NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.4130 7.8676 121.0491 61.2654 39.8523 174.3137 17 S 4.5158 8.9441 121.9783 55.6649 66.2358 172.0355 18 G 3.3817 8.4020 110.1623 47.0762 0.0000 174.7755 19 G 3.8255 8.9992 112.7818 45.2923 0.0000 172.9521 *29 D 4.6301 8.0646 117.5568 53.7306 42.5869 175.0929 30 A 4.5772 8.4872 122.8551 52.1316 19.3857 177.0173 31 I 4.9005 8.3698 113.3419 59.4054 41.5808 173.6824 32 Y 5.5009 9.6507 122.4374 56.6201 41.1499 175.2774 33 S 4.5930 8.5851 119.3016 56.2961 65.2259 173.9462 34 S 4.1760 8.4055 112.9081 61.4115 63.3676 176.1231 *39 T 4.2965 7.4329 109.5869 61.1523 70.8031 173.2967 40 G 3.9909 7.6822 111.6650 44.6324 0.0000 171.0885 41 R 4.9894 8.6570 121.3750 55.0902 33.0233 177.0180 42 C 5.1394 9.1801 122.1676 55.7730 44.6887 172.7013 43 S 5.2010 8.4786 114.5439 57.0016 66.2073 174.1136 44 L 3.3430 8.6638 125.5968 55.3704 42.6225 176.4050 45 G 3.9034 9.3927 115.3142 48.0590 0.0000 172.6749 46 F 5.1531 7.8710 115.8062 54.8293 44.3865 173.4134 47 N 5.3655 8.9116 119.6680 53.2744 39.4284 174.7965 48 V 5.2336 9.5242 116.3187 60.0640 36.9386 174.2773 48A R 5.2009 9.0320 116.7875 55.2690 33.3963 174.2981 48B S 4.4249 8.8890 114.7837 56.2443 65.4350 174.5732 48C G 4.0508 8.9589 118.8947 47.1614 0.0000 173.6394 48D S 4.3823 8.8237 118.1504 57.6977 63.2788 173.2719 49 T 4.2237 7.9841 119.9601 62.7915 69.2943 173.1370 50 Y 5.1223 8.1939 124.0023 57.1114 40.4856 174.3546 51 Y 5.3178 9.4696 119.9074 56.8265 43.5197 173.5648 52 F 5.5836 8.5284 113.8549 55.5997 41.6052 174.0712 53 L 5.0566 9.0368 120.8301 54.5920 44.2326 175.6626 54 T 4.5453 8.2015 114.2428 61.4758 71.5574 172.3704 55 A 4.2513 8.4866 124.4316 51.7825 19.2855 179.0522 56 G 3.7079 8.8178 110.5801 48.7998 0.0000 175.5914 57 H 3.6844 7.9500 115.0616 57.5441 28.3027 176.4648 58 C 4.5723 7.4038 118.9843 59.6161 35.9524 175.4746 59 T 4.4031 7.8509 110.3885 62.7779 68.7898 173.7733 60 D 4.2926 7.9636 122.9007 54.7106 41.2648 176.6354 58 G 3.9823 7.4138 109.1843 46.5161 0.0000 175.7746 59 A 4.3731 7.9409 120.5885 53.4779 18.0898 176.8733 60 T 4.0026 7.7736 116.1006 62.3106 69.9648 175.0354 65 T 4.6796 7.3916 119.1236 60.6794 70.6820 173.6246 66 W 4.8791 8.2518 123.6645 54.6826 32.9554 174.6051 67 W 5.4515 9.8552 122.7257 54.9926 32.4714 176.1617 68 A 4.4080 9.5600 123.5175 53.8726 19.3637 177.3737 *78 N 5.0779 8.2671 111.9567 52.3589 38.4035 175.6803 79 S 2.9268 7.8670 113.1453 60.6483 63.1182 175.2990 80 A 3.8810 7.6004 122.0712 52.4407 18.5697 176.9038 81 R 3.2861 7.3056 114.1323 57.3471 27.7756 177.1365 82 T 4.3108 8.1652 107.2262 62.0117 70.7959 174.1149 83 T 4.6225 8.4830 119.8732 61.7172 70.0713 174.4044 84 V 3.9842 8.6324 126.8920 63.1105 32.3575 174.7118 85 L 4.6626 8.9002 125.2867 54.7139 43.8027 176.9243 86 G 4.2772 7.0882 104.1133 45.5890 0.0000 171.1397 87 T 5.8320 7.4880 108.5238 59.7888 72.3547 173.6996 88 T 4.2382 8.8019 120.2662 64.8859 68.4019 173.9369 89 S 4.6502 8.7750 121.7020 58.7086 65.1356 174.4957 90 G 4.1170 7.6176 103.9835 45.6295 0.0000 172.5874 91 S 4.7567 8.2467 116.2244 56.8861 66.4068 172.7708 *93 S 4.4734 8.6896 120.7862 58.9158 63.1948 171.8872 94 F 5.3109 8.5841 124.5363 57.5755 42.4104 172.0730 *99A P 3.1746 0.0000 0.0000 64.1069 31.7970 174.5827 100 N 4.9775 8.6616 117.0057 53.6281 37.6617 174.1020 101 N 5.2016 7.3799 112.9537 51.5615 42.3938 173.2176 102 D 5.5211 8.7876 116.1125 53.4716 41.0152 174.0739 103 Y 5.2839 8.4473 118.2981 55.7398 42.1009 175.6109 104 G 4.8542 9.2095 106.5927 45.5075 0.0000 171.4673 105 I 4.9429 8.7314 119.9735 58.9103 42.0653 173.9608 106 V 4.4579 7.8999 127.5671 60.8017 34.4329 174.1384 107 R 4.4195 8.6876 128.9666 55.5654 31.2709 175.0609 108 Y 4.8098 8.4483 125.3336 58.4703 38.3389 176.0767 109 T 4.4277 9.2869 112.6627 61.1181 70.4679 173.0489 110 N 4.8004 8.2794 121.8464 52.9819 39.0691 174.5510 111 T 4.1720 8.5391 116.4417 63.1595 69.6930 175.4741 112 T 4.2432 7.9063 111.0179 62.4745 70.2230 175.2266 113 I 3.6767 7.8418 122.0492 60.2680 38.3967 173.6673 114 P 4.3172 0.0000 0.0000 62.6819 31.9407 176.9867 115 K 4.4362 7.8728 121.5892 54.2568 31.7504 174.7945 116 D 4.4597 8.3453 121.0712 54.2914 42.0873 177.7329 117 G 3.5111 8.4707 114.5926 45.2200 0.0000 171.7768 118 T 4.8657 7.2055 108.1789 59.8152 72.6338 173.0520 119 V 4.3546 8.0827 120.7883 61.4364 32.8699 176.0784 120 G 3.8837 8.0250 120.2832 46.9392 0.0000 174.6282 121 G 3.7215 8.7092 113.6637 45.6657 0.0000 172.8336 122 Q 4.0588 8.1578 123.4379 55.1795 29.2124 174.7729 123 D 4.6665 8.5608 125.3920 54.2384 42.0109 174.9030 124 I 4.8121 7.9363 125.9640 59.8671 39.0646 175.4402 125 T 4.6764 9.0408 116.3458 61.6279 70.7472 173.3892 126 S 4.5981 7.5960 115.3608 57.9071 66.2067 173.1940 127 A 5.2103 8.4338 120.6118 50.3932 21.5750 175.1034 128 A 4.6310 8.5153 120.2098 50.8423 22.9456 175.6892 129 N 4.6246 8.5569 116.1984 52.0333 39.8321 175.7913 130 A 4.2706 8.3279 124.8490 52.3416 19.5069 177.0100 131 T 4.6941 7.9468 108.9377 59.2345 72.0190 173.7212 132 V 3.7885 8.2619 123.2881 64.6828 31.8679 176.4459 133 G 3.9546 8.9356 116.1459 45.0793 0.0000 173.2850 134 M 4.2025 7.8823 120.7285 55.4615 33.4354 174.9294 135 A 4.6578 8.4811 127.8861 51.7027 19.6484 176.8234 136 V 4.5716 8.8529 115.4369 59.8742 36.6925 174.7420 137 T 4.8424 8.4264 117.3103 61.8845 72.8093 173.3216 138 R 5.6716 9.0163 125.0936 53.6465 33.2851 174.1080 139 R 5.1220 8.7029 124.3037 54.6753 33.3192 174.1349 140 G 4.3293 8.8878 112.2476 44.5156 0.0000 172.9633 141 S 4.3755 9.1124 115.4820 60.5701 63.8740 175.9190 142 T 4.2237 8.2330 118.0167 65.7667 68.9544 176.3265 143 T 4.3955 8.1735 109.4868 62.2096 70.7055 174.4199 *156 G 4.3178 7.4050 108.9875 46.9944 0.0000 172.6192 157 T 5.3453 8.5688 121.7474 62.4518 70.0550 174.0065 158 H 4.9566 9.3342 122.8320 54.1714 33.3007 172.7225 159 S 5.0088 8.3579 116.5468 56.9173 66.2689 174.2529 160 G 3.9895 7.8362 106.8070 46.2871 0.0000 172.3525 161 S 5.0971 8.4321 115.6465 56.6138 68.0959 173.6885 162 V 4.2414 8.6352 122.8638 63.1963 31.7577 176.4404 163 T 4.4799 8.7047 117.6467 62.0119 70.4304 174.0061 164 A 4.5270 7.4140 121.5181 51.3837 22.3869 174.8333 165 L 4.9863 8.4070 118.3975 52.4327 45.7205 175.3638 166 N 4.1260 8.7302 114.9117 54.6500 37.5291 173.8380 167 A 4.5184 8.2981 117.7558 51.6161 20.6947 177.4614 168 T 4.6774 8.3041 116.9329 61.8347 70.5307 174.2603 169 V 3.6983 8.1805 126.5633 60.7334 34.1395 173.6330 170 N 4.7614 8.2538 127.0471 52.2483 39.2868 173.8289 171 Y 4.3692 8.6620 124.2578 57.8149 38.5426 177.2049 172 G 3.9584 8.6177 106.5089 46.0387 0.0000 173.8054 173 G 4.0482 9.5083 104.2394 46.3163 0.0000 175.0956 174 G 3.9111 8.4913 106.8468 44.8926 0.0000 174.8636 175 D 4.4877 7.9329 121.1577 52.8499 40.0983 174.0753 176 V 4.4371 7.6203 121.5378 60.7237 34.3490 174.1829 177 V 4.6515 8.2345 120.6425 59.6998 34.7546 174.3113 178 Y 4.8220 8.6316 121.2415 56.3469 41.4772 175.3150 179 G 3.9865 8.8155 106.4871 47.0828 0.0000 173.8697 180 M 4.7060 8.0866 118.7372 54.6097 33.9178 175.6233 181 I 4.5757 9.0365 123.3197 60.6934 38.9145 174.8553 182 R 4.6831 9.1598 128.6424 55.2789 31.5907 175.1362 183 T 5.0685 8.2894 114.5796 60.0913 73.3179 173.2243 184 N 4.6607 8.3454 115.7899 52.8613 38.4314 174.4566 *190 V 4.4060 8.0357 117.8014 63.7851 32.5394 174.0079 191 C 4.6323 8.7265 121.0752 54.8731 43.1853 172.2489 192 A 4.7158 7.7011 120.0344 51.6104 21.3435 175.3726 192A E 4.7486 9.3819 119.4101 53.3665 33.7408 173.6442 192B P 4.2428 0.0000 0.0000 64.5396 31.5829 176.2810 193 G 4.4372 8.8924 110.4344 46.8100 0.0000 174.4080 194 D 4.4799 8.5008 119.1526 55.7725 41.4327 176.6506 195 S 4.3364 7.9574 115.4440 60.3889 63.2244 175.7382 196 G 4.0536 8.8520 112.1765 46.2778 0.0000 173.8289 197 G 3.9524 8.0464 107.2920 44.8168 0.0000 171.5300 198 P 4.8540 0.0000 0.0000 62.2380 33.1667 174.7321 199 L 5.1890 9.1569 124.1976 53.6086 44.4582 174.7779 200 Y 5.4965 9.2594 123.8079 55.6266 42.7734 174.5615 201 S 4.3563 9.2427 114.0493 56.2252 64.6844 174.5732 202 G 3.9232 8.6983 120.7821 46.9835 0.0000 173.1835 *207 T 4.9506 8.2990 115.3003 61.0718 71.1991 171.7785 208 R 5.0698 7.9334 121.6001 54.8553 32.4564 175.3357 209 A 4.4443 9.1743 126.7312 52.0587 19.2997 177.2682 210 I 4.2715 8.9800 122.7353 62.6770 40.3642 175.6288 211 G 4.4786 7.8025 106.1835 45.8022 0.0000 171.4949 212 L 5.5410 8.9392 119.1310 52.8143 45.3852 176.9139 213 T 3.6476 9.1223 120.8767 64.3234 68.8858 173.8374 214 S 4.3482 8.8601 120.8027 58.1884 64.1374 174.3007 215 G 4.0316 7.5351 104.8840 46.9385 0.0000 171.6366 216 G 4.4059 7.6161 106.6053 46.3588 0.0000 170.9518 217 S 4.6359 8.0386 117.3828 57.4561 66.7601 174.4766 218 G 4.0757 9.8650 107.8443 45.6228 0.0000 171.2727 219 N 4.7663 7.7705 115.2265 52.2869 40.2209 174.4719 220 C 4.3596 9.4867 115.7127 59.4029 40.5420 175.8371 221 S 4.2321 8.3234 113.7535 61.1544 62.1366 175.0928 222 S 4.3303 8.5939 114.0236 58.7951 63.2641 175.4952 223 G 4.0099 9.7504 107.1579 45.7088 0.0000 172.7719 224 G 4.4110 7.7075 105.2688 45.7673 0.0000 171.8006 225 T 4.8377 8.4567 115.4299 61.9639 71.9995 173.7730 226 T 4.9776 8.2371 121.7549 61.6807 72.3649 172.9987 227 F 5.3824 9.3564 124.0919 56.0036 41.7876 174.8719 228 F 5.3669 9.4558 120.4823 55.7038 43.3028 173.7694 229 Q 4.7669 9.2470 123.9986 54.6022 30.7234 173.5334 230 P 4.8118 0.0000 0.0000 62.6025 32.0973 177.8640 231 V 3.8106 8.7140 124.2394 64.7108 31.3367 178.7095 232 T 3.7642 7.8747 110.3848 64.9315 68.4807 176.0695 233 E 3.8822 7.8148 120.1307 58.8957 29.4145 179.2306 234 A 2.6580 7.3907 120.3993 54.5092 18.5269 179.4315 235 L 3.8527 7.8313 117.6356 57.8327 41.3931 180.0510 235A V 3.4539 7.6608 117.8894 65.8973 31.3007 177.8296 236 A 3.8474 7.4164 119.1579 54.9078 18.2441 178.3170 237 Y 4.7020 7.3692 111.8613 56.8454 38.6992 175.8196 238 G 3.8779 7.7695 107.7651 47.0204 0.0000 173.6417 239 V 4.8280 7.5800 111.0468 59.1615 35.4942 175.5356 240 S 4.7603 8.6847 114.9736 56.7979 66.5620 174.2606 241 V 4.3637 8.3513 114.7384 61.5968 32.6642 175.9676 242 Y 4.4171 7.6997 118.9946 57.5999 37.7473 174.7953 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 16 I 7.87 4.41 1.90 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 1.41 0.99 0.00 0.00 17 S 8.94 4.52 0.00 4.07 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.40 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *29 D 8.06 4.63 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.49 4.58 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.37 4.90 2.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.33 0.54 0.00 0.00 32 Y 9.65 5.50 0.00 3.19 2.98 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 33 S 8.59 4.59 0.00 2.95 2.63 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 34 S 8.41 4.18 0.00 4.04 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *39 T 7.43 4.30 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 1.19 0.00 0.00 40 G 7.68 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 0.00 0.00 0.00 0.00 41 R 8.66 4.99 0.00 1.69 1.76 0.00 3.00 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.31 0.00 42 C 9.18 5.14 0.00 2.88 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.48 5.20 0.00 3.79 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 44 L 8.66 3.34 0.00 1.24 1.25 0.34 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.39 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 46 F 7.87 5.15 0.00 2.98 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 47 N 8.91 5.37 0.00 2.70 3.08 0.00 0.00 6.74 7.68 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 48 V 9.52 5.23 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 0.93 0.00 0.00 1.13 0.00 0.00 48A R 9.03 5.20 0.00 1.24 1.62 0.00 2.21 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.44 0.00 48B S 8.89 4.42 0.00 3.92 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 48C G 8.96 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 48D S 8.82 4.38 0.00 3.94 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 49 T 7.98 4.22 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 0.56 0.00 0.00 50 Y 8.19 5.12 0.00 2.91 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 51 Y 9.47 5.32 0.00 2.85 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.53 5.58 0.00 3.12 3.29 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 53 L 9.04 5.06 0.00 1.82 1.77 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.20 4.55 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 0.94 0.00 0.00 55 A 8.49 4.25 1.11 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 0.00 0.00 56 G 8.82 3.71 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 0.00 0.00 0.00 57 H 7.95 3.68 0.00 2.39 1.31 0.00 5.55 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.40 4.57 0.00 3.12 3.42 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 59 T 7.85 4.40 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 1.18 0.00 0.00 60 D 7.96 4.29 0.00 3.06 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 7.41 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 A 7.94 4.37 1.46 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 60 T 7.77 4.00 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 65 T 7.39 4.68 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 66 W 8.25 4.88 0.00 3.31 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 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 F 8.58 5.31 0.00 2.95 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 *99A P 0.00 3.17 0.00 2.01 1.05 0.00 3.72 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 100 N 8.66 4.98 0.00 2.92 3.15 0.00 0.00 7.27 7.21 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 0.00 101 N 7.38 5.20 0.00 2.38 2.63 0.00 0.00 6.35 8.08 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 0.00 102 D 8.79 5.52 0.00 2.94 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 0.00 103 Y 8.45 5.28 0.00 3.01 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 0.00 104 G 9.21 4.85 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 0.00 105 I 8.73 4.94 1.30 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.87 0.00 0.00 114 P 0.00 4.32 0.00 2.04 1.92 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 115 K 7.87 4.44 0.00 1.32 1.61 0.00 1.07 0.00 0.00 0.83 0.00 0.00 2.44 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.90 7.81 116 D 8.35 4.46 0.00 2.59 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 0.00 117 G 8.47 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 0.00 0.00 0.00 118 T 7.21 4.87 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 1.17 0.00 0.00 119 V 8.08 4.35 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 0.84 0.00 0.00 0.57 0.00 0.00 120 G 8.03 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 0.00 121 G 8.71 3.72 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 0.00 122 Q 8.16 4.06 0.00 2.11 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.19 0.00 123 D 8.56 4.67 0.00 2.66 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 0.00 124 I 7.94 4.81 1.95 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 1.36 1.19 0.86 0.00 0.00 125 T 9.04 4.68 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 1.25 0.00 0.00 126 S 7.60 4.60 0.00 3.84 3.96 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 0.00 127 A 8.43 5.21 1.08 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 0.00 0.00 0.00 0.00 0.00 128 A 8.52 4.63 1.17 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 0.00 129 N 8.56 4.62 0.00 2.72 2.75 0.00 0.00 6.89 7.35 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 0.00 130 A 8.33 4.27 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.95 4.69 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 0.00 132 V 8.26 3.79 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 0.80 0.00 0.00 0.94 0.00 0.00 133 G 8.94 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 0.00 134 M 7.88 4.20 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 135 A 8.48 4.66 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 0.00 136 V 8.85 4.57 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 0.59 0.00 0.00 0.74 0.00 0.00 137 T 8.43 4.84 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 1.06 0.00 0.00 138 R 9.02 5.67 0.00 1.90 1.82 0.00 3.22 0.00 0.00 3.59 7.04 0.00 0.00 0.00 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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 0.00 168 T 8.30 4.68 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 0.95 0.00 0.00 169 V 8.18 3.70 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 -0.11 0.00 0.00 -0.20 0.00 0.00 170 N 8.25 4.76 0.00 2.56 2.55 0.00 0.00 7.22 7.54 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 0.00 171 Y 8.66 4.37 0.00 3.21 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 0.00 172 G 8.62 3.96 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 0.00 0.00 0.00 173 G 9.51 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 0.00 174 G 8.49 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 0.00 175 D 7.93 4.49 0.00 2.85 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 0.00 176 V 7.62 4.44 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 0.31 0.00 0.00 0.85 0.00 0.00 177 V 8.23 4.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.84 0.00 0.00 178 Y 8.63 4.82 0.00 2.79 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 0.00 179 G 8.82 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 0.00 0.00 0.00 0.00 180 M 8.09 4.71 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 181 I 9.04 4.58 2.11 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 1.20 0.90 0.96 0.00 0.00 182 R 9.16 4.68 0.00 2.02 1.81 0.00 3.16 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.96 0.00 183 T 8.29 5.07 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 1.23 0.00 0.00 184 N 8.35 4.66 0.00 2.80 3.01 0.00 0.00 7.02 9.00 0.00 0.00 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 V 8.04 4.41 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 1.13 0.00 0.00 0.88 0.00 0.00 191 C 8.73 4.63 0.00 3.05 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 0.00 192 A 7.70 4.72 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 192A E 9.38 4.75 0.00 1.91 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 2.20 2.23 0.00 192B P 0.00 4.24 0.00 2.03 2.02 0.00 3.64 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 2.10 0.00 193 G 8.89 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.50 4.48 0.00 2.80 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 0.00 195 S 7.96 4.34 0.00 3.87 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 0.00 196 G 8.85 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 0.00 197 G 8.05 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 0.00 198 P 0.00 4.85 0.00 1.75 0.94 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.58 0.00 199 L 9.16 5.19 0.00 1.31 1.51 0.13 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 9.26 5.50 0.00 3.21 3.17 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 0.00 201 S 9.24 4.36 0.00 3.79 3.73 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 0.00 202 G 8.70 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *207 T 8.30 4.95 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 0.00 208 R 7.93 5.07 0.00 1.98 1.87 0.00 3.11 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 209 A 9.17 4.44 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 8.98 4.27 1.99 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 1.37 1.27 0.89 0.00 0.00 211 G 7.80 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 0.00 0.00 0.00 0.00 212 L 8.94 5.54 0.00 1.76 1.67 1.11 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 213 T 9.12 3.65 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 214 S 8.86 4.35 0.00 4.01 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 0.00 215 G 7.54 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.62 4.41 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 0.00 217 S 8.04 4.64 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 0.00 218 G 9.86 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 219 N 7.77 4.77 0.00 3.10 2.91 0.00 0.00 7.45 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 0.00 220 C 9.49 4.36 0.00 3.01 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 0.00 221 S 8.32 4.23 0.00 3.83 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 S 8.59 4.33 0.00 3.87 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 0.00 223 G 9.75 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 7.71 4.41 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 0.00 225 T 8.46 4.84 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 0.85 0.00 0.00 226 T 8.24 4.98 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 0.68 0.00 0.00 227 F 9.36 5.38 0.00 3.02 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 0.00 228 F 9.46 5.37 0.00 3.06 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 9.25 4.77 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.99 0.00 0.00 0.00 0.00 0.00 2.83 2.61 0.00 230 P 0.00 4.81 0.00 2.28 2.02 0.00 3.79 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 231 V 8.71 3.81 2.16 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 0.67 0.00 0.00 0.87 0.00 0.00 232 T 7.87 3.76 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 1.17 0.00 0.00 233 E 7.81 3.88 0.00 2.30 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 2.33 2.34 0.00 234 A 7.39 2.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 7.83 3.85 0.00 1.76 1.80 0.81 0.66 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 235A V 7.66 3.45 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 0.94 0.00 0.00 0.90 0.00 0.00 236 A 7.42 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 Y 7.37 4.70 0.00 2.84 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 0.00 238 G 7.77 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 0.00 239 V 7.58 4.83 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 0.57 0.00 0.00 0.94 0.00 0.00 240 S 8.68 4.76 0.00 3.87 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 0.00 241 V 8.35 4.36 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 0.46 0.00 0.00 0.86 0.00 0.00 242 Y 7.70 4.42 0.00 3.07 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.