NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2263 8.2649 123.5678 52.5505 19.5421 175.8486 2 H 4.5801 8.6818 108.7576 56.2463 31.0276 173.3153 3 L 4.4909 8.5002 119.6316 54.5575 43.4173 176.7535 4 T 4.4442 8.3642 118.8785 61.7340 71.1039 174.5761 5 P 4.1989 0.0000 0.0000 66.2977 31.1683 178.3092 6 E 3.8874 8.1029 118.5405 59.0631 29.5778 178.5244 7 E 4.0008 7.9531 118.1383 59.0575 29.5251 179.2698 8 K 3.9479 8.3170 119.4007 59.1990 32.1901 179.4828 9 S 4.0859 8.3030 114.5750 61.3252 62.6762 176.3406 10 A 3.9925 7.9374 124.4021 54.8907 18.1380 179.8362 11 V 3.3957 7.6695 116.5079 66.4463 31.4966 178.3293 12 T 3.9258 8.2070 115.5906 66.5181 68.0684 176.3661 13 A 4.0503 7.8707 121.3168 55.2146 18.7913 179.1072 14 L 3.8839 7.7876 118.8236 58.1056 42.2150 178.9838 15 W 4.3779 8.6866 128.3485 60.3612 30.3549 178.0737 16 G 3.7548 7.9385 105.1721 47.0247 0.0000 174.8518 17 K 4.3535 7.8082 118.1884 55.6905 32.9150 176.9062 18 V 3.6364 6.8375 120.3141 62.1063 32.1690 175.7174 19 N 4.5170 8.2510 125.3214 52.2530 39.0575 175.3098 20 V 3.4858 8.1800 128.4831 66.1579 31.4907 177.1240 21 D 4.3582 7.9206 118.3976 57.5589 40.8465 178.7656 22 E 3.8805 8.1748 118.1560 59.5268 29.5305 179.5751 23 V 3.6123 7.8752 118.4289 65.6413 31.4827 178.2151 24 G 3.7278 8.2166 105.7093 47.8357 0.0000 175.8741 25 G 3.5980 7.8344 108.3145 47.3685 0.0000 175.6473 26 E 3.9140 8.0317 120.4028 58.9538 29.5075 179.2878 27 A 3.9180 8.2015 121.0694 55.1466 18.5745 179.4815 28 L 3.9912 8.1383 119.0829 58.1143 42.1807 179.3047 29 G 3.5818 8.0708 105.6777 48.0202 0.0000 175.8843 30 R 3.8842 8.1413 120.9548 58.5589 29.9362 178.8571 31 L 4.0039 7.9360 120.2085 58.3786 42.0684 179.2200 32 L 3.9563 7.8512 118.5292 57.2376 41.2114 179.7112 33 V 3.5385 7.2509 117.6254 65.8194 31.7595 178.0378 34 V 3.5188 7.9259 116.7877 64.3459 32.7219 175.5132 35 Y 3.7848 7.4194 116.7204 53.7487 37.9526 173.8672 36 P 4.6672 0.0000 0.0000 64.6814 31.5045 178.4234 37 W 4.3079 8.0685 116.2370 59.4730 27.7420 177.8748 38 T 4.1937 7.7380 110.3363 64.0777 68.1561 175.9893 39 Q 4.3287 8.2950 121.5163 57.9781 28.4634 178.1123 40 R 3.8196 7.5915 116.8067 58.4465 29.3447 177.8499 41 F 4.3618 7.0548 116.4679 57.5252 39.6306 175.5993 42 F 4.5972 7.7479 118.4681 56.5302 39.8306 177.1227 43 E 3.9933 8.5349 122.4510 59.5219 29.4306 178.4354 44 S 4.6582 8.0256 110.3821 58.5905 63.2758 174.5775 45 F 4.6438 8.4519 119.5081 58.4100 39.8045 176.3196 46 G 3.9395 8.1438 105.8025 43.9314 0.0000 173.3417 47 D 4.4377 8.5973 123.7675 54.6316 41.2591 176.1756 48 L 4.8478 8.3823 124.6900 54.1835 43.5042 177.4571 49 S 4.2939 8.1441 114.6406 61.0403 62.9181 175.1279 50 T 4.7328 7.4279 109.6403 57.9251 72.9802 172.5145 51 P 4.2024 0.0000 0.0000 66.1724 31.2838 178.7241 52 D 4.2991 8.0362 116.7629 57.0385 40.5711 178.4998 53 A 3.9235 7.5173 120.5916 55.1034 18.7618 179.4180 54 V 3.6869 8.0348 117.0520 66.7272 31.4133 178.2181 55 M 4.1931 8.2017 117.1121 57.6650 31.8587 178.0397 56 G 3.9879 7.7170 103.0818 43.3899 0.0000 173.2612 57 N 4.4524 7.4854 121.5402 52.5170 39.5451 173.8934 58 P 4.2380 0.0000 0.0000 66.0148 31.3242 178.7648 59 K 3.6333 8.0243 118.1993 58.8159 31.7610 179.5900 60 V 3.6510 7.6727 118.1985 65.8784 31.7070 178.0672 61 K 3.9349 8.0959 118.0434 59.2758 31.9997 179.1844 62 A 3.9465 8.2241 121.3438 55.4376 18.2761 179.1685 63 H 4.3151 8.4112 116.9590 59.4083 29.9752 177.4147 64 G 3.7394 8.5278 108.0072 47.9178 0.0000 175.4043 65 K 3.9809 7.9590 121.4461 59.0732 32.3062 179.0335 66 K 4.0098 7.8806 118.3416 59.4500 31.9604 179.4771 67 V 3.6495 8.0430 118.6658 66.2456 31.4968 178.1833 68 L 4.3554 8.3388 118.8376 57.5371 41.5344 179.7518 69 G 3.7138 8.4586 105.8691 47.8548 0.0000 175.6944 70 A 4.1591 8.1908 123.1872 54.6849 18.1631 179.4589 71 F 4.1720 8.4070 118.6514 61.6891 39.7904 177.1380 72 S 4.1988 8.9918 115.1404 61.7589 62.7055 176.2676 73 D 4.4788 8.1762 121.2752 57.5924 40.5821 179.3555 74 G 3.5914 7.8259 105.9529 47.5759 0.0000 175.6635 75 L 3.7294 7.3009 119.9827 57.0218 41.5628 178.6707 76 A 4.1390 7.6033 119.3214 53.3294 19.4363 176.7884 77 H 4.8796 7.9951 114.9023 54.6426 29.6442 175.3122 78 L 3.8906 7.9427 119.7226 57.6842 41.9263 178.8298 79 D 4.5123 7.8876 116.3865 55.6967 42.0176 176.1072 80 N 5.0002 8.1734 117.8978 51.2710 39.4065 174.6147 81 L 4.0882 7.8777 123.2877 57.7961 42.1593 179.3247 82 K 4.0839 8.0619 116.8847 59.5279 32.0373 179.1075 83 G 3.7129 8.1573 105.3347 48.0986 0.0000 175.6160 84 T 3.7041 7.6537 117.1494 65.7092 68.6824 175.7948 85 F 4.6763 7.9766 116.8529 56.9957 39.2613 177.2781 86 A 4.0478 7.5473 121.8869 55.8241 18.1211 180.4300 87 T 3.8259 7.8260 113.2668 66.9507 68.5872 176.9069 88 L 4.1223 7.9650 120.3324 57.5331 41.6642 179.3235 89 S 4.3958 8.6353 114.9522 61.0362 62.3766 176.0527 90 E 3.8725 8.2432 121.1579 59.2150 29.1721 179.1381 91 L 3.8980 8.0809 120.2564 58.6964 42.1922 178.9043 92 H 4.1778 8.6639 116.3517 58.8569 28.4145 177.1444 93 C 3.5715 7.7972 120.8220 62.1800 31.1379 175.3529 94 D 4.3786 8.3281 120.5618 56.7005 40.5985 177.5737 95 K 4.2628 7.8733 116.9763 57.4536 33.3708 177.5642 96 L 4.1932 7.6996 116.5457 54.7947 42.4167 175.9826 97 H 4.1632 7.2231 113.1404 56.6337 26.5774 175.1627 98 V 3.6480 7.8810 118.7832 61.1029 32.2921 174.8499 99 D 4.3305 8.7460 127.2414 53.8880 41.5550 175.1294 100 P 3.1758 0.0000 0.0000 64.2801 31.8217 177.9385 101 E 3.8912 8.1962 119.2634 59.1184 29.3064 178.3374 102 N 4.2898 7.9170 116.6907 56.1787 38.4549 177.2658 103 F 4.4869 7.3037 119.3021 60.5334 39.0241 177.9747 104 R 3.9404 7.7911 117.2864 59.1437 29.9814 178.8245 105 L 3.7967 7.7037 118.6166 57.7463 41.6148 179.3137 106 L 4.0774 8.1544 120.3683 58.0698 41.9799 179.1251 107 G 3.7039 8.1358 105.6594 48.0372 0.0000 175.4358 108 N 4.4234 8.1377 118.8790 55.9481 38.5397 177.7666 109 V 3.6118 8.0327 119.7561 65.8549 31.5881 177.6765 110 L 3.8671 8.3636 120.5502 58.2224 41.7917 179.1393 111 V 3.5526 7.7982 118.0154 66.1533 31.4162 177.6545 112 C 4.0350 8.0230 116.4408 62.8758 28.0134 176.3463 113 V 3.4986 7.8265 119.6419 65.9324 31.1151 178.0408 114 L 3.8316 7.7962 118.5132 57.6313 41.3435 179.3512 115 A 3.7811 7.3583 120.7201 55.2122 18.0709 179.1150 116 H 4.0517 7.9859 115.7029 59.6642 30.0269 176.7634 117 H 3.8577 8.2408 118.8535 58.9566 29.9221 176.6365 118 F 4.5744 8.5789 118.4179 57.2473 39.5405 177.1734 119 G 3.9297 8.8463 108.6151 45.9097 0.0000 177.0732 120 K 3.9711 8.9368 121.5727 59.5667 32.4119 178.2605 121 E 4.1130 7.9403 118.7754 58.8319 29.9203 177.5104 122 F 4.5654 8.1265 123.5603 57.0715 37.9390 175.1992 123 T 4.2006 7.3199 115.5299 60.1889 71.4059 173.5130 124 P 4.1516 0.0000 0.0000 65.7040 31.3865 177.1583 125 P 4.2146 0.0000 0.0000 65.4279 31.2525 178.9309 126 V 3.5412 7.3326 115.9025 65.7757 31.4331 177.7981 127 Q 3.5161 7.9777 119.4942 59.0598 29.0080 178.0369 128 A 4.0206 8.0599 121.4967 55.3084 18.4827 179.5315 129 A 3.9158 7.9397 118.9299 55.5909 18.4893 179.5675 130 Y 3.9264 8.2291 115.2274 61.1205 38.0199 178.6779 131 Q 4.1502 8.7501 119.6875 58.8111 28.7764 178.8498 132 K 3.9458 7.9917 119.2242 59.2727 32.0859 179.5423 133 V 3.4910 7.6452 118.2871 65.9556 31.4550 178.3733 134 V 3.8199 8.0413 118.6851 64.9548 31.0556 178.1259 135 A 4.0682 8.0577 121.3699 54.6178 18.1271 179.8315 136 G 3.4665 7.9213 104.2654 47.9154 0.0000 176.1363 137 V 3.2946 8.2213 121.2233 65.4562 31.4448 177.9293 138 A 3.8868 8.1040 120.6067 55.2755 18.0840 179.3892 139 N 4.3039 8.5163 115.1043 56.2681 38.3646 177.4639 140 A 4.0231 8.0028 121.6062 55.3311 18.3881 179.5318 141 L 3.9443 7.9665 117.0288 57.0769 41.5331 178.8480 142 A 4.3588 7.8589 119.6390 53.2876 18.7167 178.4707 143 H 4.0433 7.8099 117.3077 59.2072 29.8946 175.9346 144 K 4.4984 8.4023 116.0747 56.3438 31.9456 176.3391 145 Y 4.1622 8.0606 117.5970 58.4546 38.4431 175.6521 146 H 4.4103 8.5195 117.3564 56.3306 28.0480 173.5042 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 A 8.26 4.23 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 2 H 8.68 4.58 0.00 3.17 3.33 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.50 4.49 0.00 1.57 1.54 0.89 0.72 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 4 T 8.36 4.44 4.48 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 1.25 0.00 0.00 5 P 0.00 4.20 0.00 2.24 2.29 0.00 3.68 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 2.06 2.01 0.00 6 E 8.10 3.89 0.00 2.04 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 2.36 2.39 0.00 7 E 7.95 4.00 0.00 2.28 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 8 K 8.32 3.95 0.00 1.74 1.79 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.53 7.81 9 S 8.30 4.09 0.00 4.04 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 0.00 10 A 7.94 3.99 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 11 V 7.67 3.40 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 0.60 0.00 0.00 0.40 0.00 0.00 12 T 8.21 3.93 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 1.24 0.00 0.00 13 A 7.87 4.05 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 14 L 7.79 3.88 0.00 1.91 1.95 0.52 0.11 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 15 W 8.69 4.38 0.00 3.85 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 16 G 7.94 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 17 K 7.81 4.35 0.00 1.89 2.04 0.00 1.57 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.43 7.81 18 V 6.84 3.64 1.59 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 -0.03 0.00 0.00 0.72 0.00 0.00 19 N 8.25 4.52 0.00 2.72 2.60 0.00 0.00 6.82 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 8.18 3.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.00 0.00 0.00 21 D 7.92 4.36 0.00 2.94 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 22 E 8.17 3.88 0.00 2.09 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 0.00 2.35 2.31 0.00 23 V 7.88 3.61 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 0.98 0.00 0.00 0.68 0.00 0.00 24 G 8.22 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 25 G 7.83 3.60 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 0.00 0.00 0.00 26 E 8.03 3.91 0.00 2.21 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 2.42 0.00 27 A 8.20 3.92 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 28 L 8.14 3.99 0.00 1.76 1.64 0.94 0.97 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 29 G 8.07 3.58 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 0.00 0.00 0.00 30 R 8.14 3.88 0.00 1.88 1.92 0.00 3.08 0.00 0.00 3.01 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 31 L 7.94 4.00 0.00 1.89 1.89 1.00 0.74 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 32 L 7.85 3.96 0.00 2.03 1.67 0.98 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.25 3.54 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 0.71 0.00 0.00 0.93 0.00 0.00 34 V 7.93 3.52 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.73 0.00 0.00 35 Y 7.42 3.78 0.00 2.55 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 4.67 0.00 2.32 2.31 0.00 3.64 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 2.24 1.92 0.00 37 W 8.07 4.31 0.00 3.55 3.49 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 38 T 7.74 4.19 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 39 Q 8.29 4.33 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 40 R 7.59 3.82 0.00 1.65 1.92 0.00 2.98 0.00 0.00 2.65 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.50 0.00 41 F 7.05 4.36 0.00 1.99 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 42 F 7.75 4.60 0.00 2.83 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 0.00 0.00 0.00 43 E 8.53 3.99 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 44 S 8.03 4.66 0.00 4.10 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 45 F 8.45 4.64 0.00 3.20 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 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 47 D 8.60 4.44 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 4.85 0.00 1.66 1.63 1.06 1.03 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 49 S 8.14 4.29 0.00 4.03 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.43 4.73 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 51 P 0.00 4.20 0.00 2.14 2.12 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.04 4.30 0.00 2.67 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 53 A 7.52 3.92 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 54 V 8.03 3.69 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 1.02 0.00 0.00 0.98 0.00 0.00 55 M 8.20 4.19 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.87 0.00 56 G 7.72 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 57 N 7.49 4.45 0.00 2.96 2.82 0.00 0.00 6.89 8.42 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 58 P 0.00 4.24 0.00 2.23 2.25 0.00 3.71 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 2.00 2.01 0.00 59 K 8.02 3.63 0.00 1.59 0.74 0.00 1.57 0.00 0.00 1.36 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.15 1.24 7.81 60 V 7.67 3.65 2.21 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 1.05 0.00 0.00 1.04 0.00 0.00 61 K 8.10 3.93 0.00 1.95 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.62 7.81 62 A 8.22 3.95 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 63 H 8.41 4.32 0.00 3.60 3.51 0.00 5.81 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 8.53 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 65 K 7.96 3.98 0.00 1.98 2.08 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.73 7.81 66 K 7.88 4.01 0.00 2.14 1.90 0.00 1.92 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.51 7.81 67 V 8.04 3.65 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 1.17 0.00 0.00 0.91 0.00 0.00 68 L 8.34 4.36 0.00 1.99 1.90 1.23 0.77 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 69 G 8.46 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 70 A 8.19 4.16 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 4.17 0.00 3.18 3.35 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 72 S 8.99 4.20 0.00 4.23 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 73 D 8.18 4.48 0.00 2.80 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 74 G 7.83 3.59 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 0.00 0.00 0.00 75 L 7.30 3.73 0.00 1.41 1.43 0.16 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.60 4.14 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.00 4.88 0.00 3.09 3.15 0.00 5.83 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 78 L 7.94 3.89 0.00 1.51 1.67 0.81 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.89 4.51 0.00 2.60 2.68 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 80 N 8.17 5.00 0.00 2.68 2.58 0.00 0.00 7.03 7.27 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 81 L 7.88 4.09 0.00 1.77 1.81 0.92 0.98 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 82 K 8.06 4.08 0.00 1.67 1.81 0.00 1.60 0.00 0.00 1.10 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.45 7.81 83 G 8.16 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 84 T 7.65 3.70 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 0.49 0.00 0.00 85 F 7.98 4.68 0.00 3.06 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 86 A 7.55 4.05 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 87 T 7.83 3.83 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 88 L 7.97 4.12 0.00 2.00 1.87 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.64 4.40 0.00 4.11 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 0.00 90 E 8.24 3.87 0.00 2.28 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 2.41 0.00 91 L 8.08 3.90 0.00 1.77 1.88 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.66 4.18 0.00 3.60 3.81 0.00 5.86 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 93 C 7.80 3.57 0.00 1.23 2.34 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 94 D 8.33 4.38 0.00 2.68 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 7.87 4.26 0.00 1.78 1.80 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.51 7.81 96 L 7.70 4.19 0.00 1.70 1.63 0.73 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.22 4.16 0.00 3.46 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.88 3.65 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.38 0.00 0.00 99 D 8.75 4.33 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.18 0.00 1.94 1.77 0.00 3.38 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.44 0.00 101 E 8.20 3.89 0.00 2.02 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 2.30 2.38 0.00 102 N 7.92 4.29 0.00 2.49 2.69 0.00 0.00 6.89 7.52 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 0.00 103 F 7.30 4.49 0.00 3.10 2.93 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 0.00 104 R 7.79 3.94 0.00 2.04 1.95 0.00 3.10 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 105 L 7.70 3.80 0.00 1.72 1.36 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.15 4.08 0.00 1.82 1.74 0.94 0.97 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 0.00 107 G 8.14 3.70 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 0.00 0.00 0.00 108 N 8.14 4.42 0.00 2.95 2.95 0.00 0.00 6.70 7.48 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 0.00 109 V 8.03 3.61 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 1.05 0.00 0.00 1.16 0.00 0.00 110 L 8.36 3.87 0.00 1.72 1.82 0.90 0.43 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 0.00 111 V 7.80 3.55 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 1.39 0.00 0.00 1.18 0.00 0.00 112 C 8.02 4.04 0.00 3.21 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 0.00 113 V 7.83 3.50 2.14 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 0.83 0.00 0.00 0.94 0.00 0.00 114 L 7.80 3.83 0.00 0.92 1.09 0.58 0.78 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 0.00 115 A 7.36 3.78 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 0.00 116 H 7.99 4.05 0.00 3.16 3.42 0.00 5.78 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 0.00 117 H 8.24 3.86 0.00 2.82 2.76 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.58 4.57 0.00 3.27 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.85 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 0.00 120 K 8.94 3.97 0.00 1.92 2.02 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.53 7.81 121 E 7.94 4.11 0.00 2.11 2.12 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 2.43 2.52 0.00 122 F 8.13 4.57 0.00 3.04 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.32 4.20 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 1.28 0.00 0.00 124 P 0.00 4.15 0.00 2.16 2.16 0.00 3.58 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 2.12 2.21 0.00 125 P 0.00 4.21 0.00 2.12 2.07 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 126 V 7.33 3.54 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 0.99 0.00 0.00 0.90 0.00 0.00 127 Q 7.98 3.52 0.00 1.72 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 128 A 8.06 4.02 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 0.00 129 A 7.94 3.92 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 0.00 130 Y 8.23 3.93 0.00 3.46 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 0.00 131 Q 8.75 4.15 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 132 K 7.99 3.95 0.00 1.98 1.81 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.62 7.81 133 V 7.65 3.49 2.18 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 0.83 0.00 0.00 0.72 0.00 0.00 134 V 8.04 3.82 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 0.86 0.00 0.00 1.16 0.00 0.00 135 A 8.06 4.07 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 0.00 136 G 7.92 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 0.00 0.00 0.00 137 V 8.22 3.29 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 0.58 0.00 0.00 0.66 0.00 0.00 138 A 8.10 3.89 1.45 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 0.00 0.00 0.00 139 N 8.52 4.30 0.00 2.84 2.90 0.00 0.00 6.92 7.34 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 0.00 140 A 8.00 4.02 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 0.00 141 L 7.97 3.94 0.00 1.15 0.55 0.05 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.86 4.36 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 0.00 143 H 7.81 4.04 0.00 3.31 3.53 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.40 4.50 0.00 1.80 1.79 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.71 7.81 145 Y 8.06 4.16 0.00 3.20 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 0.00 146 H 8.52 4.41 0.00 3.24 3.22 0.00 5.58 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