NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 A 4.3576 8.2493 123.6015 52.2550 20.1033 173.6294 14 E 3.5934 9.8273 115.2385 56.9071 27.3232 179.0752 15 A 3.1669 7.0028 113.2675 51.0197 21.6664 179.5587 16 G 4.1959 5.3800 106.1810 44.6016 0.0000 175.2954 17 I 3.9045 7.5945 121.6180 63.6639 37.8565 178.1377 18 T 3.9451 7.6425 116.0230 63.1371 69.0213 174.9219 19 G 3.6012 6.9614 111.4967 44.9205 0.0000 170.6688 20 T 4.7177 7.5851 117.0511 61.5140 70.4533 174.1008 21 W 5.0053 9.2665 125.8022 55.0677 33.4273 174.0849 22 Y 6.1277 10.0600 118.1716 55.5455 42.1539 174.4903 23 N 5.9606 8.9940 118.8511 49.9044 40.6365 175.0195 24 Q 4.0940 8.7895 115.8425 58.2619 28.5324 176.9100 25 L 4.3359 8.1857 117.2491 54.8429 42.4192 177.1021 26 G 3.9810 8.5066 107.2149 45.6165 0.0000 173.7951 27 S 4.7200 8.7192 115.5694 58.1657 64.7698 173.2363 28 T 4.9302 8.6305 118.8126 61.7064 71.4045 173.0835 29 F 4.9512 8.8783 128.2939 56.4658 42.2246 173.7421 30 I 4.6579 8.3728 128.1849 59.4559 39.2898 175.2922 31 V 4.7006 8.2380 126.4738 59.8850 35.2982 174.6339 32 T 4.8482 8.6785 117.7030 61.6969 71.9264 172.6736 33 A 5.0170 8.6820 128.4602 50.2116 20.8331 176.5328 34 G 4.1109 9.1438 110.1412 44.8457 0.0000 174.9788 35 A 4.3512 8.8401 124.4874 54.1048 18.5855 177.7808 36 D 4.6402 8.1492 114.3749 53.9596 41.4843 176.8900 37 G 2.8845 8.0936 104.7669 44.0649 0.0000 173.3801 38 A 5.0181 7.6526 121.0134 50.5226 21.7260 176.3564 39 L 5.3573 8.6015 119.0192 53.2513 45.6409 176.0697 40 T 4.9735 9.2591 112.4285 59.7122 73.0106 174.6556 41 G 4.1202 7.6227 107.1361 45.9849 0.0000 171.0398 42 T 5.2313 7.5468 108.3693 60.1726 72.8771 172.2079 43 Y 5.1511 9.3494 123.2304 55.8590 42.6637 173.7285 44 E 5.3028 8.8383 126.1961 54.7007 32.7299 174.0491 45 S 5.1880 9.3260 121.9745 57.3858 63.2363 173.9399 46 A 4.3326 9.0693 129.4202 53.5517 18.8368 177.4800 47 V 4.3737 7.5363 107.4120 59.9837 35.5073 175.8029 48 G 3.5822 8.5973 107.6320 44.7783 0.0000 173.6498 49 N 4.5638 7.8413 115.7662 51.5542 37.2257 173.9421 50 A 4.9637 7.3368 122.0135 50.5716 22.8399 175.8005 51 E 4.6825 9.8961 117.5397 56.3886 33.1077 177.0424 52 S 3.8178 8.5195 116.1086 58.1440 61.2504 168.9363 53 R 5.0033 8.1350 116.5059 55.5906 31.8484 175.6333 54 Y 4.7817 9.0237 118.9418 55.9989 42.2049 175.1201 55 V 4.2631 8.5307 122.5996 62.7745 32.3925 175.1031 56 L 5.4123 8.4465 126.5538 53.3241 43.7080 175.6320 57 T 4.8168 8.3880 113.7760 61.2725 71.4872 172.9911 58 G 4.7784 8.7284 112.9086 46.4194 0.0000 171.7677 59 R 5.4536 8.6881 116.9693 55.1946 35.1540 174.2205 60 Y 5.2965 8.3439 118.6986 56.0086 41.6322 174.9203 61 D 4.6921 8.9730 119.1757 52.0017 40.4552 176.8537 62 S 5.0701 8.1737 124.3578 57.2995 61.1723 173.9139 63 A 4.5837 8.9169 115.6658 53.1766 21.6402 176.3330 64 P 4.4981 0.0000 0.0000 63.5680 31.3343 176.8388 65 A 4.7034 7.6701 119.9624 51.4894 18.7938 177.7413 66 T 3.7952 7.9744 111.0779 63.1917 70.0717 174.4245 67 D 4.4355 8.2531 122.4084 58.0081 39.3671 177.5556 68 G 3.7339 7.2961 103.8980 47.7106 0.0000 173.4014 69 S 4.5507 7.6805 117.8917 57.1760 65.0431 174.1470 70 G 4.1438 8.2359 109.0598 45.0206 0.0000 173.0432 71 T 4.8158 8.6771 116.3670 61.5876 70.2106 174.8227 72 A 4.8545 8.7159 129.3401 52.1464 20.0499 175.9490 73 L 5.0909 8.6522 120.8783 55.4459 44.8719 173.9553 74 G 4.5986 8.9796 103.9891 46.0939 0.0000 172.3616 75 W 5.7006 8.3920 116.7432 55.8891 32.0703 173.3565 76 T 5.2861 9.1726 116.5930 61.9426 72.3875 173.4709 77 V 4.5299 8.5775 122.9384 61.1975 34.9521 173.6214 78 A 4.6845 8.3336 129.3519 49.2287 20.7515 177.4306 79 W 4.3117 8.3160 125.6162 55.8843 28.4025 176.3353 80 K 5.2689 7.7332 118.2185 54.8120 35.1359 174.5391 81 N 4.8362 8.8058 121.7449 52.5862 39.6143 173.8440 82 N 4.5098 8.7201 114.5943 54.8728 38.9007 174.9969 83 Y 4.3973 8.9981 115.7482 59.0369 39.6108 176.1132 84 R 4.7659 8.1865 116.4870 54.4477 34.2185 174.1105 85 N 5.1485 8.5654 117.0461 52.3032 39.9199 173.4211 86 A 4.4034 9.2155 127.6763 51.3458 19.5830 176.6369 87 H 4.1535 8.2361 114.0065 56.4722 27.1042 173.4841 88 S 5.2906 7.5859 110.9738 57.7385 67.2527 173.3250 89 A 5.1294 9.0369 120.3185 51.0001 22.8693 175.4052 90 T 5.1106 9.0091 117.4061 61.7492 72.4714 173.2603 91 T 5.0517 8.3031 114.5677 59.6387 72.1350 172.6183 92 W 4.8891 8.7146 124.4435 54.7402 32.2179 174.5205 93 S 4.9802 8.5491 118.7599 56.7706 65.0351 173.2112 94 G 4.5810 8.5387 112.3575 46.6904 0.0000 171.8040 95 Q 5.2667 8.3192 117.3980 55.0313 32.7557 173.3247 96 Y 4.9183 9.0053 122.4038 56.2402 41.1959 174.4407 97 V 4.3535 8.3951 125.7488 61.1580 34.8760 175.0453 98 G 4.0128 9.0875 116.7540 43.3357 0.0000 170.5505 99 G 3.6700 8.7840 103.9394 44.1311 0.0000 172.7233 100 A 4.0564 8.7931 122.8382 54.4435 18.3631 177.9196 101 E 4.5198 8.0815 113.2761 54.4775 31.0173 174.9971 102 A 4.8328 8.4552 126.6403 50.7581 21.1253 175.6982 103 R 5.8431 8.7485 118.7883 54.3468 35.6474 174.4590 104 I 4.9470 8.5116 120.5737 59.9305 40.7967 174.1901 105 N 5.3288 8.9624 125.9813 52.0484 40.4626 174.7148 106 T 5.4748 9.2058 113.5440 60.0764 73.4082 172.5764 107 Q 4.9866 8.8962 119.2449 53.8980 33.2198 174.7079 108 W 5.3100 8.3689 119.1797 54.5516 32.5118 173.9211 109 L 5.1707 8.5404 119.3174 52.8866 45.0461 175.4354 110 L 4.9795 9.2092 126.2785 53.7430 44.5323 174.8821 111 T 5.0316 8.6677 123.5916 61.9849 70.9500 174.0363 112 S 5.1668 8.6595 121.8197 56.6128 65.8387 173.8919 113 G 4.0308 8.7088 110.5667 45.8810 0.0000 173.2628 114 T 4.7629 8.3279 114.3545 59.7782 72.3153 172.9183 115 T 4.3580 7.9356 111.1337 60.3180 70.7291 175.4036 116 E 3.9304 8.8819 120.9588 59.7845 29.0993 179.2878 117 A 4.1386 8.0815 118.8618 54.8817 18.5940 178.3279 118 N 4.7627 7.8816 111.6598 53.0848 38.9873 176.6279 119 A 4.1135 8.2223 126.7169 54.2248 18.1582 180.1285 120 W 4.2800 8.3697 113.6565 58.5365 28.2869 176.5159 121 K 4.1705 6.6034 118.5234 55.9284 32.2550 177.1273 122 S 4.2333 7.6867 115.3295 60.5524 63.9461 173.2899 123 T 5.0794 7.6438 117.5542 61.7713 70.0761 173.9133 124 L 4.7238 8.8493 127.2840 53.5589 43.9880 176.1962 125 V 4.3300 7.6726 119.7370 60.4085 34.8141 174.9198 126 G 3.0331 6.3459 107.1891 45.7655 0.0000 171.2468 127 H 5.3841 8.0916 113.8786 54.1145 31.6037 172.6739 128 D 5.2282 9.2376 119.2803 52.9930 45.4811 174.5190 129 T 5.0845 9.1470 118.2110 61.8889 71.9350 173.0437 130 F 5.7060 9.4963 125.1017 56.1746 42.4275 174.6498 131 T 5.6265 9.4277 111.2643 60.5158 72.7313 174.2691 132 K 4.3626 8.6757 119.1595 56.3617 32.4632 177.3167 133 V 3.9148 7.7037 124.4442 62.9709 31.4706 175.3814 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 13 A 8.25 4.36 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 14 E 9.83 3.59 0.00 2.10 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 2.15 2.35 0.00 15 A 7.00 3.17 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 16 G 5.38 4.20 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 0.00 0.00 0.00 17 I 7.59 3.90 1.47 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 -0.36 0.56 0.00 0.00 18 T 7.64 3.95 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 1.16 0.00 0.00 19 G 6.96 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 20 T 7.59 4.72 4.02 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 0.00 0.00 0.80 0.00 0.00 21 W 9.27 5.01 0.00 3.13 3.39 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 22 Y 10.06 6.13 0.00 2.91 2.88 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 23 N 8.99 5.96 0.00 2.47 1.74 0.00 0.00 6.72 7.89 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 24 Q 8.79 4.09 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 25 L 8.19 4.34 0.00 1.85 1.80 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.51 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 0.00 0.00 0.00 27 S 8.72 4.72 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.63 4.93 4.19 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 0.95 0.00 0.00 29 F 8.88 4.95 0.00 2.47 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.37 4.66 1.71 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 1.10 0.43 0.75 0.00 0.00 31 V 8.24 4.70 0.67 0.00 0.00 0.00 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 0.59 0.00 0.00 32 T 8.68 4.85 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 1.14 0.00 0.00 33 A 8.68 5.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.14 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.84 4.35 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 36 D 8.15 4.64 0.00 2.60 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 37 G 8.09 2.88 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 38 A 7.65 5.02 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 39 L 8.60 5.36 0.00 1.65 1.48 1.11 0.54 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 40 T 9.26 4.97 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 1.21 0.00 0.00 41 G 7.62 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 0.00 0.00 0.00 42 T 7.55 5.23 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 1.20 0.00 0.00 43 Y 9.35 5.15 0.00 2.97 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 44 E 8.84 5.30 0.00 2.11 1.78 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 2.29 2.53 0.00 45 S 9.33 5.19 0.00 4.16 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 46 A 9.07 4.33 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 47 V 7.54 4.37 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 0.81 0.00 0.00 0.87 0.00 0.00 48 G 8.60 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 49 N 7.84 4.56 0.00 2.59 2.64 0.00 0.00 6.60 7.94 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 50 A 7.34 4.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.90 4.68 0.00 1.99 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 2.38 2.16 0.00 52 S 8.52 3.82 0.00 3.16 3.39 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 53 R 8.14 5.00 0.00 1.70 1.84 0.00 3.19 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 54 Y 9.02 4.78 0.00 2.84 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 55 V 8.53 4.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.95 0.00 0.00 56 L 8.45 5.41 0.00 1.92 1.66 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.39 4.82 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 58 G 8.73 4.78 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 59 R 8.69 5.45 0.00 1.78 1.75 0.00 3.34 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 60 Y 8.34 5.30 0.00 3.02 2.88 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 61 D 8.97 4.69 0.00 2.71 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 62 S 8.17 5.07 0.00 3.88 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 63 A 8.92 4.58 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 64 P 0.00 4.50 0.00 2.21 2.18 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 65 A 7.67 4.70 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 66 T 7.97 3.80 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 67 D 8.25 4.44 0.00 2.82 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 68 G 7.30 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 69 S 7.68 4.55 0.00 3.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.24 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 0.00 0.00 0.00 71 T 8.68 4.82 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 1.46 0.00 0.00 72 A 8.72 4.85 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 73 L 8.65 5.09 0.00 1.98 1.96 1.26 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.98 4.60 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 75 W 8.39 5.70 0.00 3.48 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 76 T 9.17 5.29 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 1.23 0.00 0.00 77 V 8.58 4.53 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 -0.35 0.00 0.00 0.81 0.00 0.00 78 A 8.33 4.68 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 79 W 8.32 4.31 0.00 3.31 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 80 K 7.73 5.27 0.00 1.86 1.72 0.00 1.85 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.46 7.81 81 N 8.81 4.84 0.00 2.67 2.46 0.00 0.00 7.05 7.66 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 82 N 8.72 4.51 0.00 2.35 2.57 0.00 0.00 6.62 7.38 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 83 Y 9.00 4.40 0.00 3.05 3.36 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 84 R 8.19 4.77 0.00 2.09 1.91 0.00 3.20 0.00 0.00 3.57 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.90 0.00 85 N 8.57 5.15 0.00 2.64 2.64 0.00 0.00 6.97 7.99 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 86 A 9.22 4.40 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 87 H 8.24 4.15 0.00 3.35 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.59 5.29 0.00 3.94 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 89 A 9.04 5.13 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 9.01 5.11 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 -0.18 0.00 0.00 91 T 8.30 5.05 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 1.17 0.00 0.00 92 W 8.71 4.89 0.00 1.78 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 93 S 8.55 4.98 0.00 3.85 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 4.58 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 95 Q 8.32 5.27 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 96 Y 9.01 4.92 0.00 2.98 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 97 V 8.40 4.35 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 0.90 0.00 0.00 0.92 0.00 0.00 98 G 9.09 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 0.00 0.00 0.00 99 G 8.78 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.79 4.06 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 0.00 101 E 8.08 4.52 0.00 2.06 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 2.17 2.33 0.00 102 A 8.46 4.83 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 0.00 103 R 8.75 5.84 0.00 1.77 1.91 0.00 3.16 0.00 0.00 3.33 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 104 I 8.51 4.95 1.90 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 -0.28 1.07 0.00 0.00 105 N 8.96 5.33 0.00 2.79 2.82 0.00 0.00 6.19 6.89 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 0.00 106 T 9.21 5.47 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 107 Q 8.90 4.99 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.53 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 108 W 8.37 5.31 0.00 2.61 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 0.00 0.00 0.00 0.00 109 L 8.54 5.17 0.00 1.54 1.52 0.87 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.21 4.98 0.00 1.71 1.62 0.57 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.67 5.03 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 1.19 0.00 0.00 112 S 8.66 5.17 0.00 3.69 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 0.00 113 G 8.71 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.33 4.76 4.19 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 1.20 0.00 0.00 115 T 7.94 4.36 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 1.21 0.00 0.00 116 E 8.88 3.93 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 117 A 8.08 4.14 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 0.00 118 N 7.88 4.76 0.00 2.71 2.68 0.00 0.00 6.92 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 0.00 119 A 8.22 4.11 1.44 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 0.00 0.00 0.00 120 W 8.37 4.28 0.00 3.56 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 0.00 121 K 6.60 4.17 0.00 1.13 0.74 0.00 1.16 0.00 0.00 0.94 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.30 0.73 7.81 122 S 7.69 4.23 0.00 4.09 4.06 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 0.00 123 T 7.64 5.08 4.20 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 1.18 0.00 0.00 124 L 8.85 4.72 0.00 1.80 1.69 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.67 4.33 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.68 0.00 0.00 126 G 6.35 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 0.00 0.00 0.00 127 H 8.09 5.38 0.00 3.17 3.11 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.24 5.23 0.00 2.94 2.16 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 0.00 129 T 9.15 5.08 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 1.32 0.00 0.00 130 F 9.50 5.71 0.00 3.01 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 0.00 131 T 9.43 5.63 4.40 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 1.39 0.00 0.00 132 K 8.68 4.36 0.00 1.47 1.58 0.00 1.09 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 133 V 7.70 3.91 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 0.71 0.00 0.00 0.96 0.00 0.00