NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8742 8.0544 120.3012 61.6208 32.6256 174.0905 2 H 4.4593 8.4202 124.0251 53.4434 31.2545 171.8422 3 W 4.6453 8.2367 127.6496 55.0429 30.6343 176.4268 4 S 4.4087 8.5544 118.9429 57.7963 64.5192 175.3161 5 A 3.9646 8.3886 123.0873 55.3983 18.1600 179.3428 6 E 3.9201 8.3034 116.6858 59.8151 29.5083 179.4017 7 E 3.9983 8.1125 117.8034 59.5753 29.6391 179.2183 8 K 3.6365 7.9152 118.0134 59.9893 32.1130 178.6203 9 Q 3.8357 8.7610 116.6928 60.1506 27.9958 179.0231 10 L 4.0288 8.4849 123.1632 57.3707 42.3286 179.7810 11 I 3.8110 7.9500 119.4683 64.2226 37.2862 178.1477 12 T 4.1223 7.9305 116.6183 67.5610 68.2380 175.7190 13 G 3.8517 8.6839 105.6283 46.5556 0.0000 175.0495 14 L 4.3136 8.1698 121.8834 57.2036 43.2619 178.9986 15 W 4.4198 9.1647 128.6559 61.0015 30.6065 180.3040 16 G 3.4595 7.2909 103.7209 47.8465 0.0000 176.2010 17 K 4.3927 7.6126 117.5038 55.3387 32.7520 176.1096 18 V 4.1343 7.7145 120.3302 61.6882 32.4490 176.8889 19 N 4.5431 8.6554 126.4475 53.5213 37.0314 175.7916 20 V 3.3280 7.2081 122.9411 65.0827 33.2314 177.9537 21 A 4.0509 8.0114 121.4451 54.9463 18.0984 179.0646 22 D 4.3032 8.3933 117.6274 57.3611 41.0208 178.8278 23 C 4.1018 7.8847 116.9322 62.3651 28.1520 175.8913 24 G 3.7819 8.0724 107.2285 47.8835 0.0000 175.4913 25 A 4.0004 7.8639 123.4286 54.9035 18.6107 179.3841 26 E 3.8558 8.7192 117.3417 59.8369 29.4915 179.2524 27 A 3.9140 8.7280 121.2966 54.7226 18.5554 179.0340 28 L 3.7984 7.9775 117.0646 58.3918 42.1356 179.4393 29 A 3.9040 7.9390 120.1442 55.1598 18.2819 179.4743 30 R 3.7381 7.6570 116.2582 60.2511 30.1871 177.9723 31 L 3.8211 8.1710 118.1879 58.3720 41.5151 178.3421 32 L 3.8883 7.6277 122.7998 58.1133 42.1917 179.2785 33 I 3.9731 7.8446 118.7452 63.2622 37.4252 177.6937 34 V 3.7214 7.9841 118.5022 63.5878 32.9324 175.5934 35 Y 4.6155 7.5401 115.6269 55.0597 38.0352 174.6236 36 P 4.4761 0.0000 0.0000 65.7617 31.6383 178.2378 37 W 4.5296 8.0370 116.2935 59.7070 27.9129 177.8656 38 T 4.1051 7.2157 110.9915 65.0386 67.6988 176.1332 39 Q 4.2081 8.5836 121.3092 58.9749 28.5195 178.4141 40 R 3.9176 7.8007 118.4683 59.7419 30.0083 177.8088 41 F 3.8881 8.2067 115.8086 58.2686 39.6425 175.6730 42 F 4.5077 8.3088 118.3304 56.3154 39.0583 176.4800 43 A 4.3500 7.6742 125.0577 54.0654 19.9887 179.9519 44 S 4.4266 8.2514 107.2463 59.8958 62.8419 174.5813 45 F 5.0065 8.0953 116.5950 57.0302 39.8360 177.5441 46 G 3.6141 7.9809 110.7397 46.9615 0.0000 175.6907 47 N 4.6290 8.8737 125.3929 53.0404 38.9686 174.4129 48 L 4.8242 8.3912 125.9430 54.3597 42.5535 178.6245 49 S 4.0914 9.3578 118.0496 61.4433 62.9351 174.4765 50 S 4.5763 7.4829 114.2719 55.5825 66.9255 173.8639 51 P 4.2195 0.0000 0.0000 66.4356 30.8302 178.7315 52 T 3.7419 7.8482 114.8630 66.1540 68.5664 176.3718 53 A 3.9865 7.9710 122.6917 55.2076 18.1595 179.7625 54 I 3.6651 8.1038 117.5659 64.4962 37.2694 178.1169 55 L 4.1912 8.4945 119.7436 57.8884 41.5933 179.4922 56 G 3.9143 8.1426 103.6067 45.0607 0.0000 172.9888 57 N 4.1727 7.7083 119.7415 53.6529 39.1421 173.6451 58 P 4.3172 0.0000 0.0000 65.5369 31.3853 178.3924 59 M 3.8484 7.8192 117.4112 57.5819 31.8412 178.5658 60 V 3.6778 7.4977 118.1950 66.0637 31.8098 178.1591 61 R 4.0519 8.0985 116.8683 59.6113 29.6665 178.7846 62 A 3.8732 7.8743 120.5890 55.5593 18.4213 179.1662 63 H 4.2610 8.5396 116.6274 59.3628 30.2009 177.8680 64 G 4.1466 8.8170 110.3948 48.3508 0.0000 175.7378 65 K 4.1027 8.1059 122.7118 58.4147 32.3134 178.9814 66 K 3.9442 7.5120 118.8221 59.4689 32.1272 179.0668 67 V 3.6197 7.6584 118.2220 66.2482 31.5444 177.9117 68 L 4.4389 8.0971 119.4457 58.3543 41.6961 179.1154 69 T 4.1072 7.7522 114.8938 66.8298 68.8135 176.2018 70 S 4.2113 8.0590 114.5359 61.2534 62.3021 176.1008 71 F 4.1111 8.3368 120.4907 60.3937 38.5725 177.4263 72 G 3.4054 8.1354 105.2366 48.2699 0.0000 174.8507 73 D 4.3042 8.0706 119.4380 57.3680 41.0943 179.1392 74 A 4.0741 7.6639 120.1623 54.9404 18.8257 179.3488 75 V 3.0538 7.1939 115.5189 66.1587 31.6463 177.9655 76 K 3.9142 7.8256 117.1350 58.6406 33.1423 176.7168 77 N 5.0343 8.2247 115.5080 51.8502 39.0131 175.3051 78 L 3.6093 7.6404 122.3738 58.1192 42.1542 179.9604 79 D 4.7874 7.9057 114.6242 56.0790 40.7724 175.9922 80 N 5.1018 8.0959 118.6813 52.7863 39.4871 175.8368 81 I 3.9284 7.9028 118.2557 64.5794 38.0774 178.9950 82 K 4.3682 8.0017 120.5652 59.7784 32.3464 178.1806 83 N 4.5388 8.2439 115.8482 56.4396 38.6876 177.2546 84 T 4.0579 8.7082 114.4447 65.3140 68.5542 174.9454 85 F 4.7942 7.8677 119.2910 56.5126 40.3255 177.1608 86 S 4.1507 7.9935 118.9555 61.8288 62.5302 175.9286 87 Q 4.0511 7.8853 120.7494 57.9415 28.9695 177.7863 88 L 4.0274 7.8191 120.6980 57.7907 41.8580 178.9407 89 S 4.1092 7.7950 113.2540 61.4693 62.4833 175.9386 90 E 4.1103 7.7886 122.8345 58.6186 29.0861 179.0703 91 L 3.9248 7.9957 120.4448 58.5975 42.1868 178.7504 92 H 4.3635 8.2364 115.2320 57.7522 28.2894 176.4485 93 C 4.5875 7.5813 116.9966 61.4833 28.9033 175.9253 94 D 4.2904 7.7973 119.6605 57.5049 40.2567 178.7442 95 K 4.0708 7.4804 117.0748 59.2531 32.5041 178.4438 96 L 4.1203 8.4539 120.8309 55.9518 42.6074 176.8739 97 H 4.2548 7.9788 113.2164 55.9710 25.2898 175.7229 98 V 4.2459 8.2014 118.5610 61.0846 32.2119 174.8546 99 D 4.1746 8.8551 126.9494 54.3963 41.5455 175.2590 100 P 2.9700 0.0000 0.0000 65.3162 31.2233 178.0018 101 E 3.8620 8.1929 117.6293 58.8701 29.4121 177.8629 102 N 4.7017 8.2305 115.2793 54.5973 38.9258 177.0080 103 F 4.6221 7.9831 120.4377 60.4804 38.9917 177.4296 104 R 4.1000 7.9834 118.1261 59.0970 29.9651 178.3173 105 L 4.1046 7.7316 119.1901 57.6267 41.6399 179.1571 106 L 4.1565 8.1992 120.4250 58.2943 42.2386 179.0814 107 G 3.9416 8.4207 105.6428 48.2584 0.0000 175.2380 108 D 4.5307 8.0428 119.9974 56.9628 41.1778 178.5002 109 I 3.9653 7.9675 120.6589 63.8452 37.1490 177.6931 110 L 3.8330 8.4844 121.6319 58.5855 41.3733 179.3055 111 I 3.6476 7.5682 119.0202 64.0483 36.8500 178.1088 112 I 3.8376 7.7499 120.0889 63.2083 36.7504 178.4106 113 V 3.5284 7.2847 118.5521 65.5869 31.6953 177.1295 114 L 3.4842 7.6156 118.6513 57.7773 41.4108 179.4447 115 A 3.2416 7.0786 119.4663 54.1942 18.1194 179.2155 116 A 4.1906 7.3475 118.3586 54.1530 18.8031 178.1220 117 H 4.8259 7.4320 114.8035 56.0517 30.3536 175.0501 118 F 4.5374 7.5610 115.1734 58.1295 42.3438 175.8618 119 S 4.2229 6.8227 108.6875 58.1950 67.3425 177.1136 120 K 3.7016 8.9936 117.3310 59.5285 31.5262 176.8703 121 D 4.5749 8.1845 116.9019 55.8777 40.9400 176.9763 122 F 4.8631 8.5419 124.3137 56.6355 37.8810 174.9471 123 T 4.2046 7.5746 115.4527 59.9107 69.8557 174.4280 124 P 4.1078 0.0000 0.0000 66.0115 30.9925 178.4871 125 E 4.1550 8.0797 116.0767 58.4088 29.5826 177.9813 126 C 4.2671 7.8761 118.7924 61.4175 31.7860 175.1639 127 Q 3.5433 7.0843 118.7457 58.1549 28.7259 177.6958 128 A 4.1433 8.0907 121.4593 55.5009 18.7178 179.4149 129 A 3.9509 7.6468 119.4343 55.2883 18.5456 179.9820 130 W 4.0922 8.5507 117.2758 59.5358 28.7697 178.7521 131 Q 4.0828 8.5729 120.2555 58.7713 28.4535 177.8250 132 K 4.1223 8.0778 120.2342 58.8188 32.3319 178.0954 133 L 4.2342 7.7916 120.9070 58.0262 41.9831 178.8502 134 V 3.9225 8.3924 118.5698 65.4159 31.3531 177.5673 135 R 4.1695 7.4777 116.4205 59.0305 30.4133 178.2243 136 V 3.4849 7.4046 116.6057 66.1753 31.7787 177.7633 137 V 3.4268 7.8973 117.6624 65.2650 30.9604 177.2395 138 A 4.2537 7.6290 118.7908 53.4746 18.4851 178.1780 139 H 4.6504 8.3621 113.9106 56.7814 29.1738 176.2178 140 A 4.4600 7.6777 121.5891 52.6211 19.2086 178.4023 141 L 4.3139 7.5485 116.8729 56.4896 42.1989 178.5236 142 A 4.6896 7.6622 118.2937 52.8377 17.9755 179.3682 143 R 4.0834 7.8749 119.3953 61.0447 30.7265 179.7575 144 K 4.3078 7.1016 117.4143 56.4840 30.5589 176.1539 145 Y 4.5052 10.4909 113.0801 57.4973 41.0094 176.1230 146 H 4.6809 8.6450 124.1772 56.3607 29.1982 174.5834 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 V 8.05 3.87 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 0.88 0.00 0.00 0.33 0.00 0.00 2 H 8.42 4.46 0.00 3.12 3.16 0.00 5.91 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 W 8.24 4.65 0.00 3.25 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 4 S 8.55 4.41 0.00 4.12 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.39 3.96 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 6 E 8.30 3.92 0.00 2.10 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 2.43 2.51 0.00 7 E 8.11 4.00 0.00 2.44 2.32 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 2.43 2.43 0.00 8 K 7.92 3.64 0.00 1.91 1.74 0.00 1.61 0.00 0.00 1.48 0.00 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.54 7.81 9 Q 8.76 3.84 0.00 2.24 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 10 L 8.48 4.03 0.00 1.91 1.92 1.00 0.88 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 11 I 7.95 3.81 1.42 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.79 -0.19 0.00 0.00 12 T 7.93 4.12 4.49 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 1.28 0.00 0.00 13 G 8.68 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.17 4.31 0.00 2.30 2.27 -0.16 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.16 4.42 0.00 3.97 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.29 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.61 4.39 0.00 2.02 1.68 0.00 1.96 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.35 7.81 18 V 7.71 4.13 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.95 0.00 0.00 19 N 8.66 4.54 0.00 2.64 2.54 0.00 0.00 6.85 7.71 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 20 V 7.21 3.33 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 0.84 0.00 0.00 21 A 8.01 4.05 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 22 D 8.39 4.30 0.00 2.60 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 23 C 7.88 4.10 0.00 2.87 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 24 G 8.07 3.78 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 0.00 0.00 0.00 25 A 7.86 4.00 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 26 E 8.72 3.86 0.00 2.11 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 0.00 2.29 2.43 0.00 27 A 8.73 3.91 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 28 L 7.98 3.80 0.00 1.76 1.69 0.94 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.94 3.90 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 30 R 7.66 3.74 0.00 2.12 1.91 0.00 3.09 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 31 L 8.17 3.82 0.00 1.81 1.68 1.13 0.63 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 32 L 7.63 3.89 0.00 1.59 1.72 0.95 0.56 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 33 I 7.84 3.97 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.58 0.84 0.00 0.00 34 V 7.98 3.72 1.55 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 -0.15 0.00 0.00 0.71 0.00 0.00 35 Y 7.54 4.62 0.00 2.78 1.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.33 2.34 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.07 0.00 37 W 8.04 4.53 0.00 3.78 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 38 T 7.22 4.11 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39 Q 8.58 4.21 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 40 R 7.80 3.92 0.00 1.85 2.14 0.00 3.19 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.58 0.00 41 F 8.21 3.89 0.00 2.34 2.42 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 42 F 8.31 4.51 0.00 3.02 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 0.00 0.00 0.00 0.00 43 A 7.67 4.35 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 44 S 8.25 4.43 0.00 4.16 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 45 F 8.10 5.01 0.00 3.15 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 46 G 7.98 3.61 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 47 N 8.87 4.63 0.00 2.70 2.78 0.00 0.00 6.63 7.78 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 48 L 8.39 4.82 0.00 1.76 1.64 1.08 0.92 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 49 S 9.36 4.09 0.00 3.86 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 50 S 7.48 4.58 0.00 4.15 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 51 P 0.00 4.22 0.00 2.26 2.33 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 52 T 7.85 3.74 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 53 A 7.97 3.99 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 54 I 8.10 3.67 1.98 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 1.53 0.84 0.89 0.00 0.00 55 L 8.49 4.19 0.00 1.74 1.73 0.89 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.14 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.71 4.17 0.00 3.04 2.78 0.00 0.00 7.03 7.26 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 58 P 0.00 4.32 0.00 2.14 2.05 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 M 7.82 3.85 0.00 1.16 1.80 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 60 V 7.50 3.68 2.22 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 1.01 0.00 0.00 1.03 0.00 0.00 61 R 8.10 4.05 0.00 1.86 1.94 0.00 3.19 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 62 A 7.87 3.87 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.54 4.26 0.00 3.51 3.63 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.82 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 0.00 0.00 0.00 65 K 8.11 4.10 0.00 1.87 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.48 7.81 66 K 7.51 3.94 0.00 2.02 1.87 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.65 7.81 67 V 7.66 3.62 2.39 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 1.20 0.00 0.00 0.98 0.00 0.00 68 L 8.10 4.44 0.00 2.09 1.82 1.05 0.98 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 69 T 7.75 4.11 4.53 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 1.27 0.00 0.00 70 S 8.06 4.21 0.00 3.92 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.34 4.11 0.00 3.43 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 72 G 8.14 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.07 4.30 0.00 2.76 2.52 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 0.00 74 A 7.66 4.07 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 75 V 7.19 3.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.11 0.00 0.00 76 K 7.83 3.91 0.00 1.85 1.87 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.54 7.81 77 N 8.22 5.03 0.00 2.63 2.67 0.00 0.00 6.88 6.45 0.00 0.00 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 L 7.64 3.61 0.00 1.18 0.69 0.36 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.79 0.00 2.69 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 80 N 8.10 5.10 0.00 2.59 2.71 0.00 0.00 7.14 8.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.90 3.93 1.91 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 1.17 0.93 0.73 0.00 0.00 82 K 8.00 4.37 0.00 1.83 1.84 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.55 7.81 83 N 8.24 4.54 0.00 2.84 2.86 0.00 0.00 7.01 7.05 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 84 T 8.71 4.06 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 85 F 7.87 4.79 0.00 2.94 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.99 4.15 0.00 4.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 7.89 4.05 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 88 L 7.82 4.03 0.00 1.68 1.80 0.90 0.68 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 89 S 7.80 4.11 0.00 4.23 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 90 E 7.79 4.11 0.00 2.19 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 0.00 2.34 2.22 0.00 91 L 8.00 3.92 0.00 1.73 1.61 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.24 4.36 0.00 3.38 3.53 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.58 4.59 0.00 3.07 2.70 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 0.00 0.00 0.00 0.00 94 D 7.80 4.29 0.00 2.72 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 95 K 7.48 4.07 0.00 1.91 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 96 L 8.45 4.12 0.00 1.74 1.99 0.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.98 4.25 0.00 3.41 3.46 0.00 5.76 0.00 0.00 0.00 0.00 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.20 4.25 2.37 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 0.58 0.00 0.00 0.32 0.00 0.00 99 D 8.86 4.17 0.00 2.66 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 0.00 100 P 0.00 2.97 0.00 1.98 2.01 0.00 3.37 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.98 0.00 101 E 8.19 3.86 0.00 2.04 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 2.28 2.47 0.00 102 N 8.23 4.70 0.00 2.72 2.92 0.00 0.00 6.84 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 0.00 103 F 7.98 4.62 0.00 3.22 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.98 4.10 0.00 1.97 1.99 0.00 3.23 0.00 0.00 3.57 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 105 L 7.73 4.10 0.00 1.91 1.82 0.71 0.20 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 0.00 106 L 8.20 4.16 0.00 1.94 2.00 1.02 1.35 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 0.00 107 G 8.42 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 0.00 0.00 0.00 108 D 8.04 4.53 0.00 3.04 2.84 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 0.00 109 I 7.97 3.97 2.04 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 1.43 1.27 0.91 0.00 0.00 110 L 8.48 3.83 0.00 1.74 1.50 0.20 0.79 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 0.00 111 I 7.57 3.65 2.07 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.09 1.07 0.00 0.00 112 I 7.75 3.84 1.98 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 1.41 0.72 0.86 0.00 0.00 113 V 7.28 3.53 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 0.78 0.00 0.00 0.91 0.00 0.00 114 L 7.62 3.48 0.00 1.00 0.24 0.43 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.08 3.24 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 0.00 116 A 7.35 4.19 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 0.00 117 H 7.43 4.83 0.00 3.02 3.47 0.00 5.90 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 0.00 118 F 7.56 4.54 0.00 2.91 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 0.00 119 S 6.82 4.22 0.00 4.08 3.53 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 0.00 120 K 8.99 3.70 0.00 1.79 2.01 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.53 7.81 121 D 8.18 4.57 0.00 2.95 2.80 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 0.00 122 F 8.54 4.86 0.00 2.93 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.57 4.20 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 124 P 0.00 4.11 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 E 8.08 4.16 0.00 2.05 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 2.40 2.42 0.00 126 C 7.88 4.27 0.00 2.95 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.08 3.54 0.00 1.42 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 128 A 8.09 4.14 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 0.00 129 A 7.65 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 W 8.55 4.09 0.00 3.67 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.57 4.08 0.00 2.38 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 132 K 8.08 4.12 0.00 1.84 2.11 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.13 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.02 1.20 7.81 133 L 7.79 4.23 0.00 1.61 1.70 0.63 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.39 3.92 2.35 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 1.03 0.00 0.00 0.97 0.00 0.00 135 R 7.48 4.17 0.00 2.27 1.82 0.00 3.26 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 136 V 7.40 3.48 2.50 0.00 0.00 0.00 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 0.87 0.00 0.00 137 V 7.90 3.43 2.23 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 0.16 0.00 0.00 0.84 0.00 0.00 138 A 7.63 4.25 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.36 4.65 0.00 3.11 3.38 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.68 4.46 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.55 4.31 0.00 1.40 1.47 0.04 0.84 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 0.00 142 A 7.66 4.69 1.68 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 0.00 0.00 143 R 7.87 4.08 0.00 1.90 1.98 0.00 3.16 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 144 K 7.10 4.31 0.00 1.29 1.61 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.49 7.81 145 Y 10.49 4.51 0.00 2.64 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.64 4.68 0.00 3.17 3.17 0.00 5.73 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