NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4776 8.2893 120.3285 54.5801 33.4450 174.9166 2 V 3.4940 8.2961 120.3189 61.7906 31.7965 173.4958 3 H 4.8256 10.0699 124.3733 54.6793 33.1840 172.9951 4 Y 5.3095 8.4453 123.2557 56.1254 40.8017 174.5371 5 K 5.0077 9.4503 125.2804 54.4780 35.7204 174.2155 6 L 5.2074 9.4080 129.7975 53.7341 44.6915 174.7830 7 T 5.0914 8.8006 123.6744 62.3392 71.0983 173.1666 8 Y 4.7239 8.3154 125.7280 56.8019 43.2690 172.9035 9 F 5.3635 6.3837 120.2161 56.5818 40.0430 176.4242 10 N 4.6548 8.6997 120.0381 51.2880 36.6358 173.4505 11 G 2.7841 7.2799 109.2741 44.8330 0.0000 170.5904 12 R 4.3001 7.3420 117.6304 56.8453 31.6748 179.6649 13 G 4.2328 8.6920 108.9094 46.8227 0.0000 175.2804 14 A 4.1399 8.9563 127.4129 53.2893 18.9562 178.8008 15 G 3.4721 6.6329 101.6426 45.1789 0.0000 175.4999 16 E 4.0568 7.8643 121.7489 59.3192 29.5993 178.1414 17 C 4.0596 8.0649 118.1217 62.3866 31.7070 175.1197 18 A 3.6705 7.8376 121.7568 55.3215 18.0091 179.6015 19 R 3.5576 7.7215 116.0342 59.4495 29.9725 179.3615 20 Q 3.7400 7.9377 117.7824 58.3823 28.6567 178.7567 21 V 3.3617 7.6662 119.5396 65.9874 31.4910 177.9441 22 F 3.9369 7.5870 117.1904 60.4791 38.5921 177.6608 23 A 3.8654 7.5354 120.0128 55.1627 17.9981 179.5693 24 L 3.7608 7.7497 116.3186 57.6143 41.6879 178.8687 25 A 4.3032 7.6245 117.7943 51.3163 19.2447 176.2578 26 D 4.1952 7.6677 116.0343 54.8840 40.3684 173.1388 27 Q 4.4515 7.8372 118.1849 53.9101 30.4043 175.0344 28 K 4.1891 8.5189 125.3714 56.7617 32.8372 175.6254 29 Y 4.8192 7.4575 119.1668 55.6936 41.0429 173.6789 30 E 3.9778 9.1123 123.1460 55.8017 30.7429 175.0098 31 D 4.8051 8.3393 128.3954 53.1385 40.8713 174.0352 32 V 4.0758 8.8773 124.7330 61.7261 33.0271 174.4498 33 R 4.9497 8.6943 127.3028 54.6502 31.9645 175.5049 34 L 4.6834 9.2713 125.2850 53.8682 44.0538 176.5808 35 T 4.7939 8.3551 115.8827 60.4320 69.5666 175.1286 36 Q 4.1956 8.6765 124.6558 59.5711 28.5142 178.5866 37 E 4.0424 8.1295 118.2299 59.7046 29.7621 178.7896 38 T 4.0935 7.9579 111.1493 64.5264 67.7192 175.7115 39 F 4.4760 8.4175 123.2451 61.1090 39.3472 176.8783 40 V 3.5502 7.9587 118.2478 65.8147 31.0843 176.3850 41 P 4.2094 0.0000 0.0000 65.2049 31.4482 177.3045 42 L 4.0379 7.7314 117.6728 55.0645 41.8464 178.4350 43 K 3.6480 7.1576 119.5660 59.4690 31.8663 178.4882 44 A 4.1123 7.6142 118.9311 54.1243 18.5676 178.0838 45 T 3.9221 7.5805 105.3274 62.4543 69.5394 174.7831 46 F 5.0345 7.1476 121.3483 55.1256 41.1477 174.6235 47 P 3.9508 0.0000 0.0000 65.2834 29.8885 177.6863 48 F 4.9205 7.6786 114.8494 57.0133 39.8401 175.9202 49 G 4.7333 8.3889 106.7420 46.3445 0.0000 173.8167 50 Q 4.9664 7.8894 117.2255 53.9447 33.0227 174.4167 51 V 4.4285 8.0125 117.8574 59.2781 33.9487 173.7330 52 P 5.3427 0.0000 0.0000 61.9628 33.7172 174.7710 53 V 4.7274 7.9423 119.0688 61.4217 35.1811 173.0009 54 L 5.2111 9.1684 130.0817 53.5923 44.4773 174.5929 55 E 5.2566 9.6014 125.1545 54.5549 32.7810 175.0272 56 V 4.5551 8.6795 124.4841 60.9982 33.8029 175.3145 57 D 4.4974 9.8975 131.3755 55.4285 38.8277 175.3990 58 G 3.9821 8.3767 105.4302 45.4081 0.0000 173.4993 59 Q 4.4893 7.8329 119.7371 54.8358 30.4135 175.1317 60 Q 4.7859 8.5647 122.6528 55.3399 30.4413 175.2813 61 L 4.5910 9.0775 124.6284 53.6259 45.2451 175.6028 62 A 4.9144 8.7812 127.9795 51.5017 21.5643 173.7823 63 Q 3.9581 8.4196 121.8835 56.4169 29.1360 174.9028 64 S 4.0385 8.8893 118.2786 62.0103 62.7706 176.8103 65 Q 3.8397 8.0544 121.4039 58.0417 28.5507 178.2707 66 A 3.8960 7.8839 121.3955 55.1492 18.4053 179.6235 67 I 3.5826 7.8086 118.2579 64.6147 37.1702 178.3941 68 C 3.7016 7.8232 117.5957 62.6611 27.8428 176.1411 69 R 2.7489 7.0638 120.3231 59.0620 29.5563 177.7215 70 Y 3.9374 7.6923 119.1006 60.8154 38.8234 178.2355 71 L 3.4553 7.8563 119.5525 57.4915 41.6480 179.4273 72 A 4.1028 8.0156 121.1232 55.1234 17.8779 179.8502 73 K 3.8676 7.9743 117.1492 59.6937 31.8180 179.7121 74 T 3.4484 6.9603 115.0364 66.1198 68.3743 175.9733 75 F 4.7088 7.4054 116.3335 57.1378 39.4797 176.6703 76 G 3.7373 7.2889 107.6010 45.5693 0.0000 173.8124 77 F 5.1146 8.3336 117.1278 57.0843 39.4023 175.7213 78 A 4.7043 8.0038 120.7820 51.8514 19.5471 177.9787 79 G 3.8504 8.6114 104.6276 46.9185 0.0000 173.8853 80 A 4.4383 8.8820 120.9622 53.0590 19.8224 177.8929 81 T 4.7939 7.4110 105.0483 58.5001 73.5310 172.7831 82 P 4.2464 0.0000 0.0000 65.9944 31.2384 178.7670 83 F 4.1226 8.2569 118.7595 61.2359 39.4196 176.8224 84 E 3.9660 8.4566 118.3219 59.5621 29.2095 179.2565 85 S 4.3122 8.6517 114.3841 60.7646 62.3117 176.1726 86 A 3.9257 7.7789 123.1923 55.0092 18.1061 179.5499 87 L 3.7943 7.8392 117.7516 57.8359 41.6717 179.7343 88 I 3.3828 7.7314 119.6324 64.4482 37.0182 177.9008 89 D 4.4826 8.1832 119.9668 57.7213 40.6457 179.4077 90 S 4.0976 8.1457 114.6474 61.3025 62.9053 176.5726 91 L 3.7386 7.6814 122.4032 57.4907 41.4261 179.2740 92 A 4.0825 7.8408 120.6953 55.0747 18.2355 179.5502 93 D 4.3081 8.4005 117.4144 57.4840 40.8808 178.5400 94 A 4.0642 8.3006 121.6679 55.5076 18.2531 178.9370 95 Y 3.5114 8.6164 118.2002 61.0950 38.8407 178.5923 96 T 3.5776 7.8713 116.2383 66.5792 68.3227 176.1549 97 D 4.3000 7.8199 119.5790 57.6621 41.2521 178.1206 98 Y 4.1452 7.9838 119.9357 60.7677 38.8083 178.2128 99 R 3.1730 7.6131 118.8891 58.7024 29.8561 178.7658 100 A 3.9747 7.6770 120.6047 55.3722 18.1585 179.5218 101 E 3.9702 7.6268 115.3472 58.6399 29.4592 178.0186 102 M 4.6152 6.7770 112.7779 54.5274 31.5990 176.7933 103 K 3.9288 7.6448 121.2734 60.7470 32.7621 177.7769 104 T 4.2344 7.5098 114.6930 60.2706 65.5823 172.2140 105 Y 4.7120 7.1893 123.4613 55.4874 43.0200 173.1915 *118 D 4.5694 8.4589 122.7924 53.8145 43.0738 177.2560 119 K 3.8855 8.8666 118.3958 59.3222 33.0075 175.8876 120 P 4.3455 0.0000 0.0000 65.5726 31.1159 178.0717 121 K 3.7876 8.2271 118.9823 59.8934 32.0041 178.5737 122 T 3.9444 8.2646 112.2000 64.7312 67.3173 175.3988 123 D 4.6164 8.1201 119.7379 55.7823 41.6505 177.9982 124 V 4.2298 7.4342 110.8653 62.6933 33.3459 177.6700 125 L 3.9319 7.9402 119.8419 58.3012 41.9001 179.0831 126 L 4.0324 7.8816 118.7623 57.2347 41.6338 177.7720 127 P 4.2135 0.0000 0.0000 65.4370 31.3728 178.1861 128 A 4.1189 8.1769 119.9151 55.5199 18.3195 179.9598 129 R 3.9941 8.6793 115.0001 59.3381 29.6060 179.0204 130 T 3.8402 8.1546 110.9683 64.4005 68.7778 176.3206 131 K 3.4832 7.8036 121.9213 59.0718 32.2927 178.5365 132 F 4.2742 8.0902 120.5781 61.4829 39.3709 177.2854 133 L 3.4753 7.9264 118.8902 57.0731 40.8721 179.7039 134 G 3.6098 7.3235 105.3245 47.7445 0.0000 175.4863 135 F 4.7006 7.4350 119.7374 60.5820 38.9805 177.9231 136 I 3.6116 7.4789 119.4087 64.5789 36.7043 178.6403 137 T 3.9273 8.0659 116.7100 66.4978 68.0702 176.7901 138 K 3.9892 7.9596 120.5794 59.4021 31.8093 179.4528 139 F 3.9421 8.1784 116.7397 60.4135 39.4100 177.1031 140 L 4.1746 8.1253 118.6404 58.0529 41.2520 179.9087 141 K 4.1146 8.1889 117.2684 58.5502 32.1035 178.6725 142 K 4.4195 7.6285 116.9017 56.2220 33.1207 175.9074 143 N 4.8900 7.6272 120.0252 51.8753 40.2042 174.7258 144 S 4.3080 8.6893 120.2644 59.4707 63.6910 175.2824 145 S 4.1821 7.9299 116.3907 59.7371 63.1242 175.3374 146 G 3.6999 7.6605 108.3065 44.9121 0.0000 173.4891 147 F 4.9209 7.1523 117.6411 55.8658 40.7725 176.0949 148 L 4.2148 8.9870 122.3897 57.2164 41.5751 178.5423 149 V 4.3763 7.2858 116.6631 61.9340 34.4975 176.2650 150 G 3.9500 8.8399 116.6589 45.2974 0.0000 173.3586 151 D 5.0968 8.7048 122.1448 52.7437 39.7787 175.5607 152 K 4.1633 7.4399 118.7386 54.3370 35.3530 175.5109 153 I 3.1203 7.1318 123.9727 61.2271 38.3178 174.8770 154 S 5.0922 8.8926 120.2362 55.1639 66.4178 174.9666 155 W 4.2640 8.8862 118.4063 59.5535 27.5947 178.8058 156 V 3.2021 6.5467 119.5968 64.1993 30.7457 178.0009 157 D 4.4402 7.7195 119.5467 57.3646 40.6968 178.8271 158 L 3.9605 7.7791 118.7860 57.5919 41.7635 179.2045 159 L 3.8273 7.8350 120.1926 58.1389 42.0534 179.2278 160 V 3.4610 7.7095 117.9488 65.8833 31.4410 177.8223 161 A 4.0777 8.2420 120.7332 55.0935 18.2282 179.1307 162 E 4.0259 8.2792 117.8561 59.7146 29.6173 178.6343 163 H 4.2281 8.1361 117.7126 59.2332 30.0217 177.2915 164 V 3.5630 8.3529 120.2705 65.9903 31.3845 177.5575 165 A 3.9965 8.3448 120.8327 55.3114 18.1075 178.9777 166 D 4.2297 8.1186 116.1554 57.9820 41.3785 178.4395 167 M 3.8886 7.9458 119.2853 58.6648 31.2534 178.9905 168 T 4.4396 7.9283 115.7345 66.3840 68.3604 176.7127 169 N 4.4122 7.9938 118.1366 56.2016 38.5998 177.0628 170 R 4.4825 7.5715 118.0731 57.1265 31.6203 176.8419 171 V 4.3763 8.2400 118.6717 59.6242 31.8521 173.2935 172 P 4.6821 0.0000 0.0000 64.3024 31.7006 177.5532 173 E 4.1948 8.2230 114.2149 57.4957 29.9764 177.6570 174 Y 4.0515 8.4188 121.9633 61.0131 38.8882 176.9927 175 I 4.1878 7.8447 116.6906 61.2448 38.5626 174.7211 176 E 4.3041 7.9763 120.3369 58.3536 29.6269 177.3204 177 G 3.4562 9.5720 112.0304 45.1690 0.0000 173.2406 178 F 4.7988 7.8102 117.8360 54.7174 39.8314 173.9125 179 P 4.3048 0.0000 0.0000 66.0526 31.5945 178.3921 180 E 3.9394 8.1302 117.9105 58.9958 29.4509 179.1964 181 V 3.5749 7.8049 117.8426 65.8861 31.6910 177.6818 182 K 3.9347 8.2141 119.0586 59.6703 31.9578 178.4572 183 A 4.1529 8.2886 121.1230 55.4320 18.1457 179.1580 184 H 4.0096 8.4052 116.7908 59.3979 29.8893 177.0710 185 M 4.0109 8.1719 120.0047 58.8709 32.1791 178.0430 186 E 3.9544 8.2790 118.5761 59.3577 29.4029 179.2882 187 R 3.8462 8.0118 117.9501 59.5359 30.4079 178.4120 188 I 3.9432 7.9135 119.6646 64.4891 37.0362 178.2718 189 Q 4.2098 8.3168 117.0603 57.7662 28.6852 177.4603 190 Q 4.4570 7.6928 117.3664 54.9523 29.6075 175.9436 191 T 3.9209 7.3569 118.8363 63.3474 69.2626 172.7477 192 P 4.2778 0.0000 0.0000 66.2333 31.4239 178.9321 193 R 4.1182 7.9576 115.7570 58.9225 30.0299 179.1651 194 I 3.8447 7.6782 119.4749 64.1174 37.2248 177.7100 195 K 3.8782 8.7538 121.2255 59.6086 31.9196 178.4436 196 K 3.9061 8.4713 119.8482 59.3179 32.1019 178.2420 197 W 4.4667 8.2829 128.5716 60.9403 30.3234 177.9936 198 I 3.3902 8.0413 118.6205 64.2501 36.5727 178.0012 199 E 4.0257 8.3654 119.3245 58.7608 29.3509 178.5084 200 T 4.2867 7.2482 107.8282 61.1137 70.1541 175.3842 201 R 3.2686 6.4778 118.2249 54.6343 29.8196 174.6903 202 P 4.1549 0.0000 0.0000 62.6649 31.8267 175.9525 203 E 4.0923 8.5194 123.6923 56.0853 29.9695 175.9642 204 T 4.7268 7.9859 114.9820 59.2608 71.8690 172.9724 205 P 4.4028 0.0000 0.0000 64.7030 32.1907 176.3268 206 F 4.5649 7.8795 119.1008 56.9267 38.0342 174.3470 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 8.29 4.48 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 2 V 8.30 3.49 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 0.76 0.00 0.00 0.43 0.00 0.00 3 H 10.07 4.83 0.00 3.14 3.13 0.00 5.54 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.45 5.31 0.00 2.86 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 5 K 9.45 5.01 0.00 1.84 1.71 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.44 7.81 6 L 9.41 5.21 0.00 1.91 1.74 1.04 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.80 5.09 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 1.25 0.00 0.00 8 Y 8.32 4.72 0.00 2.96 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 9 F 6.38 5.36 0.00 2.46 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.70 4.65 0.00 2.82 2.82 0.00 0.00 6.75 7.98 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 11 G 7.28 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 0.00 0.00 0.00 12 R 7.34 4.30 0.00 2.04 1.99 0.00 3.42 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.57 0.00 13 G 8.69 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.96 4.14 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 15 G 6.63 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 0.00 0.00 0.00 16 E 7.86 4.06 0.00 2.26 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 2.43 2.49 0.00 17 C 8.06 4.06 0.00 3.06 2.91 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 18 A 7.84 3.67 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 19 R 7.72 3.56 0.00 1.97 1.54 0.00 3.65 0.00 0.00 3.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.96 0.00 20 Q 7.94 3.74 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 21 V 7.67 3.36 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.88 0.00 0.00 22 F 7.59 3.94 0.00 2.64 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 23 A 7.54 3.87 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.75 3.76 0.00 1.36 1.02 -0.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.62 4.30 0.72 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 0.00 0.00 26 D 7.67 4.20 0.00 2.73 2.66 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 27 Q 7.84 4.45 0.00 1.46 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 28 K 8.52 4.19 0.00 1.81 1.69 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.44 7.81 29 Y 7.46 4.82 0.00 2.56 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 9.11 3.98 0.00 2.05 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 2.30 2.25 0.00 31 D 8.34 4.81 0.00 2.23 2.48 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 32 V 8.88 4.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.99 0.00 0.00 33 R 8.69 4.95 0.00 1.77 1.91 0.00 3.31 0.00 0.00 3.46 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 34 L 9.27 4.68 0.00 1.65 1.76 1.10 0.52 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 35 T 8.36 4.79 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 1.29 0.00 0.00 36 Q 8.68 4.20 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.69 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 37 E 8.13 4.04 0.00 2.04 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 0.00 2.36 2.40 0.00 38 T 7.96 4.09 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 1.38 0.00 0.00 39 F 8.42 4.48 0.00 3.46 3.57 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 40 V 7.96 3.55 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 1.00 0.00 0.00 1.12 0.00 0.00 41 P 0.00 4.21 0.00 2.21 2.14 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 42 L 7.73 4.04 0.00 1.81 1.26 1.02 0.81 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 43 K 7.16 3.65 0.00 1.65 1.79 0.00 1.91 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.65 0.54 7.81 44 A 7.61 4.11 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 7.58 3.92 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 0.98 0.00 0.00 46 F 7.15 5.03 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 3.95 0.00 1.39 1.48 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.98 0.00 48 F 7.68 4.92 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.39 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 7.89 4.97 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.63 0.00 51 V 8.01 4.43 1.66 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 -0.08 0.00 0.00 0.48 0.00 0.00 52 P 0.00 5.34 0.00 2.05 1.99 0.00 3.82 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.72 0.00 53 V 7.94 4.73 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 1.07 0.00 0.00 0.87 0.00 0.00 54 L 9.17 5.21 0.00 1.79 1.62 1.29 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.60 5.26 0.00 1.97 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 2.27 2.30 0.00 56 V 8.68 4.56 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 0.99 0.00 0.00 1.12 0.00 0.00 57 D 9.90 4.50 0.00 2.73 2.66 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 58 G 8.38 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 59 Q 7.83 4.49 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 60 Q 8.56 4.79 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 61 L 9.08 4.59 0.00 1.49 1.33 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.78 4.91 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 63 Q 8.42 3.96 0.00 2.33 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 64 S 8.89 4.04 0.00 4.05 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 65 Q 8.05 3.84 0.00 2.17 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.68 2.55 0.00 66 A 7.88 3.90 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 67 I 7.81 3.58 1.91 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.80 0.00 0.00 68 C 7.82 3.70 0.00 2.28 2.49 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 69 R 7.06 2.75 0.00 1.26 1.60 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 70 Y 7.69 3.94 0.00 3.04 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 71 L 7.86 3.46 0.00 1.52 1.35 0.10 0.24 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 72 A 8.02 4.10 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 73 K 7.97 3.87 0.00 1.64 1.71 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.52 7.81 74 T 6.96 3.45 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 75 F 7.41 4.71 0.00 3.01 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 76 G 7.29 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 77 F 8.33 5.11 0.00 3.16 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 78 A 8.00 4.70 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 79 G 8.61 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 80 A 8.88 4.44 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 81 T 7.41 4.79 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 82 P 0.00 4.25 0.00 2.26 2.21 0.00 3.65 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 2.16 2.19 0.00 83 F 8.26 4.12 0.00 3.14 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 84 E 8.46 3.97 0.00 2.28 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 2.42 2.43 0.00 85 S 8.65 4.31 0.00 4.01 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 86 A 7.78 3.93 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 87 L 7.84 3.79 0.00 1.78 1.79 1.06 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 88 I 7.73 3.38 1.96 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 1.33 0.76 0.30 0.00 0.00 89 D 8.18 4.48 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.15 4.10 0.00 3.99 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.68 3.74 0.00 1.56 1.46 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.84 4.08 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.40 4.31 0.00 2.96 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 94 A 8.30 4.06 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 95 Y 8.62 3.51 0.00 3.20 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 7.87 3.58 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 1.22 0.00 0.00 105 Y 7.19 4.71 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *118 D 8.46 4.57 0.00 2.83 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.87 3.89 0.00 1.88 1.83 0.00 1.79 0.00 0.00 1.88 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.64 7.81 120 P 0.00 4.35 0.00 2.55 2.41 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.06 0.00 121 K 8.23 3.79 0.00 2.06 2.10 0.00 1.83 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.42 7.81 122 T 8.26 3.94 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 1.28 0.00 0.00 123 D 8.12 4.62 0.00 2.82 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 0.00 124 V 7.43 4.23 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 0.84 0.00 0.00 1.10 0.00 0.00 125 L 7.94 3.93 0.00 1.65 1.78 0.91 0.54 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 0.00 126 L 7.88 4.03 0.00 1.77 1.71 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.21 0.00 2.18 2.11 0.00 3.70 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.17 0.00 128 A 8.18 4.12 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 R 8.68 3.99 0.00 1.66 2.44 0.00 2.59 0.00 0.00 2.48 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.90 0.00 130 T 8.15 3.84 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 1.33 0.00 0.00 131 K 7.80 3.48 0.00 1.79 2.01 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.09 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.45 1.23 7.81 132 F 8.09 4.27 0.00 2.88 2.58 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 0.00 133 L 7.93 3.48 0.00 0.27 0.52 0.07 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.32 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 0.00 135 F 7.44 4.70 0.00 3.18 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 0.00 136 I 7.48 3.61 1.42 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.26 0.65 0.00 0.00 137 T 8.07 3.93 4.48 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 1.26 0.00 0.00 138 K 7.96 3.99 0.00 2.04 1.82 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.80 7.81 139 F 8.18 3.94 0.00 3.11 3.26 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 0.00 140 L 8.13 4.17 0.00 1.86 1.73 0.92 0.48 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 0.00 141 K 8.19 4.11 0.00 1.78 1.86 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.25 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.55 7.81 142 K 7.63 4.42 0.00 1.80 1.85 0.00 1.36 0.00 0.00 1.26 0.00 0.00 2.73 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.65 1.37 7.81 143 N 7.63 4.89 0.00 2.88 2.75 0.00 0.00 6.88 6.96 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 0.00 144 S 8.69 4.31 0.00 4.02 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 0.00 145 S 7.93 4.18 0.00 4.18 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 G 7.66 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 0.00 147 F 7.15 4.92 0.00 3.30 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.99 4.21 0.00 1.66 1.61 0.78 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 149 V 7.29 4.38 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 0.92 0.00 0.00 0.96 0.00 0.00 150 G 8.84 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 0.00 151 D 8.70 5.10 0.00 2.85 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 0.00 152 K 7.44 4.16 0.00 1.61 1.56 0.00 1.79 0.00 0.00 1.61 0.00 0.00 3.15 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.26 1.36 7.81 153 I 7.13 3.12 1.51 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.68 0.00 0.00 154 S 8.89 5.09 0.00 4.04 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 0.00 155 W 8.89 4.26 0.00 3.63 3.35 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 0.00 156 V 6.55 3.20 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.57 0.00 0.00 157 D 7.72 4.44 0.00 2.86 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 0.00 158 L 7.78 3.96 0.00 1.93 1.71 0.83 0.48 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 0.00 159 L 7.83 3.83 0.00 1.87 1.59 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 160 V 7.71 3.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.85 0.00 0.00 161 A 8.24 4.08 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 0.00 162 E 8.28 4.03 0.00 2.23 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 2.38 2.44 0.00 163 H 8.14 4.23 0.00 3.50 3.63 0.00 5.84 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 V 8.35 3.56 2.24 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 1.12 0.00 0.00 1.16 0.00 0.00 165 A 8.34 4.00 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 0.00 166 D 8.12 4.23 0.00 2.95 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 0.00 167 M 7.95 3.89 0.00 0.80 0.81 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.20 0.00 168 T 7.93 4.44 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 1.29 0.00 0.00 169 N 7.99 4.41 0.00 2.95 2.90 0.00 0.00 7.02 7.65 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 0.00 170 R 7.57 4.48 0.00 1.99 2.16 0.00 3.26 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 171 V 8.24 4.38 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 0.94 0.00 0.00 0.89 0.00 0.00 172 P 0.00 4.68 0.00 2.11 2.16 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 173 E 8.22 4.19 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 174 Y 8.42 4.05 0.00 3.02 3.12 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 0.00 175 I 7.84 4.19 2.03 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 1.52 1.32 0.98 0.00 0.00 176 E 7.98 4.30 0.00 2.09 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 2.35 2.39 0.00 177 G 9.57 3.46 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 0.00 0.00 0.00 178 F 7.81 4.80 0.00 3.19 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.30 0.00 2.24 2.28 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 180 E 8.13 3.94 0.00 2.10 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 0.00 2.40 2.42 0.00 181 V 7.80 3.57 2.29 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 1.04 0.00 0.00 0.87 0.00 0.00 182 K 8.21 3.93 0.00 1.94 1.97 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.52 7.81 183 A 8.29 4.15 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 0.00 184 H 8.41 4.01 0.00 3.27 3.55 0.00 5.60 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 0.00 185 M 8.17 4.01 0.00 2.33 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.77 0.00 186 E 8.28 3.95 0.00 2.19 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 2.34 2.41 0.00 187 R 8.01 3.85 0.00 1.77 2.04 0.00 3.25 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.63 0.00 188 I 7.91 3.94 1.83 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.57 0.91 0.00 0.00 189 Q 8.32 4.21 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 190 Q 7.69 4.46 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 191 T 7.36 3.92 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 1.21 0.00 0.00 192 P 0.00 4.28 0.00 2.17 2.15 0.00 3.62 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 193 R 7.96 4.12 0.00 1.82 2.13 0.00 3.30 0.00 0.00 3.35 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 194 I 7.68 3.84 2.13 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 1.48 0.76 0.98 0.00 0.00 195 K 8.75 3.88 0.00 1.86 2.03 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.48 7.81 196 K 8.47 3.91 0.00 2.02 1.88 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.48 7.81 197 W 8.28 4.47 0.00 3.48 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 0.00 198 I 8.04 3.39 2.02 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 1.54 0.95 0.85 0.00 0.00 199 E 8.37 4.03 0.00 2.09 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 2.31 2.38 0.00 200 T 7.25 4.29 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 201 R 6.48 3.27 0.00 0.72 0.66 0.00 2.74 0.00 0.00 2.96 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.40 0.00 202 P 0.00 4.15 0.00 2.01 2.00 0.00 3.58 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 203 E 8.52 4.09 0.00 1.87 1.82 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 2.24 2.23 0.00 204 T 7.99 4.73 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 1.15 0.00 0.00 205 P 0.00 4.40 0.00 2.30 2.28 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.05 0.00 206 F 7.88 4.56 0.00 3.26 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 * Residues marked with a * may have inaccurate shift predictions.