NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5704 8.2893 120.3309 55.4466 33.7921 174.2871 2 I 4.5598 7.7094 113.7152 58.1098 41.1589 171.8116 3 P 4.5899 0.0000 0.0000 63.0567 32.7512 176.9459 4 V 4.6379 8.2669 115.4580 59.6338 35.5437 175.1924 5 V 4.4227 8.1711 120.9639 61.6952 34.7593 175.2878 6 I 4.4910 8.4556 128.6039 60.3414 39.3055 174.5132 7 E 4.5831 8.4010 121.7348 55.2753 31.0218 176.4732 8 Q 4.3157 8.3815 118.7174 57.1415 29.6112 176.5010 *14 R 4.3994 7.3558 119.2926 56.1397 31.0148 179.1979 15 S 4.5337 8.7292 123.8276 58.5064 63.9137 173.7720 16 Y 4.5780 8.4077 122.8762 56.4945 37.0025 174.5509 17 D 4.8250 7.8846 125.5728 50.6912 41.5887 177.8866 18 I 3.4285 7.6780 117.7515 64.1432 37.5675 177.2967 19 Y 4.2125 7.2036 117.2353 60.8224 37.3271 177.8970 20 S 4.3119 8.1196 115.7405 61.2625 62.6587 176.8262 21 R 3.7188 7.4171 119.9223 58.8530 30.1872 178.4288 22 L 4.1128 7.6536 118.7991 57.6204 41.6371 179.0683 23 L 4.1727 8.0607 120.3622 58.1746 41.6608 178.9221 24 K 4.1329 7.7307 118.1654 59.2031 30.7376 177.1649 25 D 4.8422 8.2472 118.1637 53.8685 41.2929 177.0419 26 R 4.1025 7.8749 116.4018 57.2877 28.2979 175.2896 27 I 5.0401 7.3502 118.4277 60.6600 38.1343 175.3075 28 I 4.5786 8.5686 131.3018 59.6672 40.9637 174.1497 *30 L 4.4013 8.3586 125.8162 56.1953 42.9904 177.2628 31 T 5.5073 7.4706 114.4525 59.9812 71.9785 174.6573 32 G 3.9119 8.5602 111.9421 43.8744 0.0000 171.4440 33 P 4.5540 0.0000 0.0000 62.3916 32.3149 176.9827 34 V 4.0326 8.7832 123.9732 62.5674 32.2801 174.8315 35 E 5.0440 8.4679 124.8216 54.7375 32.9475 175.2647 36 D 4.4671 8.7922 118.7409 57.7777 41.1289 179.2230 37 N 4.1597 8.4470 112.3311 54.2277 37.9719 176.5164 *39 A 4.3196 7.9850 123.9667 52.2871 20.6894 179.6180 40 N 4.3858 8.2052 113.5307 56.1524 38.5503 177.5220 41 S 4.0603 8.0422 114.7383 61.4078 62.4636 176.5165 42 V 3.5947 7.6947 120.2831 66.1105 31.3644 177.8811 43 I 3.7337 8.1472 119.7157 64.4045 37.0655 178.3285 44 A 4.0619 8.3512 121.7804 55.1687 18.1491 179.7948 45 Q 4.1250 8.0929 116.8191 59.0229 28.8954 178.7717 46 L 4.0624 8.1902 120.0810 57.9523 41.8556 179.6259 47 L 4.1314 8.2572 118.9837 57.5204 41.4035 179.4296 48 F 4.3374 8.2369 120.3054 61.4841 39.4795 177.1795 49 L 3.6376 8.0783 118.5605 57.7294 41.1714 179.1699 50 D 4.2287 7.8452 116.7144 57.2506 41.2635 177.8601 51 A 4.0946 7.6660 119.9828 55.0673 18.3610 179.3387 52 Q 4.1806 7.3469 115.7018 57.6305 28.9586 176.3013 53 D 4.2283 7.4889 117.7879 53.9071 43.2614 174.6115 54 S 4.5385 8.6068 121.4661 58.5359 63.3422 175.0653 55 T 4.4987 7.7947 109.4007 61.4918 69.0763 173.9505 56 K 4.6274 7.5314 121.7220 54.5279 34.1730 175.9012 57 D 4.6283 8.7904 124.3639 54.7561 41.8184 175.6192 58 I 4.3753 8.2974 120.2526 59.6815 41.1167 174.7053 59 Y 4.7190 8.7671 123.1858 56.3867 40.3538 174.7449 60 L 4.9883 8.8457 128.8255 53.7101 43.3620 174.8657 61 Y 4.7910 9.0148 125.5106 57.4450 38.9409 175.5592 62 V 4.5553 9.0307 123.8265 61.2023 34.8336 174.0931 63 N 5.0702 9.0965 127.4516 53.2390 41.4363 172.6045 64 T 4.9447 8.1606 119.7738 60.2290 70.4334 172.6514 65 P 4.3641 0.0000 0.0000 63.9784 32.3824 174.7091 66 G 3.8213 7.9753 104.3837 44.8929 0.0000 171.5482 67 G 3.7156 8.5846 108.1240 44.4988 0.0000 173.0210 68 S 4.0216 8.5036 119.1895 58.7827 63.0125 175.9008 69 V 3.5185 8.6026 127.2941 66.0855 31.5048 177.4644 70 S 4.0472 8.1461 112.1790 61.6461 62.1354 176.0009 71 A 4.1018 7.9420 122.8300 55.0769 18.1474 179.8065 72 G 3.5597 8.2617 104.3616 48.0193 0.0000 175.9711 73 L 4.0817 8.4516 121.4415 57.1593 41.5620 179.4454 74 A 3.9776 7.8276 120.6729 55.0306 18.0709 179.6838 75 I 3.6394 7.5009 117.3959 64.4803 37.2828 178.5157 76 V 3.7576 7.5951 117.5811 66.2802 31.6810 177.5165 77 D 4.5976 8.4028 118.8462 57.4022 40.7208 179.4074 78 T 4.3433 7.8595 115.5682 63.9163 68.2580 176.0928 *80 N 4.7156 8.1727 120.2818 53.4026 40.8122 176.1674 81 F 4.4279 8.5957 119.9897 60.9892 39.6276 175.7836 82 I 3.6281 7.3694 112.9629 60.5491 37.8231 176.4224 83 K 3.9608 8.4431 122.2862 58.9872 32.3330 177.6977 84 A 4.3284 7.6248 120.4690 51.3406 18.8934 177.4960 85 D 4.4025 8.6978 121.9386 54.2676 42.7427 175.7554 86 V 4.5067 8.1909 122.5232 61.0419 33.1782 174.7138 87 Q 4.8699 8.8874 128.2521 56.1210 30.1479 175.6951 88 T 5.1758 8.7354 111.1727 60.1003 72.6396 172.8980 89 I 5.0944 8.3733 123.9800 59.8004 40.7062 175.5652 90 V 4.6453 8.2610 127.9747 61.7186 32.7881 176.0676 *92 G 3.9814 8.6253 108.4109 45.8660 0.0000 172.7892 *94 A 4.7346 7.7238 122.0846 51.2516 20.0632 175.2274 95 A 4.3980 8.0318 123.4470 51.3970 22.0008 176.8458 96 S 3.5902 8.6011 118.9378 60.4710 62.6765 174.8386 *98 G 3.7900 7.8600 106.9510 45.6891 0.0000 175.0014 99 T 3.4106 7.5493 111.9641 63.9246 68.4062 176.7800 100 V 3.5352 7.4606 119.7829 65.6532 31.7422 177.7801 101 I 3.8526 7.5906 118.7727 64.3518 37.2962 178.0691 102 A 4.0821 8.2331 122.1215 55.1996 18.1103 179.5627 103 S 4.5548 8.1784 109.8395 60.5440 63.3898 174.9604 104 S 4.5880 7.7907 117.1722 58.6131 62.5879 174.4866 105 G 3.8789 7.8509 107.9669 45.6402 0.0000 173.7317 106 A 4.0251 8.5529 122.8049 51.5915 19.2844 177.1898 107 K 4.1513 8.6242 124.5189 57.9379 32.4303 177.0436 108 G 4.0475 9.8097 116.1213 45.2121 0.0000 173.6376 109 K 4.4974 7.9850 119.3931 56.2596 33.5251 175.4979 110 R 5.0107 7.7372 117.5805 54.7756 32.8504 175.4216 111 F 5.4043 8.9816 124.0085 54.7624 43.3435 173.8898 *113 L 4.4848 8.3432 117.5593 54.6690 42.6059 176.8538 114 P 4.3164 0.0000 0.0000 65.2706 31.4905 176.8599 115 N 4.7418 8.0149 113.3304 52.6430 39.0877 174.5223 116 A 4.5322 7.6193 120.2680 52.2712 19.2015 176.9926 117 E 4.9814 8.8195 117.8392 54.9726 33.4569 174.4136 118 Y 5.6687 8.8513 121.6758 54.9440 42.7987 175.5124 *120 I 3.7596 8.3719 111.9821 59.9810 39.3242 175.4144 121 H 4.1324 7.8611 120.1266 56.1301 29.7802 174.1114 122 Q 4.2989 8.0846 125.4811 53.1271 29.3076 173.4023 123 P 4.0781 0.0000 0.0000 62.0414 32.3913 176.5898 *139 A 4.0864 8.3321 121.6336 51.5468 20.1453 176.2617 140 P 4.2922 0.0000 0.0000 65.4188 31.5560 178.8267 141 E 4.0095 8.1185 117.4974 59.5230 29.4561 178.4761 142 H 4.3544 8.1557 117.8554 58.8577 30.0514 177.2114 143 L 3.9285 7.6907 120.8152 57.6294 41.4683 179.2923 144 L 3.9690 7.8947 118.9997 57.6312 41.4473 179.5340 145 K 3.9452 7.9030 119.6313 59.7774 32.2392 179.0510 146 T 3.9231 7.8890 110.0285 64.5862 68.7339 176.6649 147 R 3.8883 7.8628 121.6851 59.2293 29.9739 178.1946 148 N 4.3747 8.3044 116.4823 56.5115 38.4703 177.4760 149 T 3.8716 7.6583 116.9277 66.5998 68.4742 176.7761 150 L 3.9938 7.8602 120.7724 57.9152 41.6805 179.4665 151 E 4.0168 8.3202 118.5616 58.9515 29.2874 179.3616 152 K 3.9445 8.4020 120.1974 59.6820 32.3688 178.9455 153 I 3.7456 7.9332 120.1032 64.3639 36.8390 178.4454 154 L 4.2079 8.2252 119.7893 57.7928 41.4506 179.4458 155 A 4.1492 8.1916 120.7383 55.2418 18.1287 179.3625 156 E 3.9449 8.1901 116.0827 59.9168 29.6599 179.2539 157 N 4.5767 8.3402 115.2233 55.3161 38.4033 176.7011 158 S 4.5721 7.3859 116.4305 56.6925 63.7997 175.9507 159 G 3.8786 7.7124 108.7610 45.7073 0.0000 172.9597 160 Q 4.6663 7.2725 117.9174 53.5313 32.0576 177.7239 161 S 4.6150 7.8405 120.8942 58.3355 62.6714 176.0067 *163 E 4.2175 8.9002 115.8934 55.9398 31.1217 177.6875 164 K 4.0461 7.8706 118.8042 59.2404 32.1702 178.8717 165 V 3.9145 8.1815 120.3973 65.8222 31.1432 177.5228 166 H 4.3665 8.3361 117.2069 59.1350 29.5248 176.9375 167 A 4.0286 7.8901 121.7852 55.3896 18.2373 179.0930 168 D 4.4856 8.3663 117.0104 57.0550 40.8559 178.7993 169 A 4.0579 8.1697 121.3147 54.4158 18.1359 178.3299 170 E 4.2933 7.4858 114.1047 56.1024 29.7957 176.1382 171 R 4.6831 6.9343 115.2207 55.0888 33.8357 174.9077 172 D 4.7175 8.2943 118.1351 53.7788 41.2665 176.5137 173 N 4.8434 7.7118 115.9949 51.1957 39.3325 175.8428 174 W 4.7482 8.6770 122.3697 55.4159 31.3240 175.8607 *176 S 4.3389 8.3135 113.1363 58.8338 64.8468 174.0654 177 A 4.0321 8.4642 123.6115 55.4205 17.9663 179.8941 178 Q 3.9058 8.0274 117.5742 59.5061 29.2826 178.0882 179 E 4.0804 8.0644 119.4418 59.7213 29.5017 179.5658 180 T 3.9405 8.0663 115.9749 66.3064 68.2432 176.7363 181 L 3.9251 7.7493 121.5386 58.1859 42.2254 178.5486 182 E 4.0751 7.9696 117.5561 59.5535 29.7978 178.4238 183 Y 3.8328 8.2407 119.8499 59.5290 38.6062 177.1742 184 G 4.1740 7.8175 105.4116 45.9142 0.0000 175.4041 185 F 4.3646 7.8533 118.6042 59.2155 39.1530 174.9198 186 I 4.5536 7.4552 111.6838 59.0782 40.1704 174.4101 187 D 4.7638 8.6004 119.3328 54.9501 42.8634 176.9943 188 E 4.7792 7.3963 116.3066 55.2323 34.1373 174.5375 189 I 4.3606 8.0294 125.7279 60.8817 37.6449 175.0697 *191 A 4.0128 8.2373 127.6463 52.9279 19.4539 176.0907 192 N 4.5862 8.5598 118.8007 53.0972 38.4663 174.4184 193 N 4.7797 8.6198 122.4304 53.5848 38.9014 175.6001 194 S 4.6595 8.2890 114.1270 58.4620 62.9664 174.3658 195 L 4.3252 7.7821 126.3569 54.9184 41.7516 176.3485 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 4.57 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 2 I 7.71 4.56 1.85 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.92 0.00 0.00 3 P 0.00 4.59 0.00 2.01 1.96 0.00 3.36 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 4 V 8.27 4.64 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 0.72 0.00 0.00 0.93 0.00 0.00 5 V 8.17 4.42 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 1.06 0.00 0.00 0.96 0.00 0.00 6 I 8.46 4.49 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.98 0.92 0.00 0.00 7 E 8.40 4.58 0.00 1.89 1.81 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 2.17 2.24 0.00 8 Q 8.38 4.32 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 *14 R 7.36 4.40 0.00 1.83 1.06 0.00 3.26 0.00 0.00 3.29 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 15 S 8.73 4.53 0.00 4.03 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 16 Y 8.41 4.58 0.00 3.07 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 17 D 7.88 4.82 0.00 3.08 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 18 I 7.68 3.43 1.55 0.00 0.00 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 1.23 0.87 0.03 0.00 0.00 19 Y 7.20 4.21 0.00 3.08 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 20 S 8.12 4.31 0.00 3.83 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 21 R 7.42 3.72 0.00 1.66 1.76 0.00 2.89 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.29 0.00 22 L 7.65 4.11 0.00 1.82 1.73 0.84 0.79 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 23 L 8.06 4.17 0.00 2.03 2.00 1.16 0.53 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 24 K 7.73 4.13 0.00 1.99 2.07 0.00 2.06 0.00 0.00 1.86 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.60 7.81 25 D 8.25 4.84 0.00 2.90 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 26 R 7.87 4.10 0.00 2.30 2.08 0.00 3.14 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 27 I 7.35 5.04 2.10 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 1.46 0.83 1.03 0.00 0.00 28 I 8.57 4.58 1.99 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 1.37 0.82 0.98 0.00 0.00 *30 L 8.36 4.40 0.00 1.79 1.84 0.94 0.59 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 31 T 7.47 5.51 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 1.22 0.00 0.00 32 G 8.56 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 0.00 0.00 0.00 33 P 0.00 4.55 0.00 1.94 1.99 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 34 V 8.78 4.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.91 0.00 0.00 35 E 8.47 5.04 0.00 1.91 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 2.15 2.54 0.00 36 D 8.79 4.47 0.00 2.75 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 37 N 8.45 4.16 0.00 2.93 2.81 0.00 0.00 6.88 7.33 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 *39 A 7.98 4.32 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 40 N 8.21 4.39 0.00 3.07 2.87 0.00 0.00 6.54 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 41 S 8.04 4.06 0.00 3.90 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 42 V 7.69 3.59 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 1.05 0.00 0.00 0.94 0.00 0.00 43 I 8.15 3.73 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 1.48 0.48 0.94 0.00 0.00 44 A 8.35 4.06 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 45 Q 8.09 4.13 0.00 2.41 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 46 L 8.19 4.06 0.00 1.93 1.77 0.97 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.26 4.13 0.00 1.79 1.82 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.24 4.34 0.00 3.23 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 0.00 49 L 8.08 3.64 0.00 1.74 1.66 1.01 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 50 D 7.85 4.23 0.00 2.76 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 51 A 7.67 4.09 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.35 4.18 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.61 0.00 0.00 0.00 0.00 0.00 1.93 1.42 0.00 53 D 7.49 4.23 0.00 2.56 2.47 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 54 S 8.61 4.54 0.00 4.03 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.79 4.50 4.22 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 1.18 0.00 0.00 56 K 7.53 4.63 0.00 1.60 1.74 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.65 7.81 57 D 8.79 4.63 0.00 2.27 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 0.00 0.00 0.00 58 I 8.30 4.38 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 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0.00 0.00 1.44 1.46 7.81 146 T 7.89 3.92 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 147 R 7.86 3.89 0.00 2.05 2.05 0.00 3.09 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 148 N 8.30 4.37 0.00 2.98 2.85 0.00 0.00 6.98 6.48 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 0.00 149 T 7.66 3.87 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 1.21 0.00 0.00 150 L 7.86 3.99 0.00 1.82 1.67 0.90 0.91 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 0.00 151 E 8.32 4.02 0.00 2.06 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 2.37 2.47 0.00 152 K 8.40 3.94 0.00 1.89 2.01 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.50 7.81 153 I 7.93 3.75 2.03 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 1.55 0.86 0.95 0.00 0.00 154 L 8.23 4.21 0.00 1.99 2.04 0.87 0.43 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 0.00 155 A 8.19 4.15 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 0.00 156 E 8.19 3.94 0.00 2.12 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 2.37 2.67 0.00 157 N 8.34 4.58 0.00 3.09 3.15 0.00 0.00 6.99 6.85 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 0.00 158 S 7.39 4.57 0.00 3.72 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 0.00 159 G 7.71 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 0.00 0.00 0.00 160 Q 7.27 4.67 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.04 1.76 0.00 161 S 7.84 4.62 0.00 4.00 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 *163 E 8.90 4.22 0.00 2.06 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 2.32 0.00 164 K 7.87 4.05 0.00 1.87 1.91 0.00 1.59 0.00 0.00 1.38 0.00 0.00 2.75 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.63 1.43 7.81 165 V 8.18 3.91 2.21 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 1.27 0.00 0.00 1.20 0.00 0.00 166 H 8.34 4.37 0.00 3.31 3.53 0.00 5.92 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 0.00 167 A 7.89 4.03 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 0.00 168 D 8.37 4.49 0.00 2.88 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 0.00 169 A 8.17 4.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 E 7.49 4.29 0.00 2.10 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 2.28 2.27 0.00 171 R 6.93 4.68 0.00 1.75 1.73 0.00 3.19 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 172 D 8.29 4.72 0.00 2.55 2.54 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 0.00 173 N 7.71 4.84 0.00 2.85 2.82 0.00 0.00 6.35 8.88 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 0.00 174 W 8.68 4.75 0.00 3.30 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *176 S 8.31 4.34 0.00 4.12 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 0.00 177 A 8.46 4.03 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 0.00 178 Q 8.03 3.91 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 179 E 8.06 4.08 0.00 2.23 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 0.00 2.40 2.41 0.00 180 T 8.07 3.94 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 0.40 0.00 0.00 181 L 7.75 3.93 0.00 1.62 1.91 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 182 E 7.97 4.08 0.00 2.26 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 2.34 2.31 0.00 183 Y 8.24 3.83 0.00 3.33 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 0.00 184 G 7.82 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 F 7.85 4.36 0.00 2.71 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 0.00 186 I 7.46 4.55 1.93 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.61 0.84 0.00 0.00 187 D 8.60 4.76 0.00 2.39 2.54 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 0.00 188 E 7.40 4.78 0.00 2.05 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 2.29 2.21 0.00 189 I 8.03 4.36 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.53 0.96 0.00 0.00 *191 A 8.24 4.01 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 0.00 192 N 8.56 4.59 0.00 2.71 2.78 0.00 0.00 6.99 7.79 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 0.00 193 N 8.62 4.78 0.00 2.75 2.82 0.00 0.00 7.16 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 0.00 194 S 8.29 4.66 0.00 3.87 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 0.00 195 L 7.78 4.33 0.00 1.61 1.54 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.