NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8642 8.3093 115.8534 57.2366 40.2800 176.2159 11 H 4.0755 6.3845 116.8585 57.0499 28.8864 173.5355 12 E 4.2374 8.0031 120.4505 58.0841 30.1328 178.5482 13 M 4.6547 7.6071 115.9677 55.1028 32.6203 176.9005 14 R 4.5858 8.2763 116.8914 56.3071 35.5911 175.7219 15 E 3.9580 8.2328 116.7432 55.6681 29.6052 174.4770 16 P 4.5689 0.0000 0.0000 62.6783 32.5040 174.9898 17 R 4.2619 7.7305 115.5176 55.6852 33.3441 173.5809 18 I 4.5471 8.1762 120.5421 60.2336 37.7843 175.5624 19 E 4.2633 8.8877 129.5585 58.4803 30.1069 176.6620 20 K 4.8350 7.5837 116.4767 55.6877 36.3335 174.6589 21 V 5.1606 8.5016 121.3832 60.2858 34.4433 174.1749 22 V 5.1640 8.0877 128.3307 60.7509 33.6118 174.6477 23 V 5.0296 8.0978 121.2855 59.3666 33.4731 174.0941 24 H 5.2241 8.6295 124.9126 54.5222 33.5173 172.2780 25 M 4.6730 8.5956 122.9409 53.1561 33.6413 174.4486 26 G 3.6385 8.0390 110.1037 47.1248 0.0000 170.9888 27 I 3.8921 8.7019 132.5140 60.9114 36.8223 177.7091 28 G 5.1119 8.7208 127.0700 46.8973 0.0000 171.8859 29 H 4.5502 7.4495 113.8881 55.6302 31.1313 174.2224 *35 A 4.4129 6.9750 124.0234 51.6806 18.7178 180.6466 36 N 4.4557 8.9406 117.1323 57.7891 36.5493 176.4997 37 A 3.9740 8.0411 123.2480 55.4090 18.6056 178.9377 38 E 3.8212 7.9846 116.8617 59.9825 29.6962 179.2052 39 D 4.4120 7.7542 117.6948 57.8879 40.8946 179.5030 40 I 4.1209 7.5634 114.2788 63.4391 37.5236 177.8812 41 L 4.0491 8.0710 120.5702 57.8008 41.6050 179.6822 42 G 3.6427 7.9728 104.8958 47.0716 0.0000 175.6438 43 E 3.9850 7.7101 119.5133 59.4166 29.4502 179.2016 44 I 3.8258 8.4240 117.7520 63.5905 38.0415 177.0793 45 T 4.3466 8.6717 110.1653 63.9335 69.5693 174.6811 46 G 3.5405 6.7933 110.3783 44.2339 0.0000 173.0154 47 Q 4.5403 8.0367 118.3376 54.3181 31.7886 173.9055 48 M 3.8837 8.3764 118.4215 55.4386 32.6759 174.7760 49 P 4.9642 0.0000 0.0000 61.7245 34.6050 174.7966 50 V 4.3300 7.8364 118.5204 62.0479 34.6135 175.0339 51 R 4.4213 8.8366 127.0872 57.2051 31.1702 176.4707 52 T 4.4770 8.5572 117.5077 61.9700 71.8156 174.3026 53 K 5.0209 8.8227 126.3174 55.0049 34.2165 175.9293 54 A 4.7470 8.0991 120.8075 50.8405 22.1502 176.1946 55 K 4.4155 8.6172 119.2103 55.9498 34.2927 177.4269 56 R 3.9774 8.6463 122.9745 55.9303 29.2374 175.4832 57 T 4.8357 8.1572 114.0856 61.9225 71.3163 174.1928 58 V 4.5416 8.4178 123.8148 60.6471 34.6690 176.8926 59 G 3.7456 8.7469 113.8135 48.1657 0.0000 174.3973 60 E 4.2512 8.1252 119.4155 58.7168 28.4025 176.2734 61 F 4.2273 7.6871 112.6229 60.6166 39.0709 174.7344 62 D 4.9880 7.8615 114.8253 52.3566 40.7956 175.6797 63 I 3.8827 7.5551 114.4453 62.4283 39.2262 177.0415 64 R 3.7768 7.8911 121.0827 56.0608 29.1468 174.7776 65 E 3.7257 8.3541 127.8980 59.0199 30.1273 175.6324 66 G 4.1711 7.8145 108.6977 45.8631 0.0000 172.1067 67 D 4.6879 8.5757 123.9387 51.9286 41.6734 174.0376 68 P 4.2830 0.0000 0.0000 63.9179 31.6594 175.6235 69 I 4.5922 8.6782 119.5806 62.2186 44.6450 174.3754 70 G 4.6053 7.8440 107.1524 44.9923 0.0000 171.4578 71 A 5.9393 8.5181 119.6428 50.3416 22.9109 175.0792 72 K 5.2415 8.2231 116.6193 56.3267 36.7583 174.9799 73 V 4.4473 8.0345 119.8144 61.6480 34.9528 173.2847 74 T 4.6318 8.5520 118.6362 60.3698 69.9710 173.7869 75 L 4.6976 8.4805 127.1175 53.1427 43.9370 176.1262 76 R 4.7958 7.9181 120.3790 55.2195 33.9628 176.7076 77 D 4.2073 8.8308 120.3413 55.1536 39.2173 175.8434 78 E 3.9942 8.9815 120.4071 61.3149 29.1732 178.9194 79 M 4.1539 8.1088 116.6817 58.1430 32.2560 177.9085 80 A 4.3278 8.3605 121.0594 54.3047 19.0333 179.5203 81 E 3.9401 7.9784 116.7445 59.6822 29.7159 178.8683 82 E 4.0684 8.3732 116.4800 58.0987 29.7580 178.0561 83 F 4.5902 7.8092 120.4522 60.2343 40.4542 177.3620 84 L 4.0574 7.9950 118.4622 57.6691 41.2039 179.0091 85 Q 4.1129 8.3205 117.0575 57.7677 28.6070 177.0865 86 T 4.4005 7.3577 106.7573 61.7470 71.1874 175.3659 87 A 3.9287 8.0978 125.6336 55.1770 18.7915 179.2754 88 L 3.7364 8.2336 116.1070 57.6460 41.6714 178.1256 89 P 4.2338 0.0000 0.0000 64.5840 31.3219 176.7712 90 L 4.6109 7.8339 117.2877 54.0551 41.7913 175.7015 91 A 4.7680 8.0260 120.7515 50.6778 22.2003 177.0738 92 E 4.5648 8.2150 118.7737 53.3761 29.4574 175.3007 93 L 3.9116 7.9259 119.7609 55.1338 42.3831 176.6788 94 A 5.7178 8.2881 123.4494 49.4974 22.3137 177.3768 95 T 3.8512 8.5443 116.0368 66.7999 68.8859 177.0354 96 S 4.3309 8.1490 115.5946 61.4122 62.4689 176.0736 97 Q 4.4027 8.0461 116.7609 56.3250 27.8575 175.0946 98 F 5.0887 8.0976 116.9755 55.3136 41.4513 175.2117 99 D 4.6331 10.2495 123.8658 54.3140 41.6099 176.7159 100 D 4.6297 8.6083 121.4628 56.2048 41.1574 177.4496 101 T 4.6011 7.3463 114.3647 62.3360 68.6812 174.5441 102 G 4.0032 7.9790 108.6785 46.6858 0.0000 173.6014 103 N 5.3501 8.0012 115.8548 51.3953 42.4245 173.5544 104 F 4.9361 7.9869 112.7198 55.7566 41.5601 173.1089 105 S 4.9334 8.2016 113.3791 56.4717 64.6130 172.8448 106 F 4.9704 8.5564 121.4369 55.2038 41.4001 172.7983 107 G 4.1997 8.9338 102.2337 44.3508 0.0000 173.2627 *128 L 4.0062 8.5682 123.3623 55.1785 43.6979 176.5016 129 D 4.8004 8.6858 126.4838 53.0169 43.4724 176.2320 130 V 4.1882 8.1120 121.5751 61.7871 34.4784 173.9793 131 T 4.6229 8.6423 125.3555 61.6265 71.1602 174.1938 132 V 4.3044 7.6450 123.9891 61.0754 34.5519 173.7183 133 N 4.9398 9.2219 128.4584 52.6352 40.0473 173.6763 134 L 5.3329 8.0983 125.7775 53.1912 44.7087 175.7782 135 V 4.1731 7.7436 120.0452 61.1813 35.3341 172.2960 136 R 4.1640 8.1419 120.1017 54.2637 31.7992 176.1778 137 P 4.4085 0.0000 0.0000 64.1648 31.4309 177.0336 138 G 4.2680 8.4430 107.1217 44.8649 0.0000 174.7661 139 Y 4.1690 8.2913 123.3081 60.1034 38.7789 177.1830 140 R 3.8738 8.1714 119.2186 59.0464 30.0189 178.2495 141 V 3.6179 7.7798 117.2793 64.8706 31.2707 176.6218 142 A 5.1393 7.6660 119.7151 51.2120 19.6774 177.0415 143 K 4.2527 7.4318 114.8474 56.1282 34.0638 176.7418 144 R 4.2469 7.6262 115.1942 55.6134 30.3934 176.7692 145 D 4.4384 8.5139 117.8152 57.1797 40.8874 177.8319 146 K 4.0077 7.9905 118.3103 57.5275 32.7197 177.0562 147 A 3.5442 8.5577 123.4911 52.3295 16.2482 177.1234 148 S 4.4889 7.1634 114.2249 60.7376 63.9652 173.6440 149 R 4.5753 8.9160 119.5351 55.4693 33.8901 173.2668 150 S 4.8285 8.4378 118.7674 56.6473 63.6543 173.7746 151 I 3.6830 8.4443 127.7791 61.1083 36.9707 174.2098 152 P 4.4444 0.0000 0.0000 62.6788 32.1445 177.4150 153 T 3.9447 8.5946 110.6108 64.8877 68.9021 176.7196 154 K 3.9389 8.1291 120.4177 59.4635 32.1141 177.1743 155 H 4.5119 7.8038 114.7346 56.5928 30.0226 175.3558 156 R 4.2040 7.6937 117.8464 56.3812 30.8162 175.7613 157 L 4.2349 8.2969 123.2130 54.5836 42.9887 176.1962 158 N 4.8588 8.5095 123.2598 51.7654 40.9866 174.2519 159 P 4.3112 0.0000 0.0000 65.9064 31.4618 178.5556 160 A 3.8789 8.0109 118.7066 55.6743 18.1127 179.2402 161 D 4.3290 8.2401 116.1117 57.2701 40.7740 179.0726 162 A 4.1533 7.9741 121.4629 54.9414 18.5743 179.4571 163 V 3.1810 7.9124 116.9967 66.1214 31.4348 177.6745 164 A 3.9632 8.0103 120.2943 55.3744 17.9561 179.0505 165 F 4.0945 7.6976 117.1254 61.7539 39.7587 177.2317 166 I 3.6333 7.9727 118.9470 64.4174 36.8274 177.7917 167 E 4.4056 8.4256 120.5230 58.6111 29.5318 178.1638 168 S 4.5290 8.0068 112.1661 57.6161 64.5473 175.1869 169 T 4.6505 7.8273 112.6849 63.5240 71.6609 173.0738 170 Y 3.3661 7.7931 122.8371 57.6860 35.2972 168.5217 171 D 4.3784 6.6769 117.1495 53.8522 43.1222 175.4625 172 V 4.7374 7.8642 117.0950 61.0514 35.7241 178.2043 173 E 4.4036 8.6449 124.0827 56.2120 29.0614 177.2982 174 V 3.6506 7.7786 118.5859 61.8524 31.9320 174.7753 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 10 F 8.31 4.86 0.00 3.19 3.31 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 11 H 6.38 4.08 0.00 3.22 2.85 0.00 5.49 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.00 4.24 0.00 1.59 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 2.22 2.23 0.00 13 M 7.61 4.65 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.45 0.00 14 R 8.28 4.59 0.00 1.92 1.93 0.00 3.32 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.97 0.00 15 E 8.23 3.96 0.00 2.19 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 2.54 2.32 0.00 16 P 0.00 4.57 0.00 0.98 1.58 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 17 R 7.73 4.26 0.00 1.80 1.88 0.00 2.73 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 18 I 8.18 4.55 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.95 0.00 0.00 19 E 8.89 4.26 0.00 1.83 1.80 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 2.28 2.25 0.00 20 K 7.58 4.83 0.00 1.77 1.80 0.00 1.45 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.36 7.81 21 V 8.50 5.16 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 0.85 0.00 0.00 0.96 0.00 0.00 22 V 8.09 5.16 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 0.96 0.00 0.00 0.84 0.00 0.00 23 V 8.10 5.03 1.94 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 0.58 0.00 0.00 0.66 0.00 0.00 24 H 8.63 5.22 0.00 3.23 3.00 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.60 4.67 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 26 G 8.04 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.70 3.89 1.92 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 1.10 0.74 0.71 0.00 0.00 28 G 8.72 5.11 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 0.00 29 H 7.45 4.55 0.00 3.13 3.31 0.00 5.76 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 *35 A 6.98 4.41 1.12 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 0.00 0.00 36 N 8.94 4.46 0.00 2.92 3.11 0.00 0.00 5.84 7.46 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 37 A 8.04 3.97 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 38 E 7.98 3.82 0.00 2.13 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 2.32 2.38 0.00 39 D 7.75 4.41 0.00 2.79 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 40 I 7.56 4.12 1.89 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 1.75 1.63 0.92 0.00 0.00 41 L 8.07 4.05 0.00 1.86 1.73 0.87 0.86 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 42 G 7.97 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.71 3.99 0.00 2.29 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 2.33 2.55 0.00 44 I 8.42 3.83 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.89 1.08 0.00 0.00 45 T 8.67 4.35 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 0.97 0.00 0.00 46 G 6.79 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 47 Q 8.04 4.54 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.72 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 48 M 8.38 3.88 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 49 P 0.00 4.96 0.00 2.03 1.98 0.00 3.65 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 2.04 0.00 50 V 7.84 4.33 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 0.93 0.00 0.00 0.93 0.00 0.00 51 R 8.84 4.42 0.00 1.71 1.85 0.00 3.35 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.56 4.48 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 1.20 0.00 0.00 53 K 8.82 5.02 0.00 1.63 1.76 0.00 1.75 0.00 0.00 0.82 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.27 7.81 54 A 8.10 4.75 1.16 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 0.00 0.00 55 K 8.62 4.42 0.00 1.64 1.73 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.44 7.81 56 R 8.65 3.98 0.00 1.97 1.99 0.00 3.15 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 57 T 8.16 4.84 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 1.24 0.00 0.00 58 V 8.42 4.54 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 1.10 0.00 0.00 0.95 0.00 0.00 59 G 8.75 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 0.00 0.00 0.00 60 E 8.13 4.25 0.00 2.15 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 2.31 2.34 0.00 61 F 7.69 4.23 0.00 3.00 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 62 D 7.86 4.99 0.00 2.92 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.56 3.88 1.92 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 1.38 0.78 1.03 0.00 0.00 64 R 7.89 3.78 0.00 1.75 2.12 0.00 3.21 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.61 0.00 65 E 8.35 3.73 0.00 2.04 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 2.37 2.46 0.00 66 G 7.81 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 67 D 8.58 4.69 0.00 2.67 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 68 P 0.00 4.28 0.00 1.93 2.04 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 2.02 2.14 0.00 69 I 8.68 4.59 1.98 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 1.13 1.07 0.86 0.00 0.00 70 G 7.84 4.61 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 71 A 8.52 5.94 1.16 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 0.00 0.00 72 K 8.22 5.24 0.00 1.75 1.87 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.23 7.81 73 V 8.03 4.45 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 0.93 0.00 0.00 0.92 0.00 0.00 74 T 8.55 4.63 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 1.16 0.00 0.00 75 L 8.48 4.70 0.00 1.62 1.61 0.53 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.92 4.80 0.00 1.62 1.76 0.00 3.34 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 77 D 8.83 4.21 0.00 2.88 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 78 E 8.98 3.99 0.00 2.02 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 2.42 2.44 0.00 79 M 8.11 4.15 0.00 1.97 2.30 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 80 A 8.36 4.33 1.38 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 81 E 7.98 3.94 0.00 2.06 2.01 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 2.46 2.45 0.00 82 E 8.37 4.07 0.00 2.00 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 2.54 0.00 83 F 7.81 4.59 0.00 3.24 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.00 4.06 0.00 1.96 1.81 1.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.32 4.11 0.00 1.91 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.49 0.00 86 T 7.36 4.40 4.11 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 1.15 0.00 0.00 87 A 8.10 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.23 3.74 0.00 1.75 1.68 0.97 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.23 0.00 2.11 2.10 0.00 3.65 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 2.16 2.09 0.00 90 L 7.83 4.61 0.00 1.80 1.69 0.91 0.75 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 91 A 8.03 4.77 0.65 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 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.21 4.56 0.00 1.93 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 2.17 2.27 0.00 93 L 7.93 3.91 0.00 1.59 1.70 0.71 0.57 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 94 A 8.29 5.72 1.29 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 95 T 8.54 3.85 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 96 S 8.15 4.33 0.00 4.06 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 0.00 97 Q 8.05 4.40 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 98 F 8.10 5.09 0.00 3.18 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 99 D 10.25 4.63 0.00 2.87 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 0.00 100 D 8.61 4.63 0.00 2.73 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 0.00 101 T 7.35 4.60 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 1.25 0.00 0.00 102 G 7.98 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 0.00 0.00 0.00 103 N 8.00 5.35 0.00 2.67 2.66 0.00 0.00 6.54 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 7.99 4.94 0.00 2.58 1.58 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 0.00 105 S 8.20 4.93 0.00 3.71 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 0.00 106 F 8.56 4.97 0.00 3.18 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.93 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 0.00 0.00 0.00 0.00 *128 L 8.57 4.01 0.00 1.76 1.62 0.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.69 4.80 0.00 2.84 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 0.00 130 V 8.11 4.19 1.06 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 0.85 0.00 0.00 0.95 0.00 0.00 131 T 8.64 4.62 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 132 V 7.65 4.30 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.76 0.00 0.00 133 N 9.22 4.94 0.00 2.69 2.62 0.00 0.00 6.59 6.70 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 0.00 134 L 8.10 5.33 0.00 1.70 1.46 1.28 1.07 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 0.00 135 V 7.74 4.17 1.61 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 0.27 0.00 0.00 0.89 0.00 0.00 136 R 8.14 4.16 0.00 1.74 1.79 0.00 3.12 0.00 0.00 2.86 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 137 P 0.00 4.41 0.00 2.06 2.11 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.08 0.00 138 G 8.44 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 0.00 0.00 0.00 0.00 139 Y 8.29 4.17 0.00 3.02 3.01 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 0.00 140 R 8.17 3.87 0.00 1.94 1.94 0.00 3.24 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 141 V 7.78 3.62 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 0.96 0.00 0.00 0.97 0.00 0.00 142 A 7.67 5.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.43 4.25 0.00 1.65 1.79 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.86 1.33 7.81 144 R 7.63 4.25 0.00 1.91 1.98 0.00 3.04 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 145 D 8.51 4.44 0.00 2.68 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 0.00 146 K 7.99 4.01 0.00 1.80 1.71 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.42 7.81 147 A 8.56 3.54 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 0.00 148 S 7.16 4.49 0.00 3.86 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 0.00 149 R 8.92 4.58 0.00 1.85 1.71 0.00 3.11 0.00 0.00 3.07 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 150 S 8.44 4.83 0.00 3.89 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 0.00 151 I 8.44 3.68 1.96 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 1.37 1.08 1.04 0.00 0.00 152 P 0.00 4.44 0.00 2.21 2.01 0.00 3.62 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 2.12 2.10 0.00 153 T 8.59 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 1.23 0.00 0.00 154 K 8.13 3.94 0.00 1.79 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.51 7.81 155 H 7.80 4.51 0.00 3.13 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.69 4.20 0.00 2.10 1.88 0.00 3.43 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.75 0.00 157 L 8.30 4.23 0.00 1.68 1.70 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.51 4.86 0.00 3.12 2.73 0.00 0.00 7.12 8.03 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 0.00 159 P 0.00 4.31 0.00 2.16 2.19 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.43 0.00 160 A 8.01 3.88 1.29 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 0.00 161 D 8.24 4.33 0.00 2.89 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 0.00 162 A 7.97 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.91 3.18 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 0.75 0.00 0.00 0.36 0.00 0.00 164 A 8.01 3.96 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 0.00 165 F 7.70 4.09 0.00 3.01 3.37 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 0.00 166 I 7.97 3.63 1.88 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 1.69 1.12 0.88 0.00 0.00 167 E 8.43 4.41 0.00 1.85 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 2.27 2.14 0.00 168 S 8.01 4.53 0.00 3.87 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 0.00 169 T 7.83 4.65 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 1.27 0.00 0.00 170 Y 7.79 3.37 0.00 3.01 3.07 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 0.00 171 D 6.68 4.38 0.00 2.89 2.83 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 0.00 172 V 7.86 4.74 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.64 4.40 0.00 1.99 1.16 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 2.39 2.18 0.00 174 V 7.78 3.65 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 0.92 0.00 0.00 0.88 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.