NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1934 8.1727 122.0481 56.2794 34.0413 173.7756 2 V 4.6846 8.1902 127.3095 60.7152 32.6786 174.4954 3 F 4.3885 9.2707 127.9240 57.3560 40.1227 174.7889 4 E 4.1667 9.1337 123.4878 55.8349 30.8004 176.9830 5 R 3.4691 8.9936 124.2649 60.3693 30.0230 179.5689 6 C 4.3429 8.4259 115.2979 59.6368 37.1965 175.4849 7 E 3.9182 8.7510 121.4713 59.3809 29.1347 178.7881 8 L 3.5497 8.0726 120.0103 57.7400 42.0674 178.6319 9 A 3.9418 7.8718 120.7622 55.3822 18.2769 179.8742 10 R 3.8947 8.0504 116.4490 59.5666 30.1012 179.4577 11 T 3.8386 7.8457 115.5080 66.7160 68.4882 176.7202 12 L 3.8514 8.0656 121.1831 57.4512 41.6672 179.4510 13 K 3.8764 8.0632 119.6127 59.6270 31.9486 178.8407 14 R 3.9615 8.0319 117.8154 58.9053 29.9390 177.3284 15 L 4.5005 7.5040 116.9378 54.1667 41.7617 176.9785 16 G 3.8740 7.7746 106.0220 46.7162 0.0000 175.2207 17 M 3.8836 7.8534 121.5952 56.5114 32.3577 175.5737 18 D 4.6989 7.9724 117.4469 56.5504 40.7608 175.7375 19 G 3.9838 9.4134 115.9775 45.0914 0.0000 171.1758 20 Y 4.2669 8.3824 122.2281 58.7910 38.9840 176.3010 21 R 3.6332 8.8825 126.2404 57.2879 27.8003 176.9946 22 G 3.8144 8.1382 102.6606 46.0287 0.0000 174.0616 23 I 4.1422 7.5125 121.7415 59.0827 38.2576 175.9183 24 S 4.6246 8.3123 120.9125 57.8646 65.0654 174.6817 25 L 4.2112 8.5901 124.4834 58.6449 41.7198 179.3792 26 A 4.1598 8.1240 120.0763 55.2751 18.3087 179.2371 27 N 4.4041 8.0859 114.6499 56.2937 38.5469 177.6849 28 W 4.2247 8.0051 119.9158 59.9165 29.0178 178.5049 29 M 4.1486 8.3707 118.6884 58.6450 31.4744 177.8967 30 C 3.3375 8.0704 118.7876 59.2387 44.2769 175.3586 31 L 4.0300 8.2584 121.7134 58.2694 41.7210 178.8893 32 A 4.1841 8.4325 120.8977 54.8555 18.2878 179.5034 33 K 3.0410 8.3242 118.3154 59.4405 32.1086 179.1931 34 W 4.1281 7.8956 117.4377 59.2470 29.0394 178.3734 35 E 4.3533 8.2813 118.5146 58.7266 29.3019 177.8235 36 S 4.5229 7.9137 109.2989 56.4556 64.7929 174.4379 37 G 3.5143 8.5442 108.8643 46.9840 0.0000 173.6532 38 Y 3.6866 7.5073 114.0765 58.4543 36.0006 168.6478 39 N 5.2579 7.6605 120.2880 52.0279 39.1574 175.7968 40 T 4.0128 8.7746 117.8221 64.2110 69.0470 176.0770 41 R 4.3833 8.0356 119.1140 56.0058 30.7463 176.3707 42 A 4.2933 7.8706 121.9399 52.6770 19.2766 176.9220 43 T 4.9766 8.4057 111.1866 59.8925 72.4153 173.2505 44 N 4.8290 8.8098 121.8166 52.0532 41.7548 172.1624 45 Y 4.7784 8.6667 128.1208 57.1452 40.1644 174.4702 46 N 4.4950 8.7782 125.0494 51.2349 39.1059 175.3602 47 A 3.4290 8.2333 128.0587 54.7911 18.4928 178.6090 48 G 3.8429 7.7687 103.6852 48.5518 0.0000 173.6641 49 D 4.7542 7.8084 116.6662 51.5442 39.8297 176.5941 50 R 4.3745 7.7535 116.4832 57.6382 28.3809 176.0154 51 S 4.9984 7.3144 111.3726 57.2466 66.3298 172.7841 52 T 5.1861 8.7765 116.0259 62.0118 72.6768 172.9249 53 D 5.4265 8.9648 125.6991 53.5916 43.0445 175.0196 54 Y 4.8661 9.2302 120.7811 57.4723 41.4205 177.1915 55 G 4.3357 9.2457 112.4538 45.5082 0.0000 173.4823 56 I 3.6560 8.2439 117.3344 63.3925 37.9304 177.1571 57 F 4.7165 8.0019 115.8992 56.3736 39.7921 175.3101 58 Q 3.5824 8.0248 119.2666 57.0859 26.5810 174.0998 59 I 4.4053 8.2228 118.8468 61.0599 39.3644 176.6379 60 N 5.4762 9.1456 125.8073 52.9735 39.9792 175.6642 61 S 4.7191 9.1194 120.4543 60.0319 63.2854 175.3989 62 R 3.8217 8.8247 122.3473 58.6575 30.4344 177.6309 63 Y 4.2882 7.9988 114.7289 57.4755 40.6042 176.7923 64 W 4.9411 8.3578 118.8018 57.3664 31.5419 173.6845 65 C 5.6336 8.2168 112.0903 53.6096 45.8424 172.3976 66 N 5.2920 9.1316 119.4124 52.1289 39.9112 174.7983 67 D 4.7624 8.8495 124.2118 52.3230 40.2654 176.5813 68 G 3.9774 8.5563 107.3104 46.3650 0.0000 174.4332 69 K 4.5617 8.5480 114.7796 56.2804 33.8589 175.7859 70 T 4.6480 7.8441 116.3083 61.2979 69.6520 172.6298 71 P 4.2391 0.0000 0.0000 63.9341 31.8287 176.0043 72 G 3.9279 8.5755 107.7886 46.3764 0.0000 173.2706 73 A 4.4141 7.8382 120.3788 51.0100 19.8867 177.6329 74 V 4.3990 8.0675 113.7870 58.9936 35.1641 175.6655 75 N 5.0602 7.9481 116.4804 52.4402 37.3028 174.5944 76 A 4.0234 8.6691 122.7281 55.0312 19.2543 179.2879 77 C 4.3592 8.8927 111.2413 56.7254 40.7278 173.7803 78 H 4.0596 7.9072 115.8913 55.6989 26.1864 173.9960 79 L 4.5344 8.2529 119.6739 53.7617 46.1944 174.3679 80 S 4.7181 8.4664 120.9368 58.4087 63.6986 176.3112 81 C 4.1170 8.7546 122.5729 59.7713 40.8250 176.7577 82 S 3.9262 7.9030 115.4240 61.1628 62.3932 176.1184 83 A 4.0848 7.7417 123.1843 54.2793 18.3022 177.8960 84 L 4.4699 7.8472 116.3917 55.0987 41.8676 177.5353 85 L 5.4807 7.8264 117.6572 53.7892 42.1806 176.2321 86 Q 4.7127 7.7912 116.7176 54.1102 30.8737 175.7179 87 D 4.3784 8.5998 120.1304 57.2597 41.0718 176.7550 88 N 4.5560 8.0751 118.1961 53.3075 39.0779 174.4846 89 I 4.3265 8.4045 119.0571 61.0124 38.0568 176.9880 90 A 3.9469 8.6118 125.5631 55.9263 18.1187 180.2514 91 D 4.2614 8.0694 116.5154 57.3915 40.9263 178.5986 92 A 4.0773 8.0052 120.8116 55.2668 18.4433 179.6792 93 V 3.3583 8.2466 116.8780 66.0186 31.6323 178.0887 94 A 3.8254 8.0571 120.5926 55.2386 18.0945 178.8536 95 C 4.1858 8.4084 116.8795 59.5946 40.1585 175.5349 96 A 3.9050 8.2009 122.8270 55.0627 17.8432 179.6792 97 K 3.6739 7.7483 116.9084 59.5677 31.8059 179.5216 98 R 3.9304 7.4893 117.6703 59.1944 30.3112 178.2964 99 V 2.6396 7.6182 118.3133 65.8461 31.1835 178.1221 100 V 3.8949 7.7631 110.2252 62.9004 31.3864 177.6873 101 D 4.5359 7.7739 117.8378 55.4737 41.1724 176.3271 102 D 4.7003 7.5041 119.8309 53.0523 41.7047 175.3480 103 P 4.2145 0.0000 0.0000 65.8993 31.3478 177.7062 104 Q 4.1942 8.1782 113.4752 55.4424 30.0925 176.8203 105 G 3.7377 7.9327 108.6056 47.3080 0.0000 175.2140 106 I 3.8204 7.7977 119.0508 63.0013 38.0235 178.0265 107 R 4.3546 7.3729 117.7509 57.9651 29.9879 177.4374 108 A 3.8789 7.6765 121.3649 54.1738 18.6473 178.1562 109 W 4.7080 8.0936 116.7905 55.4509 30.0362 177.6048 110 V 3.7479 8.6258 125.4741 64.8657 30.9115 178.0575 111 A 4.0501 8.2713 120.9266 54.6741 18.1804 179.2908 112 W 3.9916 8.2763 126.5148 60.5271 30.6961 178.1734 113 R 3.8043 8.0690 117.0931 59.5935 29.6358 178.4709 114 N 4.2972 8.0199 114.7697 55.3599 38.6859 176.2444 115 H 4.3365 7.6098 114.1803 55.2538 30.3583 173.8866 116 C 4.4512 7.0120 116.0767 57.9832 42.6363 174.1944 117 Q 3.2605 6.3876 119.0888 57.2978 28.6776 176.1372 118 N 4.1401 8.5905 119.4891 53.8300 36.6358 173.9756 119 R 4.5404 7.3681 116.6952 53.8062 32.5737 175.3340 120 D 4.4914 8.4679 119.5042 54.7281 41.7145 176.2027 121 V 4.7690 8.3462 117.4457 61.0817 33.4310 177.5087 122 R 4.0857 8.6762 122.5660 59.2531 29.8098 179.0684 123 Q 4.0996 8.1181 115.3610 58.8447 28.8674 177.9553 124 Y 4.1238 7.9738 116.1950 60.2689 38.0718 177.1705 125 V 4.3110 7.7249 110.3894 60.6072 32.8157 175.2684 126 Q 4.0575 7.5203 121.4432 57.5394 29.0119 176.2822 127 G 3.9226 8.8937 112.5945 46.6077 0.0000 174.4672 128 C 4.5141 8.0523 115.8475 55.9301 40.8147 174.1721 129 G 3.9019 8.0372 107.1163 46.7323 0.0000 174.1625 130 V 3.9916 7.9071 117.9820 61.0631 31.9266 175.9827 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 4.19 0.00 1.88 1.67 0.00 1.31 0.00 0.00 0.86 0.00 0.00 2.39 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.15 7.81 2 V 8.19 4.68 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.95 0.00 0.00 3 F 9.27 4.39 0.00 2.86 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 4 E 9.13 4.17 0.00 2.05 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 0.00 2.32 2.41 0.00 5 R 8.99 3.47 0.00 1.99 1.93 0.00 3.41 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 6 C 8.43 4.34 0.00 3.23 3.12 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 7 E 8.75 3.92 0.00 2.05 2.26 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 2.58 2.39 0.00 8 L 8.07 3.55 0.00 1.37 1.39 -0.08 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.87 3.94 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 10 R 8.05 3.89 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.85 3.84 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 1.20 0.00 0.00 12 L 8.07 3.85 0.00 1.58 1.57 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.06 3.88 0.00 1.93 1.95 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 R 8.03 3.96 0.00 1.82 2.17 0.00 3.30 0.00 0.00 3.22 7.59 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 7.50 4.50 0.00 1.60 1.53 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.77 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 7.85 3.88 0.00 1.26 1.95 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.16 0.00 18 D 7.97 4.70 0.00 2.67 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 19 G 9.41 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 20 Y 8.38 4.27 0.00 3.32 3.19 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 21 R 8.88 3.63 0.00 1.99 1.89 0.00 3.28 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.56 0.00 22 G 8.14 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 23 I 7.51 4.14 1.78 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.63 -0.34 0.00 0.00 24 S 8.31 4.62 0.00 4.11 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 25 L 8.59 4.21 0.00 2.03 1.82 0.98 1.59 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 26 A 8.12 4.16 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 27 N 8.09 4.40 0.00 2.87 2.78 0.00 0.00 6.98 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 28 W 8.01 4.22 0.00 3.57 3.12 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 29 M 8.37 4.15 0.00 2.20 2.35 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.94 0.00 30 C 8.07 3.34 0.00 2.60 3.19 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 31 L 8.26 4.03 0.00 1.87 1.90 0.39 -0.30 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 8.43 4.18 1.47 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 33 K 8.32 3.04 0.00 1.88 1.85 0.00 0.69 0.00 0.00 1.12 0.00 0.00 2.79 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.32 0.82 7.81 34 W 7.90 4.13 0.00 3.47 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 35 E 8.28 4.35 0.00 2.06 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 0.00 2.58 2.41 0.00 36 S 7.91 4.52 0.00 4.09 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.54 3.51 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 0.00 38 Y 7.51 3.69 0.00 3.20 3.08 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 0.00 0.00 0.00 0.00 39 N 7.66 5.26 0.00 2.78 2.85 0.00 0.00 6.99 7.08 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 40 T 8.77 4.01 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 1.45 0.00 0.00 41 R 8.04 4.38 0.00 2.01 2.03 0.00 3.18 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 42 A 7.87 4.29 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 43 T 8.41 4.98 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 1.20 0.00 0.00 44 N 8.81 4.83 0.00 2.91 2.78 0.00 0.00 6.81 7.00 0.00 0.00 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 8.67 4.78 0.00 2.91 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 46 N 8.78 4.50 0.00 2.47 2.62 0.00 0.00 6.48 7.16 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 47 A 8.23 3.43 1.21 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 0.00 0.00 48 G 7.77 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 0.00 0.00 0.00 49 D 7.81 4.75 0.00 2.78 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 50 R 7.75 4.37 0.00 2.05 2.19 0.00 3.20 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 51 S 7.31 5.00 0.00 4.00 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 52 T 8.78 5.19 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 0.58 0.00 0.00 53 D 8.96 5.43 0.00 2.79 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.23 4.87 0.00 3.03 2.91 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 55 G 9.25 4.34 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 56 I 8.24 3.66 1.71 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.76 0.13 0.00 0.00 57 F 8.00 4.72 0.00 3.20 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.02 3.58 0.00 2.53 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.22 4.41 2.13 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.15 1.10 0.00 0.00 60 N 9.15 5.48 0.00 3.12 3.05 0.00 0.00 6.98 7.42 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 61 S 9.12 4.72 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 8.82 3.82 0.00 1.65 1.53 0.00 2.65 0.00 0.00 2.85 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 63 Y 8.00 4.29 0.00 2.00 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 0.00 0.00 0.00 0.00 64 W 8.36 4.94 0.00 3.54 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 65 C 8.22 5.63 0.00 3.08 3.22 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 0.00 66 N 9.13 5.29 0.00 2.84 2.71 0.00 0.00 7.11 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 67 D 8.85 4.76 0.00 2.81 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.56 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 69 K 8.55 4.56 0.00 1.85 1.84 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.69 1.45 7.81 70 T 7.84 4.65 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 1.25 0.00 0.00 71 P 0.00 4.24 0.00 2.02 1.99 0.00 3.85 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 2.05 2.11 0.00 72 G 8.58 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 7.84 4.41 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 74 V 8.07 4.40 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 0.63 0.00 0.00 0.91 0.00 0.00 75 N 7.95 5.06 0.00 2.80 2.67 0.00 0.00 6.77 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 76 A 8.67 4.02 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 77 C 8.89 4.36 0.00 3.18 3.22 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 0.00 78 H 7.91 4.06 0.00 3.29 3.31 0.00 5.69 0.00 0.00 0.00 0.00 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.25 4.53 0.00 1.90 1.49 0.94 0.92 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 80 S 8.47 4.72 0.00 3.89 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 81 C 8.75 4.12 0.00 2.20 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 82 S 7.90 3.93 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.74 4.08 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 84 L 7.85 4.47 0.00 1.96 1.83 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.83 5.48 0.00 1.80 1.71 1.14 1.07 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 86 Q 7.79 4.71 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.00 7.07 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 87 D 8.60 4.38 0.00 2.62 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 88 N 8.08 4.56 0.00 2.69 2.75 0.00 0.00 6.92 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 8.40 4.33 1.81 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.03 1.06 0.00 0.00 90 A 8.61 3.95 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 2.80 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 8.01 4.08 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 8.25 3.36 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 0.68 0.00 0.00 0.93 0.00 0.00 94 A 8.06 3.83 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 95 C 8.41 4.19 0.00 3.11 3.23 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 96 A 8.20 3.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.67 0.00 1.69 1.41 0.00 1.24 0.00 0.00 0.86 0.00 0.00 2.39 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.80 7.81 98 R 7.49 3.93 0.00 1.83 2.10 0.00 3.42 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.86 0.00 99 V 7.62 2.64 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 -0.08 0.00 0.00 -0.57 0.00 0.00 100 V 7.76 3.89 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 0.96 0.00 0.00 1.44 0.00 0.00 101 D 7.77 4.54 0.00 2.91 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 0.00 102 D 7.50 4.70 0.00 3.17 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 0.00 103 P 0.00 4.21 0.00 2.02 2.12 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 104 Q 8.18 4.19 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.92 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 105 G 7.93 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 0.00 106 I 7.80 3.82 1.10 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.79 -0.63 0.00 0.00 107 R 7.37 4.35 0.00 2.02 2.04 0.00 3.33 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.69 0.00 108 A 7.68 3.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.09 4.71 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 8.63 3.75 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.97 0.00 0.00 111 A 8.27 4.05 1.61 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 0.00 112 W 8.28 3.99 0.00 3.42 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 0.00 113 R 8.07 3.80 0.00 2.06 2.01 0.00 3.29 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 114 N 8.02 4.30 0.00 2.35 2.43 0.00 0.00 6.92 7.76 0.00 0.00 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 H 7.61 4.34 0.00 2.08 1.44 0.00 5.59 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 C 7.01 4.45 0.00 1.46 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 0.00 117 Q 6.39 3.26 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.19 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 118 N 8.59 4.14 0.00 2.79 2.84 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 7.37 4.54 0.00 1.82 1.79 0.00 3.03 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 120 D 8.47 4.49 0.00 2.65 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 0.00 121 V 8.35 4.77 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 0.90 0.00 0.00 1.02 0.00 0.00 122 R 8.68 4.09 0.00 2.01 2.03 0.00 3.15 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.12 4.10 0.00 2.09 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.89 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 124 Y 7.97 4.12 0.00 3.29 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 0.00 125 V 7.72 4.31 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 1.04 0.00 0.00 1.08 0.00 0.00 126 Q 7.52 4.06 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.30 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 127 G 8.89 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.05 4.51 0.00 3.08 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 0.00 129 G 8.04 3.90 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 0.00 0.00 0.00 130 V 7.91 3.99 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 0.74 0.00 0.00 0.96 0.00 0.00