NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2939 8.1733 121.7891 56.0811 33.4842 176.3978 5 R 3.7712 8.5795 126.4127 58.7505 30.0804 177.4035 6 A 3.9818 8.3426 122.0720 54.9488 18.8230 178.8131 7 A 3.9535 8.0609 118.8531 55.4416 18.4518 179.6380 8 L 3.9409 7.7201 116.9187 58.0776 41.7474 179.9145 9 I 3.7059 7.6572 119.3805 64.3864 37.0726 178.1779 10 Q 3.9911 8.6252 120.7191 59.3108 28.8005 178.1651 11 N 4.3370 8.5485 117.7498 56.3628 38.5693 177.1532 12 L 4.0673 7.8406 120.1004 58.1666 41.5317 179.9443 13 R 4.0924 7.8936 116.4646 59.0886 30.1885 178.1791 14 D 4.5487 8.4308 118.3254 57.7027 40.8866 178.9921 15 S 4.4340 7.8833 114.0843 60.1556 63.4888 174.0645 16 Y 4.3216 7.7768 120.7398 56.3895 37.6322 175.8693 17 T 4.5103 7.7688 116.6226 60.1043 72.5612 174.7407 18 E 4.2136 8.8442 121.4310 58.9076 29.6086 178.3857 19 T 4.0563 7.7834 109.7647 64.0677 68.4926 177.0493 20 S 4.0478 7.7638 118.8002 61.6893 62.3827 176.6156 21 S 4.0100 7.9999 116.3467 60.8960 62.9232 176.1608 22 F 4.0271 8.4438 124.3744 60.9422 39.1643 176.5880 23 A 3.6404 7.7971 120.5771 55.4098 17.9895 179.5823 24 V 3.0797 7.0080 115.5895 66.2824 31.4287 178.3866 25 I 3.3180 6.7249 119.2441 63.9290 36.7600 178.3420 26 E 3.6994 7.6839 119.7689 59.1239 29.2008 178.9349 27 E 3.8740 7.8055 119.2921 59.1000 29.3210 178.8467 28 W 4.3799 8.3387 119.0350 59.8647 28.8615 178.3551 29 A 4.1234 8.0895 119.5320 53.5096 17.8411 178.3735 30 A 4.2289 8.3339 118.1346 52.5620 19.0610 179.0399 31 G 3.8974 9.0004 107.0778 47.3561 0.0000 174.9939 32 T 3.8885 7.9834 118.5469 66.1643 68.5200 176.9034 33 L 3.9742 7.6353 119.4806 57.6343 41.5146 179.7587 34 Q 3.9552 7.8174 117.8702 58.9637 28.7449 178.1712 35 E 3.9412 8.3434 120.4029 59.3494 29.6405 178.8397 36 I 3.7459 7.9842 120.0071 64.4456 37.1531 178.0491 37 E 4.0747 8.0935 119.9032 58.9717 29.3524 179.0278 38 G 3.6267 8.2912 106.0350 47.8393 0.0000 175.7264 39 I 3.7008 7.9192 122.0968 63.9509 37.1146 178.1989 40 A 3.9540 8.0612 121.5747 55.2863 18.1870 179.9530 41 K 3.9050 8.1226 116.5954 59.4258 32.1480 179.3237 42 A 3.9766 8.2584 121.1240 55.3149 18.1995 179.6304 43 A 3.9098 8.1423 118.8299 55.1146 18.5122 179.6963 44 A 4.2439 8.0546 120.7194 54.6615 18.4965 179.5632 45 E 3.8262 8.3805 117.6179 59.4199 29.8070 178.8141 46 A 4.0162 7.9699 120.8785 55.5051 18.4119 179.0442 47 H 4.1687 8.6020 116.9899 59.2691 29.8294 177.7821 48 G 3.6018 8.0631 107.6438 47.6838 0.0000 175.8050 49 V 3.6183 7.4696 119.5119 65.9401 31.6470 177.9354 50 I 3.9583 7.5153 118.1795 64.2119 36.9659 177.9356 51 R 3.9745 7.8009 118.8099 59.0205 30.3319 177.4916 52 N 4.8708 7.7862 114.5954 52.6780 39.7514 175.3998 53 S 4.7704 7.5231 114.5028 57.0883 67.0390 173.9201 54 T 4.6224 8.5658 120.7638 62.1593 69.9769 173.5547 55 Y 4.7422 8.7431 123.7979 56.3814 39.5630 175.2057 56 G 4.2932 9.1045 114.0515 43.1932 0.0000 173.3619 57 R 3.7796 8.5345 117.5416 58.9484 30.3036 178.2739 58 A 3.9735 8.2395 120.6661 55.4463 18.2567 179.2617 59 Q 3.8403 8.1126 113.2392 58.0743 28.8534 176.8978 60 A 4.2979 7.8338 119.0559 52.8189 18.6791 177.4787 61 E 4.5263 7.7540 115.0018 55.9618 30.8369 176.1483 62 K 4.6091 7.5263 116.2487 54.9237 35.7297 175.6649 63 S 4.5034 8.4581 116.9672 56.4429 63.5406 172.9454 64 P 4.2855 0.0000 0.0000 63.2963 31.8146 177.0444 65 E 4.0648 8.8646 123.0754 58.6890 29.5173 178.9545 66 Q 3.9604 8.0388 119.8305 59.1494 29.1517 178.0920 67 L 3.9313 7.8313 119.5040 57.7447 41.7286 179.1175 68 L 4.1550 7.8390 119.1906 57.7133 41.5154 180.0163 69 G 3.5401 8.1297 105.6428 47.6994 0.0000 175.8075 70 V 3.5954 7.6173 121.1070 65.6352 31.5429 177.9312 71 L 3.9891 8.1802 118.8472 58.0709 41.5762 179.3332 72 Q 3.9997 8.4505 119.7147 59.2660 28.9858 178.4681 73 R 3.9217 8.1476 119.7616 59.4829 30.0542 177.9199 74 Y 4.1350 8.0914 119.4373 60.7716 38.7800 177.6455 75 Q 3.7481 8.3295 120.5313 59.2607 29.2130 178.0990 76 D 4.3344 8.2028 120.0555 56.8854 40.7352 178.4235 77 L 3.8645 7.6945 120.4263 58.4496 42.1997 178.6092 78 C 3.8060 7.7631 116.7567 63.0605 28.0410 175.6002 79 H 4.0638 8.2440 119.6212 59.4694 29.3191 177.0773 80 N 4.2698 8.0099 117.6134 56.3621 38.3957 177.4880 81 V 3.9183 8.0243 121.3699 65.5180 31.5049 177.3667 82 Y 3.9914 8.1008 119.0534 61.1158 38.4811 177.9745 83 C 4.3351 8.0012 116.0639 62.8882 28.5070 175.9397 84 Q 4.1069 8.6546 119.8594 58.6878 28.2830 178.0671 85 A 4.2876 8.6928 122.3744 55.7341 18.3821 179.6983 86 E 3.8018 8.1806 116.3960 59.3932 29.3136 179.8583 87 T 3.9322 7.6439 115.6715 66.7187 68.5567 176.5647 88 I 3.6534 7.5927 121.1177 64.4516 37.0856 178.2881 89 R 3.9032 8.2196 119.6636 59.7381 29.9848 178.7014 90 T 3.7059 7.9569 115.6526 66.4619 68.1315 176.7838 91 V 3.6879 7.7729 119.2741 66.0495 31.7599 177.9991 92 I 3.8610 8.0132 119.2442 64.4922 37.1545 178.2446 93 A 3.9940 8.3276 122.0703 54.8861 17.9613 178.7255 94 I 4.2487 7.4185 108.3819 61.6597 38.0692 176.5264 95 R 4.5407 7.6758 118.6383 55.9528 30.8325 175.5058 96 I 4.1751 7.5841 118.7134 60.1009 36.9796 174.6009 97 P 4.5601 0.0000 0.0000 60.9361 32.6258 175.0608 98 E 3.7467 8.6175 117.8154 56.6408 29.6240 176.0902 99 H 4.2340 8.7432 125.7629 56.3770 30.4489 174.2598 100 K 4.6596 7.9542 124.1977 55.6430 36.0032 175.0208 101 E 4.5801 8.4063 118.1388 55.8209 29.7603 175.7021 102 E 4.5519 8.1032 114.5201 56.1065 32.0298 173.4980 103 D 4.3397 8.5431 115.8291 56.1154 39.6024 173.3053 104 N 4.9947 7.7379 110.4899 53.0672 39.3390 177.4750 105 L 4.0770 8.0479 121.6765 57.8916 41.6490 179.4007 106 G 3.6984 7.8786 106.5630 47.0659 0.0000 175.7937 107 V 3.7623 7.8005 119.9506 65.6255 31.3775 177.7655 108 A 3.9989 8.1736 120.6737 55.0919 18.1566 179.6902 109 V 3.5012 7.4249 115.7499 66.1881 31.4474 178.0230 110 Q 3.9662 8.3710 118.0690 59.6430 28.7678 178.9411 111 H 4.2697 8.4928 117.0319 58.6164 28.8342 177.7349 112 A 4.0142 8.3074 122.9762 55.3809 18.3943 179.9101 113 V 3.7675 8.1006 116.7490 65.8704 31.6304 178.2221 114 L 4.1064 8.2485 118.8958 57.2819 41.3633 179.4123 115 K 4.0100 7.9312 119.9954 59.3128 32.2120 178.7525 116 I 3.9812 7.5142 111.8537 63.3074 37.6327 178.2377 117 I 3.7762 7.7237 121.8490 64.4144 36.8299 177.7479 118 D 4.3616 8.2364 119.7763 57.4312 40.6751 178.6198 119 E 3.9131 8.1619 119.5516 59.0729 29.5770 178.3770 120 L 3.8982 7.9818 120.3275 58.3389 41.8758 178.9040 121 E 4.0034 8.3696 118.3211 60.2131 29.3843 178.8233 122 I 3.9889 8.2024 120.7009 63.5422 37.0285 178.4771 123 K 3.9990 7.8089 120.4239 60.0673 32.5475 178.9182 124 T 4.1626 7.9386 114.0846 66.4633 68.9873 176.2231 125 L 4.0500 8.4991 119.2922 54.9644 42.0139 177.3699 126 G 4.1302 7.4304 108.2633 46.5614 0.0000 174.1346 127 S 4.2568 7.6433 110.5004 57.9808 64.0455 174.8410 128 G 4.1451 7.6805 110.0203 44.2982 0.0000 173.9867 129 E 4.1430 8.9429 119.4680 58.5819 29.6256 178.0331 130 K 4.7177 7.6268 115.0302 54.3046 35.6222 176.2618 131 S 4.4033 8.5170 117.8017 57.8604 63.7789 174.1915 132 G 3.8975 8.3108 111.5099 45.2577 0.0000 174.4768 133 S 4.4021 8.4794 112.5576 59.2917 63.2879 175.5418 134 G 3.5945 7.9350 109.9603 46.9866 0.0000 173.8661 135 G 3.6572 7.8824 105.2127 44.1043 0.0000 172.9535 136 A 4.5935 8.0230 122.4177 49.4396 18.8295 174.7268 137 P 4.3306 0.0000 0.0000 66.2249 30.9525 178.0094 138 T 3.9758 7.7992 114.0288 61.1753 67.7987 172.9253 139 P 4.4007 0.0000 0.0000 65.3950 31.6698 176.4133 140 I 4.4781 7.0581 112.6857 59.6332 41.1324 174.6708 141 G 4.0859 7.7448 115.8412 44.6433 0.0000 173.2260 142 M 3.9358 7.5466 117.0660 57.8794 32.2308 177.4960 143 Y 4.8791 7.1299 116.4634 57.7705 38.7293 177.8584 144 A 4.1898 7.9700 123.7517 55.2258 18.9891 178.8668 145 L 3.9586 8.1227 118.4914 58.6891 42.1043 179.1876 146 R 3.9618 8.0970 117.8419 59.3659 30.0659 178.0799 147 E 4.0752 8.3013 118.5895 59.4274 29.3823 178.6535 148 Y 2.8676 8.3156 119.8527 60.3398 38.8369 177.9165 149 L 3.5123 7.8284 119.7714 57.6882 41.5338 179.5434 150 S 3.9878 7.9601 112.7096 61.4363 62.4464 176.1680 151 A 3.9927 7.8696 123.4540 54.9722 18.1026 179.6433 152 R 3.8046 7.9655 117.9837 59.3950 30.1440 178.8883 153 S 4.4631 8.1121 114.1106 61.4026 62.8604 176.6833 154 T 3.8210 7.5740 119.5720 66.5877 68.2100 176.7616 155 V 3.6116 7.3594 119.3336 65.8238 31.5377 177.7993 156 E 3.9317 8.6912 118.7238 59.5191 29.3603 178.8801 157 D 4.3558 8.0336 118.6395 57.6280 40.9743 179.1085 158 K 4.0266 7.8157 118.3840 59.6364 32.0064 179.3683 159 L 4.1737 8.0668 119.1217 57.0365 41.3553 179.1785 160 L 4.1015 7.9305 118.0576 56.2220 42.6302 177.0990 161 G 3.7994 8.8057 104.6187 44.5271 0.0000 176.2016 *172 G 3.6203 8.5298 116.4747 44.7448 0.0000 172.3342 173 G 4.3212 8.3857 114.0158 44.0111 0.0000 172.7256 174 S 4.1753 8.6990 116.5715 58.7139 62.8129 174.1812 175 Q 4.4149 8.4169 123.9765 55.7870 28.4975 176.0454 176 S 4.2441 7.8733 114.6070 57.4140 62.8658 172.8424 177 P 4.3104 0.0000 0.0000 66.2237 30.9091 178.6052 178 S 4.1338 7.9924 114.4560 61.1793 62.7265 176.0278 179 L 3.9753 8.0839 123.1492 57.9544 41.7527 178.9304 180 L 4.0113 7.6809 119.6071 58.1578 42.0953 178.9776 181 L 4.0685 7.6676 119.0904 57.5396 41.4591 179.1221 182 E 3.9207 8.4953 120.0088 59.0815 29.4431 178.3746 183 L 4.0089 7.7445 120.4914 58.4040 41.9996 179.0940 184 R 3.1239 7.3963 117.1082 59.0273 29.8535 178.2923 185 Q 3.9448 7.9805 119.5313 59.0071 29.1347 178.0340 186 I 3.9651 8.4738 121.3599 64.5876 37.0356 178.1482 187 D 4.5941 8.1402 119.5779 57.2580 40.6764 178.6324 188 A 4.0598 8.3652 121.5925 55.3643 18.3831 179.3494 189 D 4.2865 8.7532 117.5670 57.7396 40.4503 179.2915 190 F 3.5789 8.3262 117.4632 60.4676 38.8641 177.6831 191 M 4.1029 7.8320 117.4018 57.8891 31.7162 178.4099 192 L 3.7958 7.9950 120.6289 58.1582 42.2682 179.0980 193 K 3.7435 8.6515 119.0894 59.4824 31.7863 179.5047 194 V 3.1125 7.2290 117.3765 65.6224 31.2689 177.8770 195 E 3.8492 7.8911 118.2068 59.3502 29.3419 179.3708 196 L 3.9292 7.9463 118.6113 57.8498 41.6641 179.4475 197 A 4.0363 7.9755 120.9438 55.2976 18.2273 179.8300 198 T 3.8555 8.0911 108.6823 65.1544 68.8178 176.6398 199 T 3.8000 7.8135 118.8579 66.8470 68.5693 175.7898 200 H 4.1900 8.2814 119.5294 59.2931 29.9588 176.9650 201 L 3.8585 8.2586 122.4518 58.1295 41.7435 179.2116 202 S 3.9969 8.0233 115.0680 61.8269 62.7834 176.3920 203 T 3.8592 7.5601 118.0246 67.2001 68.2086 176.2953 204 M 3.9926 7.8810 120.0749 58.4736 32.0001 179.0838 205 V 3.3588 8.1025 118.6114 65.9515 31.6542 178.3016 206 R 3.9692 8.4324 118.0633 59.0569 29.8225 178.7642 207 A 4.0266 8.3980 121.0309 55.4279 18.3432 179.9747 208 V 3.6814 8.1376 116.7489 65.8987 31.5732 178.1414 209 I 3.8314 8.0379 119.8634 64.4825 36.9764 177.7085 210 N 4.3439 8.3339 117.2474 56.8352 38.6685 176.4759 211 A 4.0442 8.0660 120.8961 55.4903 18.6896 178.7951 212 Y 4.1472 8.5072 117.9717 61.0712 38.8038 178.1884 213 L 4.2962 8.1977 118.6363 57.9037 41.8250 179.3647 214 L 4.2634 8.2851 118.2259 56.6851 41.9013 177.6020 215 N 4.8849 7.9714 114.4489 52.2781 39.6277 176.3062 216 W 3.8511 7.8579 118.5334 59.1198 28.0362 178.4841 217 K 3.1293 6.7364 119.0141 59.0652 30.9986 179.3162 218 K 4.1855 7.5149 119.2227 58.4486 31.7552 179.2675 219 L 4.0199 7.3563 118.5782 57.4438 41.5229 179.1459 220 I 4.2535 7.4158 118.3317 62.7314 38.0793 176.7819 221 Q 4.4865 7.8850 123.0985 53.4431 28.3215 174.2755 222 P 4.5801 0.0000 0.0000 62.9232 32.2929 176.9448 223 R 4.5790 7.5640 118.0916 54.9434 33.6977 174.0688 224 T 4.5495 8.4610 111.4873 59.6093 72.0870 172.9807 225 G 4.0526 8.6968 108.4882 45.3929 0.0000 174.1429 226 T 4.3096 8.1356 118.3746 62.7724 70.8044 175.0634 227 D 5.0808 8.0513 120.2664 53.8445 39.8446 177.1626 228 H 4.3978 8.1094 118.3210 59.0799 29.5138 177.6689 229 M 4.0550 8.1728 117.5435 57.0247 32.0239 176.1977 230 F 4.9038 7.5900 115.6654 55.7512 41.3199 175.5553 231 S 4.2000 8.4765 117.7585 58.8523 62.1334 173.6316 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 4 K 8.17 4.29 0.00 1.85 1.77 0.00 1.57 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.53 7.81 5 R 8.58 3.77 0.00 1.98 1.96 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 6 A 8.34 3.98 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 7 A 8.06 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.72 3.94 0.00 1.87 1.74 0.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.66 3.71 2.01 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 1.41 0.99 0.92 0.00 0.00 10 Q 8.63 3.99 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 11 N 8.55 4.34 0.00 2.93 2.88 0.00 0.00 7.04 6.30 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 12 L 7.84 4.07 0.00 1.98 1.76 0.92 0.95 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 13 R 7.89 4.09 0.00 1.83 2.02 0.00 3.20 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 14 D 8.43 4.55 0.00 2.61 2.75 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 15 S 7.88 4.43 0.00 4.16 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 16 Y 7.78 4.32 0.00 2.90 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 17 T 7.77 4.51 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 1.31 0.00 0.00 18 E 8.84 4.21 0.00 2.13 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 2.57 2.38 0.00 19 T 7.78 4.06 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 1.19 0.00 0.00 20 S 7.76 4.05 0.00 4.04 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 21 S 8.00 4.01 0.00 3.88 4.12 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 22 F 8.44 4.03 0.00 3.23 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 23 A 7.80 3.64 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.01 3.08 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 25 I 6.72 3.32 1.62 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.23 0.89 0.00 0.00 26 E 7.68 3.70 0.00 1.78 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 1.62 1.47 0.00 27 E 7.81 3.87 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 2.31 2.52 0.00 28 W 8.34 4.38 0.00 3.46 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.09 4.12 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 30 A 8.33 4.23 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 31 G 9.00 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 32 T 7.98 3.89 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 1.05 0.00 0.00 33 L 7.64 3.97 0.00 1.74 1.71 1.00 0.76 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 34 Q 7.82 3.96 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 35 E 8.34 3.94 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 36 I 7.98 3.75 2.01 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.78 0.93 0.00 0.00 37 E 8.09 4.07 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 38 G 8.29 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.92 3.70 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.03 0.96 0.00 0.00 40 A 8.06 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.12 3.91 0.00 1.93 1.86 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.59 7.81 42 A 8.26 3.98 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 43 A 8.14 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 44 A 8.05 4.24 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.38 3.83 0.00 2.22 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 0.00 2.31 2.33 0.00 46 A 7.97 4.02 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 47 H 8.60 4.17 0.00 3.28 3.47 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.06 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 0.00 0.00 0.00 49 V 7.47 3.62 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 0.90 0.00 0.00 0.97 0.00 0.00 50 I 7.52 3.96 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.77 0.85 0.00 0.00 51 R 7.80 3.97 0.00 1.84 2.10 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 52 N 7.79 4.87 0.00 2.73 2.82 0.00 0.00 6.85 8.80 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 53 S 7.52 4.77 0.00 4.18 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 54 T 8.57 4.62 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 55 Y 8.74 4.74 0.00 2.82 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 56 G 9.10 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.53 3.78 0.00 1.85 1.94 0.00 3.21 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 58 A 8.24 3.97 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 59 Q 8.11 3.84 0.00 1.89 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 60 A 7.83 4.30 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 61 E 7.75 4.53 0.00 2.04 1.97 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 2.24 2.38 0.00 62 K 7.53 4.61 0.00 1.77 1.69 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.25 1.42 7.81 63 S 8.46 4.50 0.00 3.88 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 64 P 0.00 4.29 0.00 2.32 2.26 0.00 3.82 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 65 E 8.86 4.06 0.00 2.04 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 2.42 2.37 0.00 66 Q 8.04 3.96 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 67 L 7.83 3.93 0.00 1.64 1.40 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.84 4.15 0.00 1.82 1.77 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.13 3.54 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 70 V 7.62 3.60 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 0.98 0.00 0.00 1.01 0.00 0.00 71 L 8.18 3.99 0.00 1.67 1.75 0.43 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.45 4.00 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 73 R 8.15 3.92 0.00 2.13 2.12 0.00 3.17 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 74 Y 8.09 4.14 0.00 3.07 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 75 Q 8.33 3.75 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 76 D 8.20 4.33 0.00 2.90 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 77 L 7.69 3.86 0.00 1.75 1.66 0.89 0.83 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 78 C 7.76 3.81 0.00 2.67 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.24 4.06 0.00 3.17 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.01 4.27 0.00 2.96 2.89 0.00 0.00 6.71 6.99 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 81 V 8.02 3.92 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 0.83 0.00 0.00 0.73 0.00 0.00 82 Y 8.10 3.99 0.00 3.18 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 83 C 8.00 4.34 0.00 3.16 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 84 Q 8.65 4.11 0.00 2.62 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.61 0.00 85 A 8.69 4.29 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.18 3.80 0.00 2.09 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 2.08 2.22 0.00 87 T 7.64 3.93 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 88 I 7.59 3.65 1.94 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.48 0.97 0.00 0.00 89 R 8.22 3.90 0.00 1.91 2.03 0.00 3.24 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 90 T 7.96 3.71 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 91 V 7.77 3.69 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.16 0.00 0.00 92 I 8.01 3.86 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.72 0.92 0.00 0.00 93 A 8.33 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.42 4.25 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.67 0.86 0.00 0.00 95 R 7.68 4.54 0.00 1.89 1.94 0.00 3.21 0.00 0.00 3.45 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 96 I 7.58 4.18 1.87 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 0.89 1.42 0.92 0.00 0.00 97 P 0.00 4.56 0.00 2.16 2.06 0.00 3.79 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 1.96 1.92 0.00 98 E 8.62 3.75 0.00 1.94 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 2.32 2.35 0.00 99 H 8.74 4.23 0.00 3.13 3.21 0.00 5.97 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 0.00 100 K 7.95 4.66 0.00 1.78 1.61 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.61 7.81 101 E 8.41 4.58 0.00 1.94 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 2.25 2.23 0.00 102 E 8.10 4.55 0.00 2.01 1.87 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 2.13 2.24 0.00 103 D 8.54 4.34 0.00 2.77 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 0.00 104 N 7.74 4.99 0.00 2.74 2.74 0.00 0.00 7.00 6.74 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 0.00 105 L 8.05 4.08 0.00 1.66 1.69 0.90 0.97 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 0.00 106 G 7.88 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.80 3.76 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 1.09 0.00 0.00 0.90 0.00 0.00 108 A 8.17 4.00 1.41 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 0.00 0.00 109 V 7.42 3.50 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 1.10 0.00 0.00 0.89 0.00 0.00 110 Q 8.37 3.97 0.00 2.16 2.05 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 2.35 2.49 0.00 111 H 8.49 4.27 0.00 3.16 3.33 0.00 5.63 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.31 4.01 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 0.00 113 V 8.10 3.77 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 1.14 0.00 0.00 0.97 0.00 0.00 114 L 8.25 4.11 0.00 1.78 1.74 0.94 0.66 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 0.00 115 K 7.93 4.01 0.00 2.13 1.90 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.46 7.81 116 I 7.51 3.98 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.84 0.95 0.00 0.00 117 I 7.72 3.78 1.92 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 1.66 0.75 0.95 0.00 0.00 118 D 8.24 4.36 0.00 2.96 2.75 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 0.00 119 E 8.16 3.91 0.00 2.08 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 2.32 2.34 0.00 120 L 7.98 3.90 0.00 1.89 1.87 0.73 0.75 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 0.00 121 E 8.37 4.00 0.00 2.03 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 2.13 2.47 0.00 122 I 8.20 3.99 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.77 0.95 0.00 0.00 123 K 7.81 4.00 0.00 1.95 1.91 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.44 7.81 124 T 7.94 4.16 4.35 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 1.14 0.00 0.00 125 L 8.50 4.05 0.00 1.97 1.64 1.07 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 126 G 7.43 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 0.00 127 S 7.64 4.26 0.00 3.75 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 0.00 128 G 7.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.94 4.14 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 130 K 7.63 4.72 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.43 7.81 131 S 8.52 4.40 0.00 3.89 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 0.00 132 G 8.31 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 0.00 133 S 8.48 4.40 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.93 3.59 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 0.00 0.00 0.00 135 G 7.88 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.02 4.59 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 0.00 137 P 0.00 4.33 0.00 2.18 2.19 0.00 3.79 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 138 T 7.80 3.98 4.46 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 1.28 0.00 0.00 139 P 0.00 4.40 0.00 2.13 2.02 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 140 I 7.06 4.48 1.78 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 1.36 0.60 0.90 0.00 0.00 141 G 7.74 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 M 7.55 3.94 0.00 1.36 1.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 143 Y 7.13 4.88 0.00 3.14 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.97 4.19 1.56 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 0.00 0.00 145 L 8.12 3.96 0.00 1.85 1.78 1.02 0.90 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 0.00 146 R 8.10 3.96 0.00 1.97 2.01 0.00 3.23 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 147 E 8.30 4.08 0.00 2.60 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 0.00 2.49 2.68 0.00 148 Y 8.32 2.87 0.00 1.98 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 0.00 149 L 7.83 3.51 0.00 1.66 1.59 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 150 S 7.96 3.99 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 0.00 151 A 7.87 3.99 1.45 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 0.00 152 R 7.97 3.80 0.00 1.39 1.53 0.00 2.52 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 153 S 8.11 4.46 0.00 4.03 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 7.57 3.82 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 155 V 7.36 3.61 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 1.05 0.00 0.00 0.94 0.00 0.00 156 E 8.69 3.93 0.00 2.10 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 2.42 2.46 0.00 157 D 8.03 4.36 0.00 3.01 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 0.00 158 K 7.82 4.03 0.00 1.89 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.62 7.81 159 L 8.07 4.17 0.00 1.86 1.71 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.93 4.10 0.00 1.61 1.70 0.94 0.82 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 0.00 161 G 8.81 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 *172 G 8.53 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 0.00 0.00 0.00 173 G 8.39 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 S 8.70 4.18 0.00 3.83 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 0.00 175 Q 8.42 4.41 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 176 S 7.87 4.24 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 P 0.00 4.31 0.00 2.30 2.30 0.00 3.75 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 2.08 2.06 0.00 178 S 7.99 4.13 0.00 3.89 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 0.00 179 L 8.08 3.98 0.00 1.77 1.83 0.97 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.68 4.01 0.00 1.86 1.87 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 181 L 7.67 4.07 0.00 1.83 1.67 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.50 3.92 0.00 2.11 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 0.00 2.33 2.33 0.00 183 L 7.74 4.01 0.00 1.82 1.98 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 184 R 7.40 3.12 0.00 0.67 1.70 0.00 2.51 0.00 0.00 2.63 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.07 0.00 185 Q 7.98 3.94 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 186 I 8.47 3.97 2.11 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 1.70 1.02 1.07 0.00 0.00 187 D 8.14 4.59 0.00 2.91 2.87 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 0.00 188 A 8.37 4.06 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 D 8.75 4.29 0.00 2.89 2.61 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 0.00 190 F 8.33 3.58 0.00 3.24 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 0.00 191 M 7.83 4.10 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.76 0.00 192 L 8.00 3.80 0.00 1.65 1.78 0.79 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 193 K 8.65 3.74 0.00 1.74 1.65 0.00 0.82 0.00 0.00 1.25 0.00 0.00 2.69 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.39 7.81 194 V 7.23 3.11 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 0.74 0.00 0.00 0.76 0.00 0.00 195 E 7.89 3.85 0.00 2.11 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 2.25 2.50 0.00 196 L 7.95 3.93 0.00 1.59 1.64 0.84 0.56 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 0.00 197 A 7.98 4.04 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 0.00 198 T 8.09 3.86 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 199 T 7.81 3.80 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 200 H 8.28 4.19 0.00 3.23 3.30 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.26 3.86 0.00 1.90 1.80 0.77 0.92 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 0.00 202 S 8.02 4.00 0.00 4.03 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 0.00 203 T 7.56 3.86 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 1.22 0.00 0.00 204 M 7.88 3.99 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 205 V 8.10 3.36 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 0.80 0.00 0.00 0.44 0.00 0.00 206 R 8.43 3.97 0.00 2.01 1.99 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 207 A 8.40 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 V 8.14 3.68 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 1.41 0.00 0.00 1.07 0.00 0.00 209 I 8.04 3.83 2.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.96 1.01 0.00 0.00 210 N 8.33 4.34 0.00 2.92 3.03 0.00 0.00 7.17 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 0.00 211 A 8.07 4.04 1.45 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 0.00 212 Y 8.51 4.15 0.00 3.23 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 L 8.20 4.30 0.00 1.84 1.90 1.07 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 214 L 8.29 4.26 0.00 1.65 1.75 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 215 N 7.97 4.88 0.00 2.81 2.70 0.00 0.00 6.62 7.28 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 0.00 216 W 7.86 3.85 0.00 3.06 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 K 6.74 3.13 0.00 1.16 1.36 0.00 1.18 0.00 0.00 1.37 0.00 0.00 2.70 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.21 7.81 218 K 7.51 4.19 0.00 1.64 1.77 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.23 7.81 219 L 7.36 4.02 0.00 1.81 1.75 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 220 I 7.42 4.25 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.01 0.98 0.00 0.00 221 Q 7.88 4.49 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 222 P 0.00 4.58 0.00 2.18 2.33 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 223 R 7.56 4.58 0.00 1.73 1.79 0.00 3.13 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.57 0.00 224 T 8.46 4.55 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 1.17 0.00 0.00 225 G 8.70 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 T 8.14 4.31 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 227 D 8.05 5.08 0.00 2.70 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 0.00 228 H 8.11 4.40 0.00 3.18 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 M 8.17 4.05 0.00 1.45 1.55 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 230 F 7.59 4.90 0.00 3.03 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 0.00 231 S 8.48 4.20 0.00 3.82 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 * Residues marked with a * may have inaccurate shift predictions.