NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.2821 8.2649 123.5813 52.4169 20.4431 177.0263 10 R 4.1570 8.1304 110.7240 54.7294 26.6616 175.5097 11 T 3.9688 7.5133 114.9118 64.5169 68.0858 174.2306 12 D 4.3663 7.9854 120.4921 56.8569 39.5787 178.1362 13 T 4.1585 8.0039 111.3014 64.5886 68.6056 176.6982 14 L 4.0079 7.8906 120.4316 56.8381 41.7749 178.2244 15 L 4.4104 7.3069 116.2844 53.7237 42.5500 176.9396 16 Q 4.0998 7.3185 120.0099 55.4348 29.6706 176.9299 17 L 3.7587 8.6358 124.1335 58.4678 42.0685 178.6333 18 D 4.6477 8.0565 114.8698 56.0673 40.7324 176.3440 19 N 4.8297 7.9546 115.7618 52.9794 39.1687 174.7592 20 Q 4.4929 7.9500 119.7691 54.2898 30.2264 176.1186 21 L 4.0109 8.5462 127.5516 58.1829 42.3094 178.8091 22 S 4.1795 8.1580 113.7946 61.6237 62.7468 176.2652 23 F 4.3274 8.2584 123.4248 60.8897 39.2569 176.7772 24 A 3.8463 7.9014 120.5058 54.9591 18.0882 179.4552 25 L 3.8012 8.0089 118.6946 58.3981 42.2724 178.3756 26 Y 4.0525 8.4573 120.0792 60.9113 38.7414 178.4246 27 S 3.8056 8.2429 115.1380 61.0281 63.0930 176.2827 28 A 3.8943 7.8141 124.5497 54.7985 18.0092 179.0972 29 N 4.1148 8.1901 115.8041 56.6296 38.9189 176.8837 30 L 3.7082 7.7010 121.5286 57.9431 42.1073 178.8215 31 A 3.9054 7.8919 120.7613 55.3221 18.2761 179.3006 32 M 4.0136 8.1151 116.7867 58.8996 32.2875 177.9262 33 H 3.9112 8.3969 118.7364 59.2043 30.1658 177.3594 34 K 3.9032 8.2525 120.5008 59.3011 31.8640 179.0375 35 L 3.9729 7.9497 120.5595 58.5270 41.9828 178.7706 36 Y 3.8681 8.2371 116.5847 60.9067 37.4855 178.6440 37 R 4.0499 7.9343 118.7268 58.9364 30.1876 178.9437 38 G 3.7109 7.6761 104.7339 47.5571 0.0000 175.9715 39 L 3.9183 7.8081 121.5530 57.3469 41.5617 179.1460 40 L 3.9983 8.2656 117.8536 55.9582 41.8386 178.8527 41 K 3.8481 7.7701 120.4550 59.5330 31.8508 178.3107 42 A 4.1140 7.4849 119.6846 54.0528 18.3667 178.4527 43 L 4.4303 7.9114 115.5477 53.4077 43.2923 175.5621 44 D 4.4162 7.8485 117.2339 55.3425 39.9884 172.6615 45 L 5.0529 7.5740 115.7308 52.5797 46.1677 177.3214 46 T 4.5325 8.2762 111.1447 60.5626 71.7211 175.4109 47 Y 4.1419 8.5387 122.1269 60.7655 38.9267 176.7441 48 P 4.1434 0.0000 0.0000 65.5758 31.4330 178.6665 49 Q 3.9548 7.8620 116.4138 58.9283 28.4948 178.0496 50 Y 4.0176 8.1392 120.8158 60.6492 38.8969 178.0763 51 L 3.5736 7.6520 119.9377 57.6531 41.6476 179.7016 52 V 3.4004 7.4120 117.7478 66.1981 31.4414 178.0355 53 M 3.3289 7.4229 118.3684 57.8903 31.0987 178.6214 54 L 3.9737 7.3311 119.4255 57.6358 41.6957 179.7672 55 V 3.5267 7.3614 117.8143 66.0973 31.2912 178.1915 56 L 4.2889 7.2218 118.5339 57.0258 41.4821 179.3388 57 W 4.5482 8.2700 118.2575 58.8501 28.9424 177.5128 58 E 4.6266 7.6997 117.3597 57.0868 29.9007 176.0488 59 T 4.3683 8.1982 118.1769 61.4163 70.2921 173.1712 60 D 4.4092 8.4877 125.8305 53.8749 42.6713 175.5667 61 E 3.9012 8.3826 118.6377 57.5299 26.4229 174.6338 62 R 4.7766 7.7974 118.1961 54.1687 33.4220 176.9881 63 S 4.4910 8.9402 116.5133 57.8932 65.3997 175.6893 64 V 3.5641 8.2217 121.7185 66.1098 31.1396 178.2760 65 S 4.0477 7.9195 112.5261 61.3576 62.1101 175.7629 66 E 4.0697 8.1775 121.2727 59.5120 29.1867 179.4516 67 I 3.7353 7.8627 119.9636 64.1028 37.1454 178.6829 68 G 3.5535 8.0470 106.8044 47.8004 0.0000 175.4909 69 E 3.9912 8.0165 118.4634 58.0538 29.6754 178.5799 70 R 3.8050 7.1908 119.4621 58.4307 30.3505 177.1815 71 L 4.3240 7.4124 115.4794 53.5550 42.2348 175.8851 72 Y 3.6641 7.2846 115.0092 59.1468 35.4270 169.5667 73 L 4.8489 7.7635 117.8773 52.6284 45.0236 177.1148 74 D 4.7254 8.2835 121.6256 52.6479 42.0197 177.6698 75 S 4.0914 8.5630 115.7507 61.8892 62.5626 176.8953 76 A 3.9704 7.9868 121.8226 55.3253 18.1651 179.1996 77 T 4.1001 8.5140 113.9471 66.2471 68.9702 176.7372 78 L 4.0869 7.9023 122.2140 57.9891 42.1059 178.6794 79 T 3.8645 8.1001 116.2382 66.5659 68.4903 174.4383 80 P 4.2562 0.0000 0.0000 65.4748 31.3542 178.6508 81 L 3.9551 7.8429 117.2561 57.9307 41.5541 179.4600 82 L 3.9652 8.0418 118.8541 57.7363 41.4436 179.8027 83 K 3.9824 8.0718 118.4699 59.3682 31.9631 179.7002 84 R 3.9493 7.9194 118.5535 59.0687 29.9835 179.0079 85 L 3.9885 8.0937 118.9991 57.6490 41.5449 179.3521 86 Q 4.4473 8.6395 120.9136 58.7910 28.8485 178.1098 87 A 4.0856 8.0338 120.3600 54.8864 18.4708 178.6501 88 A 4.2775 7.8024 116.8395 52.0060 18.7608 177.8655 89 G 3.8834 8.0788 105.4964 46.4403 0.0000 174.8094 90 L 4.5259 7.8699 121.1966 55.1796 43.5188 176.6867 91 V 5.0810 7.6441 117.5369 61.2434 35.6033 173.9430 92 T 4.9732 8.7223 114.3297 59.8596 72.3859 172.8488 93 R 4.7635 8.5476 121.2030 54.8659 32.5765 175.3501 94 T 4.4605 8.4254 123.8622 62.0435 70.4791 175.3257 95 R 3.9375 8.5129 128.0555 56.7318 29.8192 172.9758 *103 V 3.6908 8.2006 124.3713 62.7544 33.0456 172.6979 104 I 3.1252 8.3593 131.5058 61.5468 35.7329 172.1965 105 I 4.9729 9.2439 126.7854 59.3815 39.5163 175.0120 106 A 5.1649 8.3747 127.2795 49.7372 22.4260 175.4550 107 L 4.6418 9.0950 121.3465 55.2083 42.7130 177.1354 108 T 4.4344 8.3701 112.7927 60.3346 71.5358 175.4716 109 E 3.9725 8.8141 120.0803 59.9862 29.3182 179.7785 110 T 4.0342 7.9524 115.3527 66.5845 68.4002 176.8866 111 G 3.7427 8.0742 106.6163 47.8388 0.0000 175.4455 112 R 4.2710 8.5158 121.1656 59.2315 30.0136 178.5229 113 A 3.9803 8.2201 120.6805 54.8716 18.3657 179.2443 114 L 3.9479 8.1186 118.9426 58.0155 42.0824 179.1182 115 R 2.5100 7.3574 119.3330 58.6837 29.9191 178.3236 116 S 3.9643 7.4687 114.3388 61.3881 63.0055 176.3553 117 K 4.1858 7.6198 119.5368 58.1097 32.6601 178.5878 118 A 4.3153 7.7351 122.4823 54.5754 17.9745 179.4305 119 G 3.6357 7.6218 103.3653 47.9675 0.0000 175.4913 120 A 4.0941 7.6665 121.2170 54.3162 18.2328 179.7430 121 V 3.3707 7.9596 117.6629 65.6890 31.7232 176.3316 122 P 4.3408 0.0000 0.0000 65.3553 31.0730 178.1261 123 E 3.9944 7.9191 118.0042 59.7510 29.5411 179.1439 124 Q 4.0238 8.1220 117.8447 58.6320 28.6620 178.7962 125 V 3.5437 7.9899 119.6677 65.8090 31.3459 177.7733 126 F 4.2326 8.1523 119.2815 61.4944 39.4161 176.2725 127 C 3.8929 7.8973 118.0042 62.4672 31.1546 175.4664 128 A 3.9467 8.0668 121.3786 55.1866 17.9759 179.5586 129 S 4.0911 8.3782 113.2895 59.2383 62.6011 174.7677 130 A 3.7824 7.1803 122.8558 53.1314 16.5171 176.5157 131 C 4.8479 6.9762 115.5841 59.6844 30.7414 174.6557 132 S 4.7870 8.5896 116.8077 57.2738 65.4446 175.2728 133 L 4.0308 8.6188 122.4556 58.3868 41.3620 179.5916 134 D 4.3974 8.1377 117.9521 57.5069 40.8277 178.5943 135 E 3.9989 8.3028 119.0290 59.1961 29.3972 179.1949 136 L 4.0237 8.2550 120.6761 58.2743 42.2578 179.3229 137 R 3.9570 8.0959 116.0773 59.1980 29.3151 178.6012 138 Q 3.9412 8.2967 120.4609 58.9210 29.0833 177.8932 139 L 3.9695 8.1121 121.4846 57.9533 42.1505 178.7995 140 K 3.9804 8.3292 119.7836 59.6025 32.0828 178.8170 141 Q 4.3125 8.1960 119.7027 58.6137 28.6192 178.6804 142 E 3.9982 8.2347 119.6033 59.2989 29.3748 179.4216 143 L 4.0232 8.0552 119.2320 57.5833 41.1048 179.3695 144 E 3.9177 8.1864 118.6923 59.2837 29.3606 179.2005 145 K 3.9280 8.2024 119.7519 59.4049 32.2170 178.5953 146 L 3.9006 8.0307 120.6715 57.9916 41.9384 178.7483 147 R 3.7849 8.1425 118.9381 59.4552 29.8850 178.3898 148 S 3.9722 7.9307 112.6791 61.5372 62.2195 176.2096 149 S 4.1095 7.9817 116.5300 61.7458 62.6735 176.4700 150 L 4.2055 8.2453 120.8889 57.5723 41.4149 179.3327 151 G 3.7328 7.7462 103.6285 46.3148 0.0000 174.0584 152 A 4.3274 7.6004 126.9697 52.3939 18.7295 176.8860 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 9 A 8.26 4.28 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 10 R 8.13 4.16 0.00 1.91 2.02 0.00 3.30 0.00 0.00 3.30 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 11 T 7.51 3.97 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 1.20 0.00 0.00 12 D 7.99 4.37 0.00 2.85 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.00 4.16 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 1.20 0.00 0.00 14 L 7.89 4.01 0.00 1.79 1.77 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.31 4.41 0.00 1.53 1.66 0.90 1.01 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 16 Q 7.32 4.10 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 17 L 8.64 3.76 0.00 1.49 1.49 -0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.06 4.65 0.00 2.72 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 19 N 7.95 4.83 0.00 2.84 2.82 0.00 0.00 6.89 7.80 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 20 Q 7.95 4.49 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 21 L 8.55 4.01 0.00 1.77 1.68 0.93 0.90 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 22 S 8.16 4.18 0.00 4.12 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.26 4.33 0.00 3.07 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 24 A 7.90 3.85 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 25 L 8.01 3.80 0.00 1.78 1.87 0.91 0.64 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 26 Y 8.46 4.05 0.00 3.06 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.24 3.81 0.00 3.71 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 28 A 7.81 3.89 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 29 N 8.19 4.11 0.00 2.75 2.81 0.00 0.00 6.83 6.38 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 30 L 7.70 3.71 0.00 1.43 1.52 0.71 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.89 3.91 1.34 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 0.00 0.00 32 M 8.12 4.01 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 33 H 8.40 3.91 0.00 3.06 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.25 3.90 0.00 1.94 1.82 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.65 7.81 35 L 7.95 3.97 0.00 1.90 1.87 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.24 3.87 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.93 4.05 0.00 1.92 1.97 0.00 3.15 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 38 G 7.68 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 39 L 7.81 3.92 0.00 1.44 1.42 0.85 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.27 4.00 0.00 1.75 1.85 1.10 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.77 3.85 0.00 1.93 1.87 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.47 7.81 42 A 7.48 4.11 1.27 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 43 L 7.91 4.43 0.00 1.80 1.87 1.18 1.34 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 44 D 7.85 4.42 0.00 2.82 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.57 5.05 0.00 1.72 1.60 1.13 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 46 T 8.28 4.53 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 1.25 0.00 0.00 47 Y 8.54 4.14 0.00 3.09 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 48 P 0.00 4.14 0.00 2.21 2.10 0.00 3.75 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 49 Q 7.86 3.95 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 50 Y 8.14 4.02 0.00 3.01 2.95 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 51 L 7.65 3.57 0.00 1.67 1.49 0.83 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.41 3.40 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 0.87 0.00 0.00 0.88 0.00 0.00 53 M 7.42 3.33 0.00 0.51 1.26 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 54 L 7.33 3.97 0.00 1.58 1.59 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.36 3.53 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 0.96 0.00 0.00 0.83 0.00 0.00 56 L 7.22 4.29 0.00 1.46 1.58 0.75 0.86 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 57 W 8.27 4.55 0.00 3.30 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 58 E 7.70 4.63 0.00 2.04 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 0.00 2.27 2.35 0.00 59 T 8.20 4.37 4.21 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 1.19 0.00 0.00 60 D 8.49 4.41 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 61 E 8.38 3.90 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 62 R 7.80 4.78 0.00 1.79 1.75 0.00 3.25 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 63 S 8.94 4.49 0.00 4.00 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 64 V 8.22 3.56 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 0.99 0.00 0.00 0.90 0.00 0.00 65 S 7.92 4.05 0.00 3.90 3.81 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 66 E 8.18 4.07 0.00 2.17 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 67 I 7.86 3.74 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.83 0.81 0.00 0.00 68 G 8.05 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.02 3.99 0.00 2.04 2.03 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 2.53 2.21 0.00 70 R 7.19 3.80 0.00 1.83 2.01 0.00 3.19 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 71 L 7.41 4.32 0.00 1.60 1.64 0.81 0.78 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 72 Y 7.28 3.66 0.00 3.17 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 73 L 7.76 4.85 0.00 1.59 1.54 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.28 4.73 0.00 2.95 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.56 4.09 0.00 3.88 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 76 A 7.99 3.97 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 T 8.51 4.10 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 78 L 7.90 4.09 0.00 1.95 1.62 0.87 0.71 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 79 T 8.10 3.86 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 1.20 0.00 0.00 80 P 0.00 4.26 0.00 2.15 2.10 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 81 L 7.84 3.96 0.00 1.80 1.68 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.04 3.97 0.00 1.79 1.68 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.07 3.98 0.00 1.95 1.85 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.80 7.81 84 R 7.92 3.95 0.00 2.03 1.97 0.00 3.27 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 85 L 8.09 3.99 0.00 1.82 1.66 0.80 0.53 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 86 Q 8.64 4.45 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 87 A 8.03 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 7.80 4.28 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.08 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 90 L 7.87 4.53 0.00 1.62 1.73 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.64 5.08 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 0.99 0.00 0.00 0.84 0.00 0.00 92 T 8.72 4.97 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 1.21 0.00 0.00 93 R 8.55 4.76 0.00 1.66 1.85 0.00 3.13 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 94 T 8.43 4.46 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 1.20 0.00 0.00 95 R 8.51 3.94 0.00 1.60 1.76 0.00 3.30 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 *103 V 8.20 3.69 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.92 0.00 0.00 104 I 8.36 3.13 2.05 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 1.39 0.85 0.89 0.00 0.00 105 I 9.24 4.97 1.81 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 1.11 0.98 0.85 0.00 0.00 106 A 8.37 5.16 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 0.00 107 L 9.10 4.64 0.00 1.57 1.68 1.18 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.37 4.43 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 1.23 0.00 0.00 109 E 8.81 3.97 0.00 2.09 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 0.00 2.41 2.48 0.00 110 T 7.95 4.03 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 1.26 0.00 0.00 111 G 8.07 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.52 4.27 0.00 2.10 2.12 0.00 3.13 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 113 A 8.22 3.98 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 0.00 114 L 8.12 3.95 0.00 2.13 2.28 1.16 1.24 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 0.00 115 R 7.36 2.51 0.00 0.67 1.44 0.00 2.96 0.00 0.00 2.84 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 116 S 7.47 3.96 0.00 3.95 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 0.00 117 K 7.62 4.19 0.00 2.04 2.07 0.00 1.35 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.53 7.81 118 A 7.74 4.32 1.34 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 0.00 0.00 119 G 7.62 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 0.00 120 A 7.67 4.09 1.34 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 0.00 0.00 121 V 7.96 3.37 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.84 0.00 0.00 122 P 0.00 4.34 0.00 2.26 2.20 0.00 3.93 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 123 E 7.92 3.99 0.00 2.31 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 0.00 2.33 2.45 0.00 124 Q 8.12 4.02 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 125 V 7.99 3.54 2.30 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 1.21 0.00 0.00 0.84 0.00 0.00 126 F 8.15 4.23 0.00 3.05 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 0.00 127 C 7.90 3.89 0.00 2.97 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 0.00 128 A 8.07 3.95 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 0.00 129 S 8.38 4.09 0.00 3.94 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 0.00 130 A 7.18 3.78 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 0.00 131 C 6.98 4.85 0.00 3.00 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 0.00 132 S 8.59 4.79 0.00 4.14 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 0.00 133 L 8.62 4.03 0.00 1.76 1.76 0.25 0.88 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 0.00 134 D 8.14 4.40 0.00 2.72 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 0.00 135 E 8.30 4.00 0.00 2.33 2.03 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 2.35 2.35 0.00 136 L 8.26 4.02 0.00 1.89 1.95 1.17 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 137 R 8.10 3.96 0.00 2.12 2.20 0.00 2.84 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 138 Q 8.30 3.94 0.00 2.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 139 L 8.11 3.97 0.00 1.90 1.83 0.93 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.33 3.98 0.00 2.05 1.93 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.54 7.81 141 Q 8.20 4.31 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 142 E 8.23 4.00 0.00 2.14 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 2.52 2.50 0.00 143 L 8.06 4.02 0.00 1.87 1.71 0.96 0.91 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 0.00 144 E 8.19 3.92 0.00 2.22 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 2.36 2.64 0.00 145 K 8.20 3.93 0.00 1.93 1.98 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.45 7.81 146 L 8.03 3.90 0.00 1.89 1.81 0.92 0.71 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 0.00 147 R 8.14 3.78 0.00 1.88 1.96 0.00 2.31 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.44 0.00 148 S 7.93 3.97 0.00 3.90 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 0.00 149 S 7.98 4.11 0.00 3.97 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 0.00 150 L 8.25 4.21 0.00 1.66 1.71 0.91 0.92 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 0.00 151 G 7.75 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 0.00 0.00 0.00 152 A 7.60 4.33 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 * Residues marked with a * may have inaccurate shift predictions.