NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 S 4.4154 8.3349 115.2908 57.8058 62.6860 173.1994 19 L 4.1122 8.3430 128.3530 54.5515 42.2298 175.5804 20 M 4.5065 9.1692 121.9612 55.0327 33.4503 175.9220 21 I 3.8676 7.6721 121.2729 61.7386 37.7930 175.6209 22 K 4.8704 8.9806 124.9201 54.4572 34.3277 177.6274 23 V 3.5630 8.7919 121.9005 66.1980 31.3498 178.4231 24 E 4.0307 7.9689 115.8184 58.9200 29.3416 177.8208 25 D 4.5191 7.9948 119.1009 56.2705 40.9985 176.6326 26 M 4.6911 7.9137 113.3466 54.2615 32.5682 175.5846 27 M 4.2072 7.7362 116.8257 55.3769 32.7465 176.1449 28 T 4.0871 8.6796 117.6760 63.7414 69.3972 174.8617 29 R 4.4372 8.5971 125.6506 54.6181 32.0406 175.6778 30 H 4.0455 8.2830 115.1521 56.3057 26.2997 173.7106 31 P 4.4659 0.0000 0.0000 62.7041 32.3252 175.9948 32 H 4.4860 8.7159 117.8798 56.2868 29.1318 174.6978 33 T 4.9903 8.4877 112.0300 59.9494 72.4548 172.7038 34 L 4.8624 8.5593 120.0979 52.7373 46.4557 176.6093 35 L 4.9201 8.5032 121.0129 53.9930 42.6898 178.5427 36 R 4.1434 8.8410 117.5446 58.6991 29.7485 178.0439 37 T 4.3972 7.8436 106.9922 62.2559 69.7365 174.2933 38 H 4.3804 8.1449 120.8858 56.0736 29.6035 173.7921 39 T 4.9206 8.6840 111.1875 59.2732 72.5040 174.6618 40 L 3.8615 8.2840 122.3372 58.6216 41.8359 178.4969 41 N 4.2754 8.2590 116.5307 56.8188 38.8562 176.5100 42 D 4.3970 8.0960 119.8281 57.3470 40.8565 178.6920 43 A 3.9731 8.0425 121.2474 54.8642 18.3186 179.2301 44 K 3.7444 8.4977 118.5587 60.3304 32.1349 178.5233 45 H 4.2493 8.2179 116.1035 58.8128 28.7329 177.6525 46 L 3.9647 8.1836 122.1547 58.3607 41.9714 178.8456 47 M 4.1258 8.3137 118.9193 58.5080 31.3900 178.6555 48 E 3.9601 8.4794 118.5695 59.3731 29.4387 179.2327 49 A 4.0330 8.2275 120.0094 54.4982 18.5785 178.7192 50 L 4.3505 7.6695 113.6983 53.2465 43.5769 175.7553 51 D 4.3581 7.5241 117.4429 55.5031 39.7311 171.1517 52 I 4.7360 7.8297 111.2692 59.4488 41.3057 175.6795 53 R 4.6927 8.3550 114.6995 55.8629 32.7380 174.6424 54 H 5.2383 8.1471 115.9443 54.2973 32.8429 172.9592 55 V 4.3465 8.8525 122.9874 60.2566 34.2652 172.9492 56 P 4.7684 0.0000 0.0000 62.8259 32.8583 175.4156 57 I 4.9718 8.8679 124.6552 60.0699 38.8433 175.3503 58 V 5.0484 8.5984 119.4360 59.6255 36.6458 175.2652 59 D 4.7565 8.5452 121.6916 51.9660 41.3641 176.9936 60 A 4.0205 8.5254 120.8107 55.0978 18.3306 178.0399 61 N 4.7428 8.2597 111.3881 53.0229 38.8587 175.3812 62 K 3.9438 8.2531 115.9646 57.0715 30.3967 175.6569 63 K 4.6092 8.2525 119.4232 55.6593 32.6668 176.2452 64 L 4.4715 8.2850 125.8782 55.0964 42.4281 176.2950 65 L 4.5149 8.8523 126.1005 54.8851 44.0167 176.4256 66 G 4.0342 7.3819 102.8353 46.9367 0.0000 171.2892 67 I 5.1033 8.2464 118.3038 59.8025 41.2123 174.9251 68 V 4.7981 8.8644 121.9865 59.6393 34.6190 175.2934 69 S 5.0640 9.0485 119.4676 56.5393 65.7539 174.8625 70 Q 3.9182 8.6744 121.0809 59.5239 28.4927 178.6529 71 R 3.9286 7.9398 119.0357 59.4264 30.1513 178.0029 72 D 4.3297 8.1156 118.6254 57.4550 40.8420 178.8735 73 L 3.9952 7.8747 119.3561 57.7536 41.5328 179.6092 74 L 3.9709 8.4264 119.1708 57.7551 41.4869 179.4507 75 A 3.9716 8.3060 120.7060 55.0180 18.0546 179.6088 76 A 3.9135 7.8655 118.5501 55.2813 18.8782 179.6295 77 Q 4.0995 8.2358 116.6145 59.2230 28.9924 178.8514 78 E 3.9926 8.4719 119.9427 59.4255 29.3360 179.1016 79 S 4.3085 8.1942 111.3351 60.2070 62.4940 175.1462 80 S 4.6174 7.5639 114.1959 59.7345 63.2958 174.1342 81 L 4.3129 7.1853 120.4942 54.8736 39.2714 174.8469 82 Q 4.5665 8.0754 121.1966 56.8192 35.8983 175.3553 *92 F 4.8374 8.0179 112.2717 56.2480 39.6427 175.9228 93 E 3.8762 7.1652 116.4899 56.4132 30.3365 176.5058 94 T 3.6750 7.5616 117.6739 63.2989 69.1013 171.6965 95 P 4.6059 0.0000 0.0000 62.1845 32.1458 177.4349 96 L 3.9574 8.8747 123.0718 57.8553 41.2616 179.9279 97 F 4.2786 8.2342 114.1796 60.0086 37.5930 176.9653 98 E 4.0961 7.1779 117.7999 58.1101 29.3703 178.2908 99 V 3.8820 7.3020 117.2157 63.8821 32.5633 176.2335 100 M 4.2279 7.7033 115.5830 54.8818 31.8075 175.8716 101 H 4.4116 8.5140 118.8859 56.2034 29.4445 176.0583 102 T 4.0908 8.5109 113.2592 63.7688 69.2514 174.3713 103 D 4.6308 7.9903 122.5784 53.1483 41.6013 175.6042 104 V 4.3678 8.3353 123.5812 61.2366 33.7130 174.2367 105 T 4.8020 8.5070 123.9916 62.1523 70.1383 173.9394 106 S 4.9915 8.4228 119.4527 57.2289 66.8000 172.8581 107 V 4.5526 8.4448 117.8065 59.9502 35.0923 174.4289 108 A 4.9688 8.6626 123.1549 50.0671 19.6527 177.0664 109 P 4.2186 0.0000 0.0000 65.4369 31.5337 177.9826 110 Q 4.1833 7.9485 114.4655 56.4247 29.4431 175.9649 111 A 4.0871 7.8094 123.2200 52.1909 19.2369 177.2510 112 G 3.9858 8.4030 107.3252 44.2263 0.0000 174.8565 113 L 3.9843 8.9741 126.7084 57.9541 42.2045 179.5491 114 K 3.9744 8.0233 119.1311 59.4569 32.2405 178.1289 115 E 3.9585 8.1714 119.1287 59.5204 29.6055 178.8924 116 S 4.2024 8.2787 115.0095 61.3953 62.8492 176.4912 117 A 4.1212 8.5207 123.9204 55.2841 18.0690 179.6782 118 I 3.6347 8.0590 118.5359 64.6026 37.1722 177.8885 119 Y 3.9872 8.1733 120.2694 61.1584 38.5731 178.2617 120 M 4.2141 8.4696 119.5468 58.2993 31.9100 178.5058 121 Q 3.8523 8.4434 120.1122 59.1748 29.0755 178.3649 122 K 3.8693 8.0354 119.4279 59.1798 32.2634 177.5184 123 H 4.5959 7.7805 113.2556 53.9869 29.5996 175.1166 124 K 3.7201 7.4793 119.1761 57.3774 30.0255 175.7779 125 I 4.3248 7.8950 118.7885 59.8232 38.1066 176.9895 126 G 3.7857 8.7746 115.6393 47.7950 0.0000 172.9990 127 C 4.9454 7.8487 118.7699 57.2596 34.7741 173.2141 128 L 4.6865 8.8264 128.1211 52.4547 44.0514 173.7291 129 P 4.7502 0.0000 0.0000 62.7772 32.8976 175.5211 130 V 4.8005 8.8488 123.5075 61.2889 33.6907 174.7892 131 V 4.9936 8.9585 120.7327 59.4529 35.6134 174.7666 132 A 4.5609 8.5492 126.8892 51.1254 21.4515 176.4185 133 K 3.7390 9.3946 123.7988 57.9503 29.8159 177.7059 134 D 4.7157 8.1210 118.9298 55.1142 40.5173 175.1154 135 V 4.0283 7.3483 119.3562 62.1177 31.9666 174.7322 136 L 4.4255 8.7446 130.2182 55.4558 41.8490 176.5944 137 V 4.1949 8.2289 119.7425 61.4292 33.3539 175.6209 138 G 4.0996 7.2473 106.5774 45.9373 0.0000 171.9281 139 I 5.1532 8.1582 112.2185 59.1080 41.5285 174.3764 140 I 4.7992 8.6623 125.3315 60.0068 39.1870 174.9873 141 T 5.0670 9.0139 117.1236 58.8962 72.2769 174.5602 142 D 4.7052 8.9959 121.1485 57.2649 38.7657 178.8954 143 S 4.1447 7.7986 114.7846 61.6086 62.8095 176.5045 144 D 4.2811 7.9916 121.4962 57.3140 40.4317 178.8394 145 F 4.3500 7.8086 117.8958 60.2942 38.9390 177.5552 146 V 3.6485 8.1348 118.1450 66.4488 31.3257 178.2148 147 T 3.8619 7.6805 115.0676 66.7809 68.2862 176.5530 148 I 3.7338 7.9873 120.2721 63.8119 37.8819 177.7153 149 A 4.0256 8.5219 122.2618 55.1415 18.2116 179.5818 150 I 3.6500 7.9166 118.2380 64.7925 37.2647 178.4625 151 N 4.4263 8.2707 117.1520 56.2880 38.2410 177.5696 152 L 4.0401 8.1899 120.5334 57.7279 41.6493 179.5508 153 L 3.9913 8.2725 119.2801 57.7583 41.4939 179.2535 154 E 3.9463 8.6511 119.0061 59.3438 29.1801 179.2180 155 L 3.9353 7.7896 119.0561 58.3902 42.2772 178.7307 156 Q 4.1466 8.1187 116.8766 58.9463 28.6549 178.4781 157 E 4.1197 8.1964 118.9773 59.3611 29.6510 177.4202 158 E 4.2790 8.2053 121.8353 56.6211 29.7044 176.6439 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 18 S 8.33 4.42 0.00 3.85 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 19 L 8.34 4.11 0.00 1.75 1.59 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 20 M 9.17 4.51 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 21 I 7.67 3.87 1.89 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 1.42 0.53 0.92 0.00 0.00 22 K 8.98 4.87 0.00 1.88 1.85 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.54 7.81 23 V 8.79 3.56 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.92 0.00 0.00 24 E 7.97 4.03 0.00 2.10 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 0.00 2.39 2.27 0.00 25 D 7.99 4.52 0.00 2.85 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.91 4.69 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.42 0.00 27 M 7.74 4.21 0.00 2.05 2.17 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 2.50 2.67 0.00 28 T 8.68 4.09 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 1.20 0.00 0.00 29 R 8.60 4.44 0.00 1.50 1.57 0.00 3.28 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 1.50 1.58 0.00 30 H 8.28 4.05 0.00 3.22 3.25 0.00 5.70 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 31 P 0.00 4.47 0.00 2.19 2.06 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 32 H 8.72 4.49 0.00 3.04 3.32 0.00 5.83 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.49 4.99 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 34 L 8.56 4.86 0.00 1.59 1.52 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.50 4.92 0.00 1.62 1.62 0.94 1.08 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 36 R 8.84 4.14 0.00 2.22 2.28 0.00 2.95 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 37 T 7.84 4.40 4.33 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 1.37 0.00 0.00 38 H 8.14 4.38 0.00 3.51 3.39 0.00 5.75 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.68 4.92 4.33 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 1.15 0.00 0.00 40 L 8.28 3.86 0.00 1.68 1.87 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.26 4.28 0.00 3.18 2.87 0.00 0.00 7.27 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 42 D 8.10 4.40 0.00 2.97 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 43 A 8.04 3.97 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 44 K 8.50 3.74 0.00 1.84 1.91 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.53 1.48 7.81 45 H 8.22 4.25 0.00 3.38 3.31 0.00 5.67 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 46 L 8.18 3.96 0.00 1.86 1.88 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 47 M 8.31 4.13 0.00 2.16 2.32 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.67 0.00 48 E 8.48 3.96 0.00 2.17 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 2.34 2.44 0.00 49 A 8.23 4.03 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.67 4.35 0.00 1.62 1.66 0.60 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.52 4.36 0.00 2.77 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 52 I 7.83 4.74 1.90 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 1.29 0.85 0.97 0.00 0.00 53 R 8.35 4.69 0.00 1.69 1.75 0.00 3.07 0.00 0.00 3.34 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 54 H 8.15 5.24 0.00 2.97 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.85 4.35 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 1.08 0.00 0.00 0.95 0.00 0.00 56 P 0.00 4.77 0.00 2.13 1.97 0.00 3.86 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 57 I 8.87 4.97 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 1.26 0.96 1.01 0.00 0.00 58 V 8.60 5.05 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 0.94 0.00 0.00 0.93 0.00 0.00 59 D 8.55 4.76 0.00 2.91 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 60 A 8.53 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.26 4.74 0.00 2.81 2.82 0.00 0.00 6.97 7.61 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 62 K 8.25 3.94 0.00 2.00 1.92 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.39 7.81 63 K 8.25 4.61 0.00 2.08 1.72 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.37 7.81 64 L 8.29 4.47 0.00 1.62 1.58 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.85 4.51 0.00 1.64 1.70 0.97 0.80 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 66 G 7.38 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 67 I 8.25 5.10 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.86 0.96 0.00 0.00 68 V 8.86 4.80 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 0.68 0.00 0.00 0.97 0.00 0.00 69 S 9.05 5.06 0.00 3.80 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 70 Q 8.67 3.92 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 71 R 7.94 3.93 0.00 1.92 1.93 0.00 3.25 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 72 D 8.12 4.33 0.00 2.95 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 73 L 7.87 4.00 0.00 1.82 1.70 0.92 0.67 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 74 L 8.43 3.97 0.00 1.64 1.71 0.92 0.89 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 75 A 8.31 3.97 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 76 A 7.87 3.91 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 8.24 4.10 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 78 E 8.47 3.99 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 79 S 8.19 4.31 0.00 3.85 4.07 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 80 S 7.56 4.62 0.00 4.08 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 81 L 7.19 4.31 0.00 1.77 1.64 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.08 4.57 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.68 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 *92 F 8.02 4.84 0.00 3.41 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 93 E 7.17 3.88 0.00 1.71 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 1.60 2.01 0.00 94 T 7.56 3.67 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 1.05 0.00 0.00 95 P 0.00 4.61 0.00 1.02 1.73 0.00 3.42 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.94 0.00 96 L 8.87 3.96 0.00 1.67 1.73 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 F 8.23 4.28 0.00 3.09 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 98 E 7.18 4.10 0.00 1.80 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 2.19 1.47 0.00 99 V 7.30 3.88 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 0.84 0.00 0.00 100 M 7.70 4.23 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.80 0.00 101 H 8.51 4.41 0.00 3.21 3.28 0.00 5.70 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.51 4.09 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 1.26 0.00 0.00 103 D 7.99 4.63 0.00 2.69 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 0.00 104 V 8.34 4.37 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 0.86 0.00 0.00 0.99 0.00 0.00 105 T 8.51 4.80 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 1.37 0.00 0.00 106 S 8.42 4.99 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.44 4.55 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 0.81 0.00 0.00 0.83 0.00 0.00 108 A 8.66 4.97 1.23 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 0.00 109 P 0.00 4.22 0.00 2.40 2.30 0.00 3.67 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 2.05 1.94 0.00 110 Q 7.95 4.18 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 111 A 7.81 4.09 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 0.00 112 G 8.40 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 0.00 113 L 8.97 3.98 0.00 1.74 1.80 1.06 0.60 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 0.00 114 K 8.02 3.97 0.00 1.89 1.81 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.52 7.81 115 E 8.17 3.96 0.00 2.10 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 2.42 2.45 0.00 116 S 8.28 4.20 0.00 4.11 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.52 4.12 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 0.00 118 I 8.06 3.63 2.05 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 1.40 0.81 0.91 0.00 0.00 119 Y 8.17 3.99 0.00 3.26 3.21 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 0.00 120 M 8.47 4.21 0.00 2.35 2.35 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.00 2.73 0.00 121 Q 8.44 3.85 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 122 K 8.04 3.87 0.00 1.72 1.65 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.71 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.10 1.32 7.81 123 H 7.78 4.60 0.00 2.99 3.10 0.00 5.86 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.48 3.72 0.00 1.79 1.83 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.51 7.81 125 I 7.89 4.32 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.98 1.02 0.00 0.00 126 G 8.77 3.79 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 0.00 0.00 0.00 127 C 7.85 4.95 0.00 2.53 2.64 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 0.00 128 L 8.83 4.69 0.00 1.84 1.54 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.75 0.00 2.11 1.96 0.00 3.84 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 2.13 2.10 0.00 130 V 8.85 4.80 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 1.04 0.00 0.00 0.95 0.00 0.00 131 V 8.96 4.99 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 0.67 0.00 0.00 0.96 0.00 0.00 132 A 8.55 4.56 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 0.00 133 K 9.39 3.74 0.00 1.97 1.86 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.43 7.81 134 D 8.12 4.72 0.00 2.88 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 0.00 135 V 7.35 4.03 2.20 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 0.99 0.00 0.00 0.93 0.00 0.00 136 L 8.74 4.43 0.00 1.60 1.65 1.00 0.88 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 0.00 137 V 8.23 4.19 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 0.74 0.00 0.00 0.94 0.00 0.00 138 G 7.25 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 0.00 0.00 0.00 139 I 8.16 5.15 1.85 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 1.21 0.79 0.91 0.00 0.00 140 I 8.66 4.80 1.83 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 1.15 0.60 0.53 0.00 0.00 141 T 9.01 5.07 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 1.17 0.00 0.00 142 D 9.00 4.71 0.00 3.07 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 S 7.80 4.14 0.00 3.94 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 0.00 144 D 7.99 4.28 0.00 2.42 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 0.00 145 F 7.81 4.35 0.00 3.27 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 0.00 146 V 8.13 3.65 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 1.06 0.00 0.00 1.04 0.00 0.00 147 T 7.68 3.86 4.39 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 1.20 0.00 0.00 148 I 7.99 3.73 1.99 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 1.50 1.26 1.13 0.00 0.00 149 A 8.52 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 0.00 150 I 7.92 3.65 2.04 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 1.54 0.68 0.92 0.00 0.00 151 N 8.27 4.43 0.00 2.79 2.87 0.00 0.00 7.11 6.19 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 0.00 152 L 8.19 4.04 0.00 1.84 1.73 0.96 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.27 3.99 0.00 1.87 1.72 0.97 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 154 E 8.65 3.95 0.00 2.13 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 2.34 2.50 0.00 155 L 7.79 3.94 0.00 1.77 1.93 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.12 4.15 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 157 E 8.20 4.12 0.00 2.11 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 2.35 2.46 0.00 158 E 8.21 4.28 0.00 2.09 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 2.35 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.