7123 176.0014 108 T 4.5922 8.5753 117.4118 62.7448 70.3606 175.2307 109 R 4.7721 7.8263 121.8396 55.2558 33.6221 173.4067 110 V 4.5851 8.3214 125.8888 60.9412 33.9644 174.1868 111 E 4.4156 8.8067 126.6191 54.3795 32.5929 174.8054 112 V 4.2506 5.6523 124.1374 61.1899 33.2339 174.8360 113 T 4.3660 8.4280 123.9384 61.6770 71.8570 172.5774 114 E 4.4733 8.4115 125.4908 54.4690 31.4896 175.9758 115 F 4.8231 8.4801 121.5510 58.1811 39.8564 178.0251 116 E 3.9107 7.6030 121.9509 59.2651 29.6758 176.9012 117 D 4.2828 8.3494 116.7188 56.3563 41.2369 177.4660 118 I 3.2300 8.6432 120.6953 62.8684 34.0980 172.1056 119 K 4.7203 7.0388 116.5498 57.2339 31.9519 176.4631 120 S 4.7209 8.4012 119.1235 58.0108 65.9210 175.6614 121 G 3.8627 8.4556 111.7603 46.6256 0.0000 174.3149 122 Y 5.0237 8.6175 123.3486 56.0232 41.9974 172.8861 123 R 4.9945 9.1851 119.2734 54.8185 34.1246 173.4316 124 I 4.8399 9.2059 126.7798 59.6173 40.1763 174.0144 125 D 5.1927 8.7670 127.3216 52.4503 43.6524 175.3301 126 F 5.2082 9.6080 122.7398 56.0951 41.5473 173.9452 127 Y 5.0915 9.1479 123.0342 56.8931 39.4050 174.9535 128 F 5.5699 9.3010 123.1991 55.6351 41.8337 175.2600 129 D 4.8292 9.3661 123.3158 53.6421 41.8864 176.0698 130 E 3.8686 8.7955 118.9872 57.4210 29.6436 176.7526 131 N 4.1053 7.9001 118.5219 50.4771 40.0630 173.5469 132 P 3.8246 0.0000 0.0000 64.5834 31.8230 177.4181 133 Y 4.4884 6.7250 116.3622 59.3729 38.4645 175.2453 134 F 5.0444 6.4904 110.9605 55.2081 41.2129 173.9382 135 E 4.1691 8.6304 120.1565 58.5444 29.7054 177.9666 136 N 4.3535 8.1120 115.2929 53.9339 39.0707 175.0708 137 K 4.4409 8.7359 121.7281 58.6221 33.6413 177.0142 138 V 4.8921 7.7029 118.4493 61.0348 34.7160 174.3374 139 L 4.7099 9.5185 127.6939 53.1101 44.2867 175.7313 140 S 5.5789 9.2194 119.2821 56.7704 67.4320 173.0477 141 K 4.6502 9.0222 122.4776 54.8462 35.6295 174.7541 142 E 5.0715 8.7029 126.3239 54.5599 33.0863 174.9883 143 F 4.8529 8.7195 120.4971 56.5376 42.6516 173.6434 144 H 4.4311 9.1561 118.8526 57.4517 31.0681 175.4982 *152 S 4.5670 7.7200 112.3528 57.8103 64.7016 172.6304 153 S 5.3316 7.5524 111.3556 58.7045 65.2673 174.2884 154 K 4.5228 8.2371 122.9421 55.1341 34.4139 175.0827 155 S 4.9673 7.9783 115.3728 56.9887 66.0266 173.3686 156 T 4.0530 8.3785 122.7822 63.7062 68.9148 174.0380 157 E 4.0252 8.5831 125.9253 55.8588 29.8292 176.5281 158 I 3.5382 7.9585 125.7117 60.6739 37.7895 176.8620 159 K 4.2583 8.6070 126.7980 54.2619 30.7006 176.1829 160 W 4.9930 7.8019 121.5019 56.0184 30.1003 176.9837 161 K 4.0526 8.9432 120.6489 57.8392 32.1816 177.8314 162 S 5.1361 8.3409 119.0976 58.8462 63.4770 176.5935 163 G 3.9471 8.6710 113.0574 45.9374 0.0000 172.5148 164 K 4.1965 7.5654 116.6376 56.5983 32.5317 176.8780 165 D 3.3700 7.7968 118.4718 54.8138 42.0798 175.3551 166 M 4.1769 5.8600 125.0003 55.2547 31.8628 177.0064 *189 F 4.6790 8.6828 125.5208 59.4086 40.9037 176.3527 190 F 4.7426 8.5231 116.3680 58.9951 39.2017 177.2029 191 T 4.0079 8.1262 118.7264 66.1459 68.5271 175.9688 192 W 4.4483 7.9908 130.7574 60.2485 30.4892 176.3822 193 F 4.3516 7.7449 113.8420 57.0470 38.7349 176.8350 194 T 3.8735 8.3062 119.2315 66.3718 68.4514 175.6608 *201 A 4.8116 7.6031 123.0501 52.2782 20.8613 177.8116 202 D 4.5859 8.4036 113.9491 57.7855 41.0123 179.1166 203 E 3.9591 8.2664 117.9281 59.4704 29.5724 178.9958 204 L 3.8421 7.9820 119.6803 57.9980 42.0655 178.8937 205 G 3.7832 8.3448 106.9142 47.4360 0.0000 175.4325 206 E 3.8852 8.4170 121.7039 58.6685 29.3150 179.6503 207 V 3.5522 7.8392 118.2767 66.0655 31.5929 178.1329 208 I 3.8188 7.7872 119.3616 64.2580 36.8006 178.3149 209 K 3.7948 8.1014 119.2502 59.6513 32.0939 177.9226 210 D 4.6092 8.2298 117.2427 55.8638 41.2695 177.5849 211 D 4.7221 8.2138 117.6311 56.4833 42.0433 178.0969 212 I 4.3683 7.6687 119.2913 63.8014 37.4676 177.7261 213 W 4.7319 8.6403 128.7926 60.2907 30.5868 175.4483 214 P 4.6355 0.0000 0.0000 65.5855 30.8859 176.3690 215 N 4.7212 7.7109 114.8809 51.1954 40.2467 172.4995 216 P 4.6917 0.0000 0.0000 64.0864 31.9194 177.7074 217 L 4.1069 8.3081 121.1900 57.6387 42.2201 178.2152 218 Q 3.9363 8.1320 116.8441 58.4335 28.2745 177.2555 219 Y 4.3644 7.3462 117.2860 59.9431 38.9124 176.5144 220 Y 3.9114 7.7870 119.7795 60.5252 38.7787 177.3288 221 L 4.0541 7.5434 118.7913 56.5712 42.2970 176.8398 222 V 3.6842 7.3556 121.9559 63.2081 31.4222 175.9666 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 1 M 8.16 4.44 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.57 0.00 2 S 8.13 3.93 0.00 3.98 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 3 A 8.73 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.03 3.92 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 5 A 8.48 3.97 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 6 A 8.05 3.91 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 7 K 7.87 3.86 0.00 2.02 1.88 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.65 7.81 8 V 7.92 3.57 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 1.10 0.00 0.00 0.98 0.00 0.00 9 S 8.52 4.10 0.00 4.11 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 10 K 8.13 3.91 0.00 1.94 1.86 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.64 7.81 11 K 7.98 3.93 0.00 1.73 2.11 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.50 7.81 12 E 8.19 4.20 0.00 1.97 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 2.51 2.49 0.00 13 L 8.43 3.95 0.00 1.67 1.48 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.89 3.57 0.00 2.75 2.75 0.00 0.00 6.78 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 15 S 7.62 4.04 0.00 3.93 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 *21 D 7.71 4.55 0.00 2.77 2.57 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 0.00 0.00 0.00 0.00 22 E 8.23 4.15 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 23 T 7.58 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 24 S 7.71 4.05 0.00 3.89 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 25 E 8.19 3.88 0.00 2.13 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 2.30 2.36 0.00 26 K 8.11 3.79 0.00 1.90 1.80 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.57 7.81 27 E 8.17 3.88 0.00 2.43 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 28 Q 8.09 3.95 0.00 2.36 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 29 Q 8.31 4.03 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 30 E 8.36 3.86 0.00 2.17 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 31 A 8.17 4.03 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 32 I 7.86 3.67 2.00 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 1.40 0.93 0.90 0.00 0.00 33 E 7.88 3.95 0.00 1.96 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 0.00 2.31 2.35 0.00 34 H 8.28 4.40 0.00 3.39 3.30 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.29 3.76 2.01 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 1.42 0.64 0.92 0.00 0.00 36 D 8.21 4.36 0.00 2.73 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.02 3.93 0.00 2.25 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 0.00 2.35 2.53 0.00 38 V 7.63 3.64 2.22 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 1.04 0.00 0.00 1.01 0.00 0.00 39 Q 8.58 4.02 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 40 N 8.23 4.37 0.00 3.02 2.87 0.00 0.00 7.02 7.82 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 41 E 7.73 3.94 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 2.60 2.49 0.00 42 I 7.77 3.70 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 1.53 0.73 0.92 0.00 0.00 43 D 8.78 4.34 0.00 2.64 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 44 R 7.96 3.88 0.00 1.91 2.07 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 45 L 7.91 3.99 0.00 1.92 1.70 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.50 4.33 0.00 2.87 2.87 0.00 0.00 7.07 7.83 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 47 E 8.53 4.00 0.00 2.16 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 0.00 2.47 2.50 0.00 48 Q 8.31 3.98 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 49 A 8.15 3.99 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 50 S 8.00 4.06 0.00 4.11 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 51 E 8.22 3.92 0.00 2.14 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 2.32 2.38 0.00 52 E 8.31 3.99 0.00 2.21 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 0.00 2.35 2.50 0.00 53 I 8.15 3.77 2.02 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 1.54 0.80 0.93 0.00 0.00 54 L 8.20 4.01 0.00 1.83 1.75 0.94 1.24 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 55 K 8.31 4.00 0.00 1.97 1.87 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.69 7.81 56 V 7.88 3.71 2.30 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 1.14 0.00 0.00 1.05 0.00 0.00 57 E 8.59 4.02 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 58 Q 8.30 3.96 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 59 K 8.10 3.84 0.00 1.80 1.93 0.00 1.55 0.00 0.00 1.34 0.00 0.00 2.40 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.84 1.25 7.81 60 Y 8.07 4.19 0.00 3.20 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 61 N 8.27 4.42 0.00 3.09 2.88 0.00 0.00 6.84 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 62 K 7.75 4.06 0.00 1.91 1.87 0.00 1.88 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.49 7.81 63 L 7.71 4.23 0.00 1.88 1.88 0.66 0.94 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 64 R 8.50 4.50 0.00 2.13 2.42 0.00 3.46 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 65 Q 8.23 4.09 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 66 P 0.00 4.38 0.00 1.70 1.90 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.08 0.00 67 F 8.03 4.28 0.00 3.23 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 68 F 8.60 3.95 0.00 3.38 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 69 Q 8.61 4.09 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.67 0.00 70 K 8.39 3.86 0.00 1.88 1.94 0.00 1.49 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 71 R 8.34 3.73 0.00 1.81 1.84 0.00 2.81 0.00 0.00 2.70 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.40 0.00 72 S 8.19 4.15 0.00 4.14 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 73 E 7.87 3.97 0.00 2.06 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 2.58 0.00 74 L 8.02 4.05 0.00 1.66 1.57 0.85 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.75 3.04 1.78 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.32 0.40 0.00 0.00 76 A 7.56 4.22 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 77 K 7.82 4.45 0.00 1.85 1.83 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.42 7.81 78 I 7.42 4.33 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.33 0.99 0.00 0.00 79 P 0.00 4.46 0.00 2.22 2.09 0.00 3.90 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 2.03 2.01 0.00 80 N 9.08 4.47 0.00 3.06 3.11 0.00 0.00 6.70 8.13 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 81 F 7.89 3.79 0.00 3.01 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 W 8.23 4.03 0.00 3.48 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 83 V 8.01 3.78 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 0.93 0.00 0.00 1.02 0.00 0.00 84 T 7.97 3.83 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 85 T 7.67 3.82 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 1.22 0.00 0.00 86 F 8.15 4.76 0.00 3.28 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 87 V 8.36 3.74 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 1.00 0.00 0.00 1.12 0.00 0.00 88 N 8.18 4.68 0.00 3.05 2.93 0.00 0.00 6.90 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 89 H 7.95 4.51 0.00 3.07 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.34 0.00 2.17 2.08 0.00 3.12 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 2.07 2.11 0.00 91 Q 8.02 4.27 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.10 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 92 V 7.78 3.66 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 0.58 0.00 0.00 0.73 0.00 0.00 93 S 8.70 4.10 0.00 4.12 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 94 A 7.46 4.19 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.57 4.59 0.00 1.78 1.75 0.75 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.27 4.54 0.00 1.70 1.63 0.68 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 97 G 9.33 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 98 E 8.69 4.10 0.00 2.11 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 2.44 2.50 0.00 99 E 8.18 3.99 0.00 2.02 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 2.44 2.37 0.00 100 D 8.31 4.80 0.00 2.77 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 0.00 101 E 8.00 3.99 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 102 E 8.17 4.37 0.00 2.38 2.33 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 2.50 2.61 0.00 103 A 8.17 4.37 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 0.00 104 M 8.71 4.59 0.00 2.20 2.31 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 3.04 0.00 105 H 8.03 4.58 0.00 3.18 3.18 0.00 5.84 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.58 4.85 0.00 3.58 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 0.00 107 L 7.70 4.27 0.00 1.50 2.02 0.79 1.72 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 0.00 108 T 8.58 4.59 4.34 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 1.48 0.00 0.00 109 R 7.83 4.77 0.00 1.88 1.77 0.00 2.67 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 110 V 8.32 4.59 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 0.29 0.00 0.00 111 E 8.81 4.42 0.00 1.92 1.68 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 2.29 2.44 0.00 112 V 5.65 4.25 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 0.42 0.00 0.00 0.35 0.00 0.00 113 T 8.43 4.37 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 1.04 0.00 0.00 114 E 8.41 4.47 0.00 1.65 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 0.00 1.96 2.03 0.00 115 F 8.48 4.82 0.00 3.03 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 0.00 116 E 7.60 3.91 0.00 2.06 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 2.43 2.41 0.00 117 D 8.35 4.28 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.64 3.23 1.89 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 1.43 0.40 0.92 0.00 0.00 119 K 7.04 4.72 0.00 1.81 1.77 0.00 1.77 0.00 0.00 0.61 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.52 7.81 120 S 8.40 4.72 0.00 3.80 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 0.00 121 G 8.46 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 0.00 0.00 0.00 122 Y 8.62 5.02 0.00 3.06 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 0.00 123 R 9.19 4.99 0.00 2.09 1.89 0.00 3.25 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 124 I 9.21 4.84 2.08 0.00 0.00 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 1.29 0.88 0.36 0.00 0.00 125 D 8.77 5.19 0.00 2.63 2.33 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 0.00 126 F 9.61 5.21 0.00 3.45 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 0.00 127 Y 9.15 5.09 0.00 2.95 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 0.00 128 F 9.30 5.57 0.00 3.05 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 9.37 4.83 0.00 2.86 2.81 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 0.00 130 E 8.80 3.87 0.00 1.99 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 2.33 2.37 0.00 131 N 7.90 4.11 0.00 1.44 1.88 0.00 0.00 6.29 7.76 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 0.00 132 P 0.00 3.82 0.00 1.15 1.79 0.00 2.58 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 133 Y 6.73 4.49 0.00 2.46 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 0.00 134 F 6.49 5.04 0.00 2.84 2.39 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 0.00 135 E 8.63 4.17 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 136 N 8.11 4.35 0.00 2.59 2.84 0.00 0.00 6.94 7.61 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 0.00 137 K 8.74 4.44 0.00 1.79 1.98 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.61 1.49 7.81 138 V 7.70 4.89 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 0.30 0.00 0.00 0.67 0.00 0.00 139 L 9.52 4.71 0.00 1.75 0.75 -0.14 -0.04 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 0.00 140 S 9.22 5.58 0.00 3.74 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 0.00 141 K 9.02 4.65 0.00 0.89 1.00 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.30 0.56 7.81 142 E 8.70 5.07 0.00 1.75 1.69 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 2.19 2.14 0.00 143 F 8.72 4.85 0.00 2.13 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 0.00 144 H 9.16 4.43 0.00 3.06 3.31 0.00 5.88 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *152 S 7.72 4.57 0.00 3.92 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 0.00 153 S 7.55 5.33 0.00 3.26 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.24 4.52 0.00 1.58 1.61 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.71 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.28 7.81 155 S 7.98 4.97 0.00 3.48 3.43 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 0.00 156 T 8.38 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 1.03 0.00 0.00 157 E 8.58 4.03 0.00 1.85 1.84 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 2.27 2.34 0.00 158 I 7.96 3.54 1.00 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 0.39 0.08 -1.12 0.00 0.00 159 K 8.61 4.26 0.00 1.68 1.71 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.28 7.81 160 W 7.80 4.99 0.00 3.23 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 0.00 161 K 8.94 4.05 0.00 1.77 1.85 0.00 1.81 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.45 7.81 162 S 8.34 5.14 0.00 3.87 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 0.00 163 G 8.67 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 0.00 164 K 7.57 4.20 0.00 2.02 2.07 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.67 1.65 7.81 165 D 7.80 3.37 0.00 2.28 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 0.00 0.00 0.00 166 M 5.86 4.18 0.00 1.95 1.07 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.37 0.00 *189 F 8.68 4.68 0.00 3.22 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 0.00 190 F 8.52 4.74 0.00 3.52 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.13 4.01 4.31 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 1.26 0.00 0.00 192 W 7.99 4.45 0.00 2.76 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 0.00 193 F 7.74 4.35 0.00 3.15 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 0.00 194 T 8.31 3.87 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 *201 A 7.60 4.81 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 0.00 202 D 8.40 4.59 0.00 2.82 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 E 8.27 3.96 0.00 2.02 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 0.00 2.43 2.42 0.00 204 L 7.98 3.84 0.00 1.34 1.19 0.54 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 205 G 8.34 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 E 8.42 3.89 0.00 2.12 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 2.61 2.47 0.00 207 V 7.84 3.55 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 0.95 0.00 0.00 0.94 0.00 0.00 208 I 7.79 3.82 2.07 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.53 1.07 0.00 0.00 209 K 8.10 3.79 0.00 1.17 1.50 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 1.15 7.81 210 D 8.23 4.61 0.00 2.84 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 D 8.21 4.72 0.00 2.88 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 7.67 4.37 2.36 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 1.47 1.01 1.46 0.00 0.00 213 W 8.64 4.73 0.00 3.56 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 P 0.00 4.64 0.00 2.19 2.26 0.00 4.03 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 215 N 7.71 4.72 0.00 2.57 2.66 0.00 0.00 7.23 8.74 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 0.00 216 P 0.00 4.69 0.00 2.06 2.35 0.00 3.58 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 1.98 1.89 0.00 217 L 8.31 4.11 0.00 1.78 1.88 1.02 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 218 Q 8.13 3.94 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.51 0.00 0.00 0.00 0.00 0.00 1.98 1.16 0.00 219 Y 7.35 4.36 0.00 3.12 3.19 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 0.00 220 Y 7.79 3.91 0.00 2.08 2.81 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 0.00 221 L 7.54 4.05 0.00 1.59 1.54 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 222 V 7.36 3.68 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 0.65 0.00 0.00 0.85 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.