NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2461 8.1727 120.1364 56.8387 34.8742 173.9862 2 V 4.5216 8.0522 121.4626 60.7737 32.3590 174.7120 3 F 4.2531 10.0372 129.1071 57.5763 40.2195 174.7221 4 E 4.3451 8.8226 120.8725 55.3921 31.1527 176.8046 5 R 3.2469 8.9722 121.8760 60.7293 30.0038 179.4896 6 C 4.3340 8.0265 115.3129 59.5414 36.2745 175.7087 7 E 3.9064 8.1056 120.7826 59.2777 29.2698 178.4510 8 L 3.5430 8.0394 120.0639 57.8739 42.1445 178.5660 9 A 3.9326 7.8766 120.6651 55.4738 18.3010 179.9218 10 R 3.9091 8.0444 116.3761 59.5018 30.1322 179.5064 11 T 3.8381 7.7610 115.5875 66.6630 68.4786 176.7731 12 L 3.8596 8.1111 121.2917 57.5162 41.6954 179.5298 13 K 3.9165 7.9449 119.4719 59.5228 31.9401 178.9434 14 R 3.9603 7.7673 117.9300 58.9304 30.0417 177.4971 15 L 4.3516 7.4553 116.3469 54.2834 41.6756 177.1815 16 G 3.8658 7.6219 106.5872 46.5691 0.0000 175.1152 17 M 3.8170 7.8584 121.7390 56.8489 32.2102 175.6878 18 D 4.4266 7.9841 117.7856 56.0296 41.1452 175.9063 19 G 3.9306 9.3527 115.8131 45.3039 0.0000 171.2563 20 Y 4.1942 8.2324 121.8333 58.6512 38.7644 176.3377 21 R 3.3058 8.9380 127.6025 57.4006 27.5499 177.4635 22 G 3.7967 8.1954 103.6460 45.7320 0.0000 174.0871 23 I 4.1200 7.4417 121.9814 59.0192 37.8363 175.7953 24 S 4.6398 8.3718 120.5481 57.7861 63.8923 174.9074 25 L 4.1798 9.1175 123.6939 58.7424 41.6564 179.4809 26 A 4.1767 8.1579 119.9491 55.2794 18.3197 179.2338 27 N 4.4492 8.2883 115.1051 56.2485 38.5357 177.7370 28 W 4.2137 8.0762 120.0055 59.9397 29.1898 178.3725 29 M 4.1505 8.4570 118.8439 58.4992 31.5013 177.9278 30 C 3.1368 8.2127 118.8018 59.1010 44.9094 175.4139 31 L 3.9711 8.1494 121.6542 58.2666 41.8450 178.8217 32 A 3.9866 8.3477 120.9288 54.8607 18.0955 179.5179 33 K 2.8914 8.1220 118.1856 59.2225 32.0467 178.9783 34 W 4.3736 7.6121 116.9027 58.6743 29.1347 178.3686 35 E 4.3195 8.2103 118.6595 58.5378 29.7239 177.6273 36 S 4.5318 7.7590 110.0411 56.5117 64.5107 174.3552 37 G 3.3445 7.7325 108.9712 47.0003 0.0000 173.3626 38 Y 3.6718 7.6792 112.9367 58.4942 35.8306 168.6035 39 N 5.2490 7.5689 118.3822 52.0907 40.1956 175.9735 40 T 4.1132 8.9917 117.2990 63.9800 69.2547 175.9917 41 R 4.4066 8.0343 116.5293 55.6042 29.9168 176.0801 42 A 4.3409 7.5888 121.3657 52.7277 19.3322 177.2420 43 T 4.9887 8.3680 111.3117 59.9439 72.4023 172.9511 44 N 4.8898 8.7875 122.2198 52.0862 41.8779 172.3005 45 Y 4.6166 8.7053 128.0768 57.2690 40.7906 173.8605 46 N 4.5398 8.5278 124.9903 51.1819 38.6235 175.3609 47 A 3.7411 8.3168 127.5969 54.7073 18.9215 179.2676 48 G 3.7124 8.0486 104.3775 47.9788 0.0000 173.8987 49 D 4.7360 7.5390 115.2999 52.1393 40.0744 175.8540 50 R 3.9772 8.0055 115.6717 56.9252 28.2329 175.8326 51 S 4.9632 7.6185 112.4419 57.1476 66.2682 172.8537 52 T 5.1233 8.6199 115.7647 61.9889 72.8182 172.7362 53 D 5.5225 9.0097 124.9408 53.0935 43.4091 175.0567 54 Y 5.0792 9.0217 120.5226 57.3950 41.6005 177.5257 55 G 4.4941 8.9501 112.5378 44.7412 0.0000 173.4816 56 T 3.9588 8.5429 113.7072 65.7974 68.2124 174.9706 57 F 4.5498 8.0452 115.5087 56.4455 39.9020 175.5789 58 Q 3.5740 8.1419 119.4553 57.1143 26.5765 174.2221 59 I 4.4149 8.2005 118.9969 60.9920 39.2091 177.0407 60 N 5.2658 9.3097 126.4864 53.7053 39.8209 175.4056 61 S 4.7579 8.9892 120.0619 59.4413 63.3616 175.1007 62 R 3.7988 8.7441 122.3657 58.4152 30.4476 177.5596 63 Y 4.2466 7.6244 114.6325 57.8424 40.6643 177.2221 64 W 4.7171 8.0314 119.0185 57.7643 30.3414 173.6516 65 C 5.6086 7.9203 110.5711 53.4555 43.6559 171.8006 66 N 4.8533 8.9797 119.6126 52.1079 39.6438 174.7384 67 D 4.7422 8.6026 123.4146 52.3131 40.4718 178.1755 68 G 4.0569 8.3095 108.0727 45.8967 0.0000 174.6328 69 K 4.4324 7.9157 116.0734 56.6787 33.1651 175.8774 70 T 4.4402 7.7702 117.1354 61.5173 69.3566 172.8905 71 P 4.2537 0.0000 0.0000 63.9066 31.9373 176.2621 72 G 3.9278 8.5112 109.3489 46.3680 0.0000 172.9349 73 A 4.4864 7.7354 119.6335 50.5537 20.5888 177.3697 74 V 4.4239 8.0319 113.1815 59.6653 35.2426 176.1622 75 N 4.9210 8.0252 116.2535 51.8304 38.4228 174.4562 76 A 3.9276 8.7252 123.7626 54.7655 19.0983 178.3308 77 C 4.4996 8.4959 111.5256 56.9906 41.2379 173.0479 78 H 4.1258 8.0493 116.5565 56.3692 26.2989 174.2865 79 L 4.7604 8.3503 117.6643 52.9858 46.5480 176.5544 80 S 4.6386 8.4135 115.7898 58.1480 63.2521 176.0230 81 C 4.1687 8.5525 123.9919 59.4885 37.6345 176.3557 82 S 3.9401 7.9603 114.5921 61.2266 61.7098 175.7359 83 A 4.1317 7.7383 122.5985 54.4199 18.2243 178.5254 84 L 4.4790 7.8110 116.2260 55.0662 41.6097 177.6482 85 L 5.0629 7.5961 117.8006 54.5354 42.3536 176.6715 86 Q 4.3947 7.7752 117.8266 55.3301 29.6069 175.9207 87 D 4.4215 8.5371 119.6944 57.1126 41.1369 176.7391 88 N 4.5889 8.0368 118.2227 53.1246 39.0826 174.7155 89 I 4.2035 8.4984 118.9765 61.0336 38.0095 176.8834 90 A 3.9437 8.5011 124.8371 56.0471 18.0651 179.9574 91 D 4.2580 8.0712 116.2042 57.4989 41.0065 178.6583 92 A 4.0528 8.0616 120.7887 55.2238 18.3495 179.7305 93 V 3.2739 8.0891 116.7231 65.8273 31.4438 178.1547 94 A 3.8299 7.8173 120.6646 55.2325 18.1186 178.8460 95 C 4.2069 8.4941 117.0755 59.6053 37.9270 175.5853 96 A 3.8255 7.9764 122.5137 55.0128 17.5816 179.7314 97 K 3.8130 7.4717 116.2247 59.4033 32.2894 179.2827 98 R 4.0492 7.5974 118.9262 59.3221 29.9410 178.4175 99 V 2.1877 7.4097 118.2195 65.8475 30.8776 177.9299 100 V 3.8756 7.6296 109.2571 62.5133 31.3472 177.8940 101 R 4.1112 7.7868 118.5793 57.6872 30.5310 176.1468 102 D 4.6655 7.3068 119.0853 53.0874 41.6852 175.1495 103 P 4.2265 0.0000 0.0000 66.3571 31.0551 177.8074 104 Q 4.0035 8.1367 117.5303 56.5343 30.0243 177.1804 105 G 3.8142 7.8583 106.6068 46.8166 0.0000 176.1110 106 I 3.5717 7.7697 120.5340 63.3622 37.9574 177.8526 107 R 4.2433 7.2323 117.9597 57.9405 29.9296 177.5647 108 A 3.8842 7.6421 120.7824 53.8554 18.7184 177.4831 109 W 4.7689 8.0857 116.5037 55.1478 30.2796 177.4013 110 V 3.7261 8.7240 123.5789 65.9764 30.9147 177.4943 111 A 4.0133 8.3583 120.1840 54.9955 18.0327 179.2638 112 W 3.9631 8.3289 126.6637 60.6751 30.5863 178.4850 113 R 3.6737 8.0726 116.4658 59.1846 29.6495 178.4316 114 N 4.3779 8.1215 115.4920 55.5507 38.7496 176.8539 115 R 4.1297 7.5512 113.3083 55.9619 30.3528 175.4614 116 C 4.5539 7.1111 115.5570 58.2845 42.9753 174.2165 117 Q 3.3218 6.6337 119.4480 57.3521 28.7047 175.5813 118 N 4.1491 8.6361 119.6487 54.0329 36.3288 173.7744 119 R 4.4325 7.4048 116.5621 54.1596 32.6155 175.6044 120 D 4.5764 8.4108 118.7861 54.0098 40.4111 175.7934 121 V 4.5779 8.2103 119.1503 61.1635 32.4327 178.2714 122 R 4.0255 8.1514 122.2968 59.3702 30.0569 178.8361 123 Q 3.9885 8.1162 114.3766 59.3060 28.3177 177.6325 124 Y 4.3061 7.8021 115.2084 59.9042 38.2292 176.6156 125 V 4.4153 7.8812 111.0087 60.6151 33.3180 175.5033 126 Q 4.1732 7.9984 120.1788 57.2449 28.8149 176.7844 127 G 3.9615 8.9471 110.5315 45.9173 0.0000 174.5579 128 C 4.3983 7.9669 115.9125 57.0281 40.6008 174.1038 129 G 3.8312 8.1565 107.1183 46.7058 0.0000 174.0397 130 V 3.9959 7.8771 118.0529 61.0668 31.9810 175.9011 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 K 8.17 4.25 0.00 1.71 2.29 0.00 1.07 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.10 7.81 2 V 8.05 4.52 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 0.86 0.00 0.00 0.94 0.00 0.00 3 F 10.04 4.25 0.00 3.02 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 4 E 8.82 4.35 0.00 1.90 1.86 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 2.30 2.24 0.00 5 R 8.97 3.25 0.00 1.94 1.92 0.00 3.37 0.00 0.00 3.48 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 6 C 8.03 4.33 0.00 3.00 3.11 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 7 E 8.11 3.91 0.00 2.06 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.42 0.00 8 L 8.04 3.54 0.00 1.37 1.36 -0.24 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.88 3.93 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 10 R 8.04 3.91 0.00 2.01 1.99 0.00 3.13 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 11 T 7.76 3.84 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 1.18 0.00 0.00 12 L 8.11 3.86 0.00 1.58 1.58 0.94 0.40 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 13 K 7.94 3.92 0.00 1.96 1.92 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 R 7.77 3.96 0.00 1.99 2.04 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 15 L 7.46 4.35 0.00 1.66 1.53 0.83 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 16 G 7.62 3.87 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 0.00 0.00 0.00 17 M 7.86 3.82 0.00 1.31 1.94 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 18 D 7.98 4.43 0.00 2.66 2.67 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 19 G 9.35 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 20 Y 8.23 4.19 0.00 3.30 3.15 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 21 R 8.94 3.31 0.00 1.89 1.85 0.00 3.24 0.00 0.00 2.97 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.23 0.00 22 G 8.20 3.80 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 0.00 0.00 0.00 23 I 7.44 4.12 1.96 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.92 -0.13 0.00 0.00 24 S 8.37 4.64 0.00 4.07 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 25 L 9.12 4.18 0.00 2.09 1.82 0.97 0.96 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 26 A 8.16 4.18 1.52 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 0.00 0.00 27 N 8.29 4.45 0.00 2.87 2.80 0.00 0.00 6.94 7.63 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 28 W 8.08 4.21 0.00 3.59 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 29 M 8.46 4.15 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.90 0.00 30 C 8.21 3.14 0.00 2.58 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 31 L 8.15 3.97 0.00 1.82 1.85 0.56 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.35 3.99 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 33 K 8.12 2.89 0.00 1.46 1.72 0.00 0.78 0.00 0.00 1.34 0.00 0.00 2.64 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.73 0.21 7.81 34 W 7.61 4.37 0.00 3.32 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 35 E 8.21 4.32 0.00 2.07 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 2.55 2.34 0.00 36 S 7.76 4.53 0.00 4.09 4.13 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 0.00 0.00 0.00 0.00 37 G 7.73 3.34 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 0.00 38 Y 7.68 3.67 0.00 3.24 2.98 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 39 N 7.57 5.25 0.00 2.89 2.80 0.00 0.00 7.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.99 4.11 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 1.49 0.00 0.00 41 R 8.03 4.41 0.00 2.02 2.10 0.00 3.09 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 42 A 7.59 4.34 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 43 T 8.37 4.99 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 1.29 0.00 0.00 44 N 8.79 4.89 0.00 2.88 2.77 0.00 0.00 6.71 7.37 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 45 Y 8.71 4.62 0.00 3.00 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 46 N 8.53 4.54 0.00 2.63 2.61 0.00 0.00 6.54 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.32 3.74 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 48 G 8.05 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 49 D 7.54 4.74 0.00 2.71 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 50 R 8.01 3.98 0.00 2.03 2.19 0.00 3.13 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 51 S 7.62 4.96 0.00 3.86 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 52 T 8.62 5.12 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 0.73 0.00 0.00 53 D 9.01 5.52 0.00 2.72 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 54 Y 9.02 5.08 0.00 2.94 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.95 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 0.00 0.00 0.00 0.00 56 T 8.54 3.96 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 57 F 8.05 4.55 0.00 3.16 2.99 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 58 Q 8.14 3.57 0.00 2.48 2.31 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 2.50 2.67 0.00 59 I 8.20 4.41 2.15 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.05 1.16 0.00 0.00 60 N 9.31 5.27 0.00 3.06 3.12 0.00 0.00 6.98 7.41 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 61 S 8.99 4.76 0.00 4.08 4.38 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 62 R 8.74 3.80 0.00 1.59 1.33 0.00 2.71 0.00 0.00 2.90 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 63 Y 7.62 4.25 0.00 1.43 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 0.00 0.00 0.00 64 W 8.03 4.72 0.00 3.66 3.30 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 65 C 7.92 5.61 0.00 3.23 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 66 N 8.98 4.85 0.00 2.78 2.70 0.00 0.00 7.13 8.31 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 67 D 8.60 4.74 0.00 2.99 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 68 G 8.31 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 0.00 0.00 0.00 69 K 7.92 4.43 0.00 1.88 1.92 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 70 T 7.77 4.44 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 1.17 0.00 0.00 71 P 0.00 4.25 0.00 2.01 1.97 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.51 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 73 A 7.74 4.49 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.03 4.42 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 0.64 0.00 0.00 0.84 0.00 0.00 75 N 8.03 4.92 0.00 2.72 2.65 0.00 0.00 6.75 7.84 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 76 A 8.73 3.93 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 77 C 8.50 4.50 0.00 3.34 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 78 H 8.05 4.13 0.00 3.30 3.35 0.00 5.65 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 79 L 8.35 4.76 0.00 1.68 1.50 0.95 0.66 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 80 S 8.41 4.64 0.00 3.84 3.69 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 81 C 8.55 4.17 0.00 2.25 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 82 S 7.96 3.94 0.00 3.86 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 83 A 7.74 4.13 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 84 L 7.81 4.48 0.00 1.95 1.84 1.04 0.50 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 85 L 7.60 5.06 0.00 1.81 1.73 1.11 1.21 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 86 Q 7.78 4.39 0.00 2.25 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 87 D 8.54 4.42 0.00 2.64 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 88 N 8.04 4.59 0.00 2.70 2.76 0.00 0.00 6.97 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 89 I 8.50 4.20 1.85 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.43 1.00 0.00 0.00 90 A 8.50 3.94 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 91 D 8.07 4.26 0.00 2.75 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 92 A 8.06 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.09 3.27 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 0.64 0.00 0.00 0.89 0.00 0.00 94 A 7.82 3.83 1.33 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 95 C 8.49 4.21 0.00 3.02 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 96 A 7.98 3.83 0.70 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 97 K 7.47 3.81 0.00 1.69 1.57 0.00 1.27 0.00 0.00 0.99 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.30 0.81 7.81 98 R 7.60 4.05 0.00 1.90 2.11 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 99 V 7.41 2.19 1.84 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 -0.27 0.00 0.00 -0.46 0.00 0.00 100 V 7.63 3.88 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 1.14 0.00 0.00 1.42 0.00 0.00 101 R 7.79 4.11 0.00 2.17 2.01 0.00 3.33 0.00 0.00 3.28 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 102 D 7.31 4.67 0.00 3.02 2.60 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 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.14 4.00 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.72 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.86 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.77 3.57 1.04 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 -0.02 -0.83 0.00 0.00 107 R 7.23 4.24 0.00 1.99 2.02 0.00 3.22 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.55 0.00 108 A 7.64 3.88 0.80 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 0.00 0.00 109 W 8.09 4.77 0.00 3.56 3.26 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 0.00 110 V 8.72 3.73 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.36 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.33 3.96 0.00 3.49 3.50 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 0.00 0.00 0.00 0.00 113 R 8.07 3.67 0.00 2.09 1.98 0.00 3.51 0.00 0.00 3.61 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.10 0.00 114 N 8.12 4.38 0.00 2.53 2.70 0.00 0.00 6.92 7.20 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 0.00 115 R 7.55 4.13 0.00 0.82 0.88 0.00 2.73 0.00 0.00 2.85 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.00 116 C 7.11 4.55 0.00 1.84 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 0.00 117 Q 6.63 3.32 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.58 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 118 N 8.64 4.15 0.00 2.80 2.82 0.00 0.00 6.90 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 0.00 119 R 7.40 4.43 0.00 1.91 1.83 0.00 3.17 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 120 D 8.41 4.58 0.00 2.64 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 0.00 121 V 8.21 4.58 2.40 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 0.92 0.00 0.00 1.06 0.00 0.00 122 R 8.15 4.03 0.00 1.95 2.02 0.00 3.16 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.12 3.99 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.11 0.00 0.00 0.00 0.00 0.00 2.07 1.48 0.00 124 Y 7.80 4.31 0.00 3.24 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 0.00 125 V 7.88 4.42 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 0.99 0.00 0.00 1.07 0.00 0.00 126 Q 8.00 4.17 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.81 0.00 0.00 0.00 0.00 0.00 2.48 2.31 0.00 127 G 8.95 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 0.00 0.00 0.00 128 C 7.97 4.40 0.00 3.07 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 0.00 129 G 8.16 3.83 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 0.00 0.00 0.00 130 V 7.88 4.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.96 0.00 0.00