NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4735 8.3044 120.6134 56.2078 33.8430 173.3606 2 M 4.2743 7.9830 120.2273 54.9278 36.6162 171.3429 3 I 5.0375 9.1630 122.6340 59.6831 39.9062 175.3588 4 R 4.7143 9.2377 124.5362 54.3790 34.7353 174.7153 5 G 4.1761 8.7717 109.5325 46.0578 0.0000 172.8347 6 I 4.7640 8.9995 124.1983 59.3549 40.2360 174.8951 7 R 5.0613 8.9680 125.4891 54.9193 32.6191 175.4772 8 G 4.3332 8.6705 107.9369 45.2126 0.0000 171.1289 9 A 5.2708 8.6573 120.7609 51.2490 23.3354 175.1956 10 T 5.1784 8.9615 114.1950 61.4558 71.7240 172.0229 11 T 5.8034 8.2217 111.9729 59.0156 72.1300 173.2216 12 V 4.5587 8.2020 114.0754 59.7095 34.7299 175.9050 13 E 4.2565 9.0309 121.5198 58.2166 29.8920 177.5520 14 R 4.6795 7.5993 115.3379 54.4767 34.2810 175.1582 15 D 4.6131 8.3981 121.3517 53.2846 39.8558 175.4647 16 T 4.6777 7.3837 115.8557 58.7879 72.2293 172.9545 17 E 3.9213 8.6449 127.0577 59.3938 29.8188 179.0240 18 E 3.9709 8.1213 117.1816 59.5880 29.5405 178.8811 19 E 3.9580 8.0522 119.0231 59.0630 29.5834 179.1887 20 I 3.7042 7.8141 119.8568 64.3963 37.2052 178.5554 21 L 3.9651 8.2919 120.2901 57.6100 41.4039 179.3782 22 Q 3.8872 8.1975 119.5452 59.3132 29.0458 178.5771 23 K 4.0212 8.4178 119.8320 59.4905 31.9723 179.6926 24 T 3.8334 8.1371 116.4794 66.3537 68.3454 176.5948 25 K 3.7660 8.4825 121.9403 59.7482 32.1195 178.8478 26 Q 4.2293 8.1459 119.5684 58.1484 28.5146 178.4918 27 L 3.8654 8.0507 121.5618 58.0602 42.1362 178.9432 28 L 3.7935 7.9050 118.9881 57.7869 41.5618 179.3454 29 E 3.8085 8.3516 118.8179 59.2497 29.3303 179.3981 30 K 4.2305 8.0206 120.9431 58.9708 32.1775 178.7017 31 I 3.6145 7.7932 120.1839 64.6970 37.0260 178.4809 32 I 3.7631 8.1067 120.7991 64.2927 36.8971 178.3796 33 E 3.9492 8.4704 119.9463 59.4200 29.0960 179.0362 34 E 4.1637 8.2004 117.1481 57.8999 29.5455 177.6344 35 N 4.6940 8.3005 114.6700 52.1263 39.3297 175.1771 36 H 4.1623 8.0539 116.2015 56.8457 26.8608 174.9041 37 T 4.0621 7.3833 113.5316 63.6273 68.8445 174.3139 38 K 4.5083 8.4736 126.1950 54.1700 33.7972 175.9547 39 P 2.9700 0.0000 0.0000 65.1744 30.9786 178.0373 40 E 3.9383 7.7396 114.8396 57.9512 29.9386 176.8354 41 D 4.5120 7.8378 119.1153 54.2887 41.3811 175.8824 42 V 4.2415 7.2892 120.8243 61.9200 31.9453 175.6821 43 V 3.8700 8.9346 129.0693 65.2222 31.8080 175.5611 44 Q 4.7967 7.5038 115.5266 56.1887 31.4254 171.9957 45 M 5.4067 8.8318 118.1749 53.6793 36.7899 174.5687 46 L 5.3418 8.9695 121.0609 52.9801 45.7810 175.4960 47 L 5.3591 8.8183 122.5804 52.9236 45.1709 175.7328 48 S 5.9703 9.5483 117.5055 55.8184 66.4162 172.8089 49 A 5.2404 8.2392 121.8107 50.0760 22.6021 175.8263 50 T 4.3553 8.4722 111.8100 60.9073 70.0643 173.4193 51 P 4.3897 0.0000 0.0000 63.8581 31.3688 176.3880 52 D 4.6153 7.8674 117.5199 53.5313 39.8915 175.7215 53 L 4.7772 7.5444 120.6631 53.6897 43.5110 175.9270 54 H 4.7648 9.3047 117.6101 54.9648 31.2881 174.5242 55 A 4.1333 8.2748 122.5875 54.7179 18.5405 177.8335 56 V 4.3280 6.9522 111.8221 60.2492 34.1308 173.4847 57 F 4.2807 8.5057 120.4654 56.7887 39.2907 175.0737 58 P 4.2791 0.0000 0.0000 65.2901 31.1100 178.3344 59 A 4.0303 8.2767 119.3397 54.8439 18.1268 179.0608 60 K 3.8085 8.3888 118.3284 59.9270 31.9129 178.7174 61 A 4.0424 8.0419 120.1080 54.7405 18.5376 179.5836 62 V 3.6225 7.5837 116.6256 66.3406 31.5648 178.4194 63 R 4.0092 8.0133 116.4423 58.6637 29.9616 177.9401 64 E 4.3921 7.9285 115.9614 55.3255 30.2719 176.0868 65 L 4.0404 7.5059 123.4050 54.0950 42.6788 175.9489 66 S 4.2319 8.6794 120.7366 60.2403 62.4806 174.4517 67 G 4.0909 8.6128 115.1139 45.5432 0.0000 173.7596 68 W 4.5351 8.5504 119.4476 56.3873 29.2684 177.8233 69 Q 3.9982 7.9667 117.1654 58.1908 28.1880 176.2531 70 Y 4.5149 7.5533 114.7471 57.5823 38.4903 175.3836 71 V 3.8182 7.7694 121.9890 61.5148 31.9166 173.7799 72 P 4.6728 0.0000 0.0000 62.8280 32.3260 175.6682 73 V 5.4764 8.1637 121.9909 60.3425 34.7209 173.6601 74 T 4.6355 8.3634 115.3293 61.5625 71.1956 171.5677 75 C 5.8686 8.6511 121.8878 57.9691 31.6567 172.5896 76 M 4.7923 8.1237 115.1508 54.4817 34.1350 173.3363 77 Q 4.7401 8.5269 121.5080 55.4375 29.9413 175.1338 78 E 4.2802 8.9158 128.1910 55.8949 30.5033 176.4607 79 M 4.0684 8.6156 124.0606 55.6838 32.5892 176.2056 80 D 4.5844 8.4188 121.2166 53.0336 40.9287 175.4234 81 V 4.2719 7.8335 126.4453 60.7025 33.2491 175.1356 82 T 3.9368 8.3996 123.7069 65.4227 68.3562 174.6428 83 G 3.9277 9.0346 114.9785 45.1901 0.0000 173.5233 84 G 3.7451 8.2184 108.7379 44.5490 0.0000 173.6301 85 L 3.9804 8.2464 122.7135 54.8462 42.5261 177.3190 86 K 4.2099 8.4909 125.1169 56.4145 33.5354 176.2478 87 K 3.8809 8.9182 117.7294 58.2714 30.3188 174.5093 88 C 5.3289 8.1578 117.7709 57.6208 35.0599 172.9787 89 I 4.9645 8.7940 126.6164 59.6765 39.4068 174.8540 90 R 5.2683 8.9908 125.9150 54.2696 33.7697 175.2293 91 V 4.9042 8.6911 120.8601 60.1607 35.2051 174.4234 92 M 4.6691 9.1487 122.4775 54.2745 34.8410 173.3688 93 M 4.7714 9.2427 127.7074 54.2457 34.5273 174.5280 94 T 4.9820 8.9819 123.9141 62.3520 70.5785 174.3985 95 V 4.9321 8.9594 119.3214 59.5041 36.5764 174.2307 96 Q 4.8224 8.8014 124.7181 55.7368 29.2666 174.7906 97 T 4.5996 9.0134 119.7747 61.7066 71.2413 173.2397 98 D 4.7614 8.7127 123.7514 52.9219 40.4258 176.9326 99 V 3.6748 7.5104 121.3003 62.3601 32.0784 174.0604 100 P 4.4669 0.0000 0.0000 62.1796 31.8198 176.8683 101 Q 3.9496 8.9415 122.2859 59.5964 28.8180 178.1600 102 D 4.7625 8.0871 113.0375 53.9947 39.5677 176.2780 103 Q 4.5356 7.9616 118.0302 55.8013 30.2318 176.1452 104 I 3.6009 7.2417 119.0042 61.5807 37.4659 176.0657 105 R 4.3198 8.7871 124.8925 54.9686 29.6032 175.7401 106 H 4.6369 8.3068 120.3440 55.2315 30.0704 175.2006 107 V 4.2198 8.1448 121.7679 61.1576 34.1949 173.7035 108 Y 5.0981 8.5953 124.9799 56.4130 40.3248 174.7908 109 L 4.7501 8.8986 123.9535 52.3657 45.9132 177.5109 110 E 3.5373 8.7653 118.7967 57.9679 28.0989 177.7269 111 K 4.2403 8.8837 122.4959 59.0035 32.1278 177.9260 112 A 4.2787 8.0380 121.1256 53.4207 18.3087 179.4190 113 V 3.6797 7.7589 111.7434 64.0850 31.3816 178.3777 114 V 3.7796 7.6643 117.4801 63.5213 31.3000 177.2811 115 L 4.1875 7.5311 118.7972 54.1687 42.2912 176.9807 116 R 3.3673 6.9827 116.7155 55.0170 29.9548 175.2292 117 P 4.2356 0.0000 0.0000 63.3954 32.2551 175.5016 118 D 4.3569 7.9274 118.0104 55.3499 38.2057 173.5512 119 L 4.1867 7.6398 116.6565 54.5526 42.9332 178.1980 120 S 4.5344 8.2240 114.7792 56.3170 63.9347 174.2631 121 L 4.0102 8.3451 131.7877 57.7253 41.8159 178.3327 122 T 3.8594 7.9032 109.0332 64.4042 68.8434 175.5047 123 K 4.1741 8.0152 121.7970 58.5680 32.3329 178.1477 124 N 4.3541 8.2341 117.0287 56.5120 38.9473 176.3619 125 T 4.1308 7.9866 109.4684 63.2491 69.0698 174.7338 126 E 4.5704 8.1289 120.3531 56.9038 31.8848 175.9397 127 L 4.3239 7.6298 121.9524 54.9268 42.8295 175.9142 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.47 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.74 0.00 2 M 7.98 4.27 0.00 2.13 1.85 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 3 I 9.16 5.04 1.88 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 1.34 1.02 0.97 0.00 0.00 4 R 9.24 4.71 0.00 1.63 1.77 0.00 3.30 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 5 G 8.77 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 0.00 0.00 0.00 6 I 9.00 4.76 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 1.23 0.80 0.88 0.00 0.00 7 R 8.97 5.06 0.00 1.68 1.81 0.00 3.34 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 8 G 8.67 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 0.00 0.00 0.00 0.00 9 A 8.66 5.27 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 10 T 8.96 5.18 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 1.24 0.00 0.00 11 T 8.22 5.80 4.29 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 1.28 0.00 0.00 12 V 8.20 4.56 2.31 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 0.76 0.00 0.00 0.99 0.00 0.00 13 E 9.03 4.26 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 14 R 7.60 4.68 0.00 1.72 1.75 0.00 3.19 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 15 D 8.40 4.61 0.00 2.60 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 16 T 7.38 4.68 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 1.24 0.00 0.00 17 E 8.64 3.92 0.00 2.06 1.92 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 2.37 2.37 0.00 18 E 8.12 3.97 0.00 2.27 2.19 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 2.35 2.45 0.00 19 E 8.05 3.96 0.00 2.02 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 2.39 2.38 0.00 20 I 7.81 3.70 1.85 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 1.50 0.66 0.90 0.00 0.00 21 L 8.29 3.97 0.00 1.65 1.70 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.20 3.89 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 23 K 8.42 4.02 0.00 1.85 1.82 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.80 7.81 24 T 8.14 3.83 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 1.24 0.00 0.00 25 K 8.48 3.77 0.00 1.74 1.95 0.00 1.58 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.38 7.81 26 Q 8.15 4.23 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 27 L 8.05 3.87 0.00 1.77 1.82 0.88 0.48 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 28 L 7.90 3.79 0.00 1.61 1.26 0.78 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.35 3.81 0.00 2.01 1.92 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 2.21 2.34 0.00 30 K 8.02 4.23 0.00 1.90 1.86 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.39 1.33 7.81 31 I 7.79 3.61 1.94 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.61 0.90 0.00 0.00 32 I 8.11 3.76 1.96 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.60 1.05 0.00 0.00 33 E 8.47 3.95 0.00 2.09 1.98 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 2.32 2.42 0.00 34 E 8.20 4.16 0.00 1.86 1.95 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 2.28 2.57 0.00 35 N 8.30 4.69 0.00 2.81 2.82 0.00 0.00 6.91 9.02 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 36 H 8.05 4.16 0.00 3.34 3.44 0.00 5.85 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.38 4.06 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 38 K 8.47 4.51 0.00 1.91 1.84 0.00 1.67 0.00 0.00 2.02 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.43 7.81 39 P 0.00 2.97 0.00 1.55 0.49 0.00 3.55 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.64 0.00 40 E 7.74 3.94 0.00 2.00 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 2.18 2.20 0.00 41 D 7.84 4.51 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.29 4.24 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.77 0.00 0.00 43 V 8.93 3.87 2.19 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 0.81 0.00 0.00 0.92 0.00 0.00 44 Q 7.50 4.80 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.62 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 45 M 8.83 5.41 0.00 1.99 2.00 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 2.63 2.62 0.00 46 L 8.97 5.34 0.00 1.57 1.53 0.94 0.69 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 47 L 8.82 5.36 0.00 1.61 1.55 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.55 5.97 0.00 3.89 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 49 A 8.24 5.24 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 50 T 8.47 4.36 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 51 P 0.00 4.39 0.00 2.20 2.37 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 52 D 7.87 4.62 0.00 2.76 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 53 L 7.54 4.78 0.00 1.65 1.52 0.85 1.02 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 54 H 9.30 4.76 0.00 3.04 3.16 0.00 5.66 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 55 A 8.27 4.13 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 56 V 6.95 4.33 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 0.67 0.00 0.00 0.97 0.00 0.00 57 F 8.51 4.28 0.00 3.12 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 58 P 0.00 4.28 0.00 2.19 2.11 0.00 3.73 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 59 A 8.28 4.03 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 60 K 8.39 3.81 0.00 1.94 1.97 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.50 7.81 61 A 8.04 4.04 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 62 V 7.58 3.62 2.25 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 1.24 0.00 0.00 0.92 0.00 0.00 63 R 8.01 4.01 0.00 1.83 1.97 0.00 3.19 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 64 E 7.93 4.39 0.00 1.94 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 0.00 2.29 2.45 0.00 65 L 7.51 4.04 0.00 1.76 1.57 0.75 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.68 4.23 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.61 4.09 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 0.00 0.00 0.00 68 W 8.55 4.54 0.00 3.53 3.33 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 69 Q 7.97 4.00 0.00 1.84 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.55 0.00 70 Y 7.55 4.51 0.00 2.96 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 71 V 7.77 3.82 2.36 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 0.89 0.00 0.00 0.70 0.00 0.00 72 P 0.00 4.67 0.00 2.17 2.19 0.00 3.73 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 2.20 1.97 0.00 73 V 8.16 5.48 2.15 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 0.57 0.00 0.00 1.02 0.00 0.00 74 T 8.36 4.64 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 1.22 0.00 0.00 75 C 8.65 5.87 0.00 3.08 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 76 M 8.12 4.79 0.00 2.08 2.14 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 2.58 2.72 0.00 77 Q 8.53 4.74 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 7.05 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 78 E 8.92 4.28 0.00 1.99 1.88 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 2.33 2.34 0.00 79 M 8.62 4.07 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 80 D 8.42 4.58 0.00 2.63 2.61 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 81 V 7.83 4.27 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 0.93 0.00 0.00 82 T 8.40 3.94 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 83 G 9.03 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.22 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 85 L 8.25 3.98 0.00 1.59 1.60 0.92 0.68 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 86 K 8.49 4.21 0.00 1.78 1.83 0.00 2.11 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.39 7.81 87 K 8.92 3.88 0.00 1.92 1.89 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.44 7.81 88 C 8.16 5.33 0.00 3.13 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 0.00 89 I 8.79 4.96 1.87 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 1.22 0.67 0.95 0.00 0.00 90 R 8.99 5.27 0.00 1.75 1.82 0.00 3.13 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 91 V 8.69 4.90 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 0.71 0.00 0.00 0.94 0.00 0.00 92 M 9.15 4.67 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 93 M 9.24 4.77 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.60 0.00 94 T 8.98 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 1.22 0.00 0.00 95 V 8.96 4.93 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 0.71 0.00 0.00 0.99 0.00 0.00 96 Q 8.80 4.82 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.67 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 97 T 9.01 4.60 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 1.22 0.00 0.00 98 D 8.71 4.76 0.00 2.81 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 99 V 7.51 3.67 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 0.79 0.00 0.00 0.95 0.00 0.00 100 P 0.00 4.47 0.00 2.23 1.96 0.00 3.68 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 2.12 2.07 0.00 101 Q 8.94 3.95 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.07 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 102 D 8.09 4.76 0.00 2.83 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 0.00 103 Q 7.96 4.54 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.84 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 104 I 7.24 3.60 1.80 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 1.59 0.75 0.82 0.00 0.00 105 R 8.79 4.32 0.00 1.80 2.03 0.00 3.30 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 106 H 8.31 4.64 0.00 3.12 3.18 0.00 5.83 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.14 4.22 1.90 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 0.97 0.00 0.00 0.94 0.00 0.00 108 Y 8.60 5.10 0.00 2.94 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 0.00 109 L 8.90 4.75 0.00 1.53 1.54 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.77 3.54 0.00 2.20 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 111 K 8.88 4.24 0.00 1.82 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.45 7.81 112 A 8.04 4.28 1.49 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 0.00 0.00 113 V 7.76 3.68 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 1.00 0.00 0.00 1.03 0.00 0.00 114 V 7.66 3.78 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 0.72 0.00 0.00 0.90 0.00 0.00 115 L 7.53 4.19 0.00 1.33 1.49 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 116 R 6.98 3.37 0.00 1.85 1.74 0.00 3.08 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 117 P 0.00 4.24 0.00 2.18 2.16 0.00 3.85 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 118 D 7.93 4.36 0.00 2.79 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 0.00 119 L 7.64 4.19 0.00 1.66 1.61 0.95 0.86 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 0.00 120 S 8.22 4.53 0.00 3.84 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 0.00 121 L 8.35 4.01 0.00 1.81 1.65 0.99 0.85 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 0.00 122 T 7.90 3.86 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 1.22 0.00 0.00 123 K 8.02 4.17 0.00 1.88 1.83 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.43 7.81 124 N 8.23 4.35 0.00 2.85 2.84 0.00 0.00 7.27 8.55 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 0.00 125 T 7.99 4.13 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 1.29 0.00 0.00 126 E 8.13 4.57 0.00 2.10 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 2.27 2.48 0.00 127 L 7.63 4.32 0.00 1.56 1.48 0.92 0.81 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