NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8280 8.3549 109.7376 45.6931 0.0000 171.8530 2 S 4.2925 8.0238 119.1051 56.5143 62.3828 171.9575 3 S 4.6348 8.4109 119.7860 56.2753 64.5770 174.0271 4 G 4.6784 8.7747 125.6421 47.1272 0.0000 172.2310 5 S 3.8871 7.6387 115.3091 58.0348 61.7802 173.0762 6 S 4.8201 8.4905 121.4718 56.1887 65.8421 173.1189 7 G 4.1326 8.2642 108.3812 43.8303 0.0000 174.0242 8 R 4.2532 8.2782 124.4599 54.4860 28.5558 174.3152 9 V 4.3908 7.4054 111.3674 59.1421 34.7624 175.3635 10 E 4.3778 8.7243 127.7727 56.3776 29.8013 175.2471 11 T 4.7367 7.4797 106.2040 60.1609 72.1806 172.2195 12 Q 4.5894 8.1717 118.8891 53.3028 32.5988 175.1300 13 P 4.4870 0.0000 0.0000 62.2464 32.6434 174.7784 14 E 4.1046 8.5654 117.9157 57.4673 29.4403 176.3637 15 V 4.3356 8.1635 115.9176 63.0500 33.1747 175.7609 16 Q 4.4755 7.7012 116.7586 54.0436 28.7836 173.8953 17 L 4.8348 7.4978 119.4054 51.4512 45.5913 174.8324 18 P 4.4133 0.0000 0.0000 62.8050 31.9183 175.8689 19 G 4.0314 7.6359 108.5366 42.9189 0.0000 171.4759 20 P 4.4290 0.0000 0.0000 62.2870 31.9426 176.1550 21 A 4.3092 8.6302 126.2962 51.3815 18.9856 175.4573 22 P 4.4167 0.0000 0.0000 62.5877 33.9072 175.4789 23 N 4.1929 8.4085 113.4679 54.2294 35.8810 175.2825 24 L 4.6235 7.7142 119.3758 54.5037 42.7013 176.2365 25 R 4.9963 9.3370 125.5587 54.5312 34.0010 175.2324 26 A 5.1385 8.4238 122.0639 51.0365 22.3059 175.3253 27 Y 4.8815 8.3274 120.1121 55.1091 40.9592 174.9812 28 A 4.4677 8.8620 124.9772 51.5678 17.7058 177.9818 29 A 4.3510 8.3561 125.3984 55.6739 19.1820 177.3714 30 S 4.6872 7.3757 108.1333 56.8511 67.3333 173.5167 31 P 4.8271 0.0000 0.0000 64.7054 31.3140 177.0576 32 T 5.2494 7.7066 107.3025 60.2652 71.0184 172.7363 33 S 5.2178 8.1496 116.1738 57.4371 67.0960 172.3436 34 I 4.7538 8.3895 121.8587 60.1805 41.9334 174.2098 35 T 4.6670 8.2289 123.3011 61.6789 70.9017 173.6696 36 V 4.8107 8.4180 126.0130 61.0872 34.7628 174.1211 37 T 4.9199 8.8518 117.9631 59.5767 71.3921 173.0213 38 W 6.1633 7.5691 119.9126 54.0891 31.8844 173.5180 39 E 4.7087 8.9883 119.2378 54.6278 32.3165 175.9925 40 T 4.6703 8.2784 117.8081 62.1735 69.4659 173.4109 41 P 4.4540 0.0000 0.0000 62.6049 32.0374 177.9598 42 V 3.4259 8.5113 115.6274 63.2622 32.0946 175.9426 43 S 4.7381 8.3173 115.1760 54.8958 63.8088 173.2661 44 G 4.4780 7.9172 119.7977 45.2859 0.0000 170.8078 45 N 4.7056 8.3824 119.6023 52.9207 40.8803 175.0320 46 G 3.8675 8.4722 115.1480 46.7073 0.0000 175.3562 47 E 4.7195 8.5554 119.9003 53.7564 32.3419 174.9810 48 I 3.8744 8.1837 121.5436 60.9905 37.4874 175.8458 49 Q 4.1427 8.0091 125.1396 58.6615 28.6930 176.6680 50 N 5.0292 7.5837 113.0961 52.0793 43.7781 172.4898 51 Y 4.8965 9.3086 120.0868 56.7613 40.0845 174.6338 52 K 4.6369 8.9764 126.7388 55.3285 33.8104 175.0501 53 L 4.4982 8.2798 130.7382 53.7074 43.4148 175.1407 54 Y 4.8171 9.4155 124.9307 57.3076 39.5881 174.5316 55 Y 5.4307 8.5630 117.8385 57.2587 41.4133 173.2013 56 M 4.8353 8.1199 118.8957 54.1394 35.1150 172.6964 57 E 4.4722 8.1926 119.6027 54.6953 31.4657 174.5038 58 K 3.8182 7.7501 127.5153 60.2514 32.4351 176.3401 59 G 4.3102 8.6002 120.2929 46.6814 0.0000 173.2744 60 T 4.3832 7.7173 115.4772 61.8122 71.0474 175.0351 61 D 4.3894 8.3292 117.8270 53.8794 38.5659 174.0725 62 K 4.4929 7.2867 116.3821 54.9119 31.8260 175.1480 63 E 4.1014 7.9886 121.7388 56.5169 31.0784 175.7273 64 Q 4.8502 7.9302 122.5213 54.3795 33.2173 173.6063 65 D 4.2141 8.1580 117.5079 52.4702 42.1427 175.2433 66 V 4.4352 8.0277 114.9117 59.2895 35.6168 174.6461 67 D 4.6849 8.6047 124.9086 54.3619 41.4977 176.0060 68 V 4.6794 8.6310 122.7805 60.7818 35.5586 175.3330 69 S 5.1009 8.7951 122.4400 57.7189 63.4068 173.2680 70 S 4.6336 8.1615 113.2119 58.7002 66.2553 172.3341 71 H 3.9516 8.0315 114.6539 54.9445 29.6879 174.9755 72 S 4.1208 6.8150 108.9292 57.7675 65.0854 174.2403 73 Y 4.7010 8.4605 125.5583 55.8488 42.6127 173.6763 74 T 4.8170 7.3345 121.1538 61.7585 71.2223 173.6076 75 I 4.2143 8.6861 128.3242 60.0931 38.6105 175.3263 76 N 5.1098 7.9671 125.1419 50.8726 40.8565 174.5933 77 G 3.7190 8.3606 104.2991 47.3045 0.0000 172.4747 78 L 4.9280 7.9139 117.6167 52.2416 46.6079 178.0876 79 K 4.7649 8.9992 120.3933 56.4735 33.2605 176.6181 80 K 5.1467 8.5010 120.5356 55.1604 33.4401 176.2767 81 Y 4.3127 8.3583 124.4398 58.9401 37.9495 168.5435 82 T 4.5407 8.0332 114.1443 61.0954 70.9642 173.6951 83 E 4.7333 8.1776 125.3621 56.3340 31.7327 174.8423 84 Y 5.0131 8.4741 121.7254 56.7960 42.8585 174.4733 85 S 4.7566 9.1024 119.7706 58.1095 64.3180 172.7961 86 F 5.7048 8.8772 122.7294 55.6125 43.7861 173.7713 87 R 4.9125 8.7213 117.8988 54.9423 32.8029 173.7271 88 V 4.6033 8.5543 122.3087 61.3811 34.1175 174.6268 89 V 4.4749 8.4063 125.4381 61.1155 35.3012 173.6792 90 A 4.7945 8.5488 129.1308 51.2546 20.6668 175.3470 91 Y 4.6862 8.3782 120.9995 56.2914 40.2428 175.0560 92 N 5.2302 8.5879 120.8718 49.8852 40.8227 174.3013 93 K 3.9206 8.8504 117.3152 60.6253 31.7036 177.4909 94 H 4.1413 7.8988 115.3995 55.6449 28.9954 176.1901 95 G 3.9023 8.2532 109.4526 44.5252 0.0000 170.1549 96 P 4.1080 0.0000 0.0000 62.1321 31.2011 176.8303 97 G 3.8697 8.1269 114.1961 45.3449 0.0000 171.8529 98 V 3.7987 8.2111 113.0918 61.3745 32.6816 175.7610 99 S 4.7470 8.2093 116.2307 56.2600 64.5757 173.8768 100 T 4.2059 8.0388 117.6320 60.9775 69.3850 172.0592 101 P 4.5313 0.0000 0.0000 62.3487 32.1081 175.7494 102 D 4.4700 8.7841 122.2521 54.5956 39.7808 176.8133 103 V 4.4265 9.0706 121.7890 60.9610 32.4065 173.0480 104 A 4.7307 8.3733 127.1432 51.0988 19.7838 176.8957 105 V 4.5639 8.6948 120.8424 60.2857 35.2715 173.7795 106 R 4.9181 8.6080 124.4498 55.6324 31.3433 176.0199 107 T 4.4910 8.7165 116.4127 60.9641 70.8237 173.8176 108 L 4.4948 8.5336 121.6668 55.0245 42.2793 176.0750 109 S 4.7034 8.6311 117.1148 56.9823 63.2738 174.5178 110 D 4.5952 8.9809 127.3449 57.1192 41.5714 176.8644 111 S 4.1395 8.1298 113.2785 59.3255 62.2052 174.1238 112 G 3.9545 6.8323 107.7325 44.7251 0.0000 171.5386 113 P 4.4237 0.0000 0.0000 63.4466 31.1594 175.9125 114 S 3.9429 7.4323 116.3320 58.2852 61.9884 174.3939 115 S 4.1765 8.6850 120.7295 58.3892 62.8059 174.2916 116 G 3.8436 8.6442 114.6035 45.7404 0.0000 173.2573 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 G 8.35 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 2 S 8.02 4.29 0.00 3.94 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 3 S 8.41 4.63 0.00 3.81 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 4 G 8.77 4.68 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 0.00 5 S 7.64 3.89 0.00 3.82 3.82 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 0.00 0.00 0.00 0.00 6 S 8.49 4.82 0.00 3.95 3.95 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 7 G 8.26 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 0.00 0.00 0.00 8 R 8.28 4.25 0.00 1.77 1.86 0.00 3.17 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 9 V 7.41 4.39 2.07 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 0.85 0.00 0.00 0.97 0.00 0.00 10 E 8.72 4.38 0.00 1.92 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 0.00 2.27 2.28 0.00 11 T 7.48 4.74 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 12 Q 8.17 4.59 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 13 P 0.00 4.49 0.00 2.15 2.08 0.00 3.77 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 14 E 8.57 4.10 0.00 1.95 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 2.32 2.32 0.00 15 V 8.16 4.34 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 0.91 0.00 0.00 0.91 0.00 0.00 16 Q 7.70 4.48 0.00 1.65 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.60 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 17 L 7.50 4.83 0.00 1.52 1.48 1.01 1.08 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 18 P 0.00 4.41 0.00 2.18 2.05 0.00 3.81 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 1.93 1.99 0.00 19 G 7.64 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 20 P 0.00 4.43 0.00 2.09 2.06 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 1.99 1.97 0.00 21 A 8.63 4.31 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 22 P 0.00 4.42 0.00 2.16 2.26 0.00 4.04 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 23 N 8.41 4.19 0.00 2.92 2.87 0.00 0.00 6.46 6.75 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 24 L 7.71 4.62 0.00 1.88 1.67 1.03 0.99 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 25 R 9.34 5.00 0.00 1.83 1.89 0.00 3.40 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 26 A 8.42 5.14 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 27 Y 8.33 4.88 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.86 4.47 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 29 A 8.36 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 30 S 7.38 4.69 0.00 3.83 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 31 P 0.00 4.83 0.00 2.28 2.38 0.00 3.66 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 2.11 1.99 0.00 32 T 7.71 5.25 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 1.25 0.00 0.00 33 S 8.15 5.22 0.00 3.89 3.64 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 34 I 8.39 4.75 1.79 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.42 0.58 0.00 0.00 35 T 8.23 4.67 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 0.87 0.00 0.00 36 V 8.42 4.81 2.27 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 1.14 0.00 0.00 0.35 0.00 0.00 37 T 8.85 4.92 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 1.25 0.00 0.00 38 W 7.57 6.16 0.00 3.21 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 39 E 8.99 4.71 0.00 2.05 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 2.18 2.62 0.00 40 T 8.28 4.67 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 1.41 0.00 0.00 41 P 0.00 4.45 0.00 2.44 2.43 0.00 3.94 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 42 V 8.51 3.43 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 0.79 0.00 0.00 0.95 0.00 0.00 43 S 8.32 4.74 0.00 3.67 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 44 G 7.92 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 0.00 0.00 0.00 0.00 45 N 8.38 4.71 0.00 2.70 2.79 0.00 0.00 7.01 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 46 G 8.47 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 47 E 8.56 4.72 0.00 2.03 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 2.16 2.29 0.00 48 I 8.18 3.87 1.43 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 1.40 0.78 0.61 0.00 0.00 49 Q 8.01 4.14 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.62 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 50 N 7.58 5.03 0.00 2.64 2.64 0.00 0.00 6.94 7.49 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 51 Y 9.31 4.90 0.00 3.34 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 52 K 8.98 4.64 0.00 2.17 2.18 0.00 1.34 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.55 1.23 7.81 53 L 8.28 4.50 0.00 1.55 1.37 0.97 1.35 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 54 Y 9.42 4.82 0.00 3.09 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 55 Y 8.56 5.43 0.00 3.11 3.31 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 56 M 8.12 4.84 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 57 E 8.19 4.47 0.00 2.20 1.80 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 1.90 1.47 0.00 58 K 7.75 3.82 0.00 1.67 1.63 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.39 7.81 59 G 8.60 4.31 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 0.00 60 T 7.72 4.38 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 1.19 0.00 0.00 61 D 8.33 4.39 0.00 2.87 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 62 K 7.29 4.49 0.00 1.80 1.66 0.00 1.67 0.00 0.00 1.60 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.32 7.81 63 E 7.99 4.10 0.00 2.04 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 0.00 2.54 2.38 0.00 64 Q 7.93 4.85 0.00 1.33 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 6.16 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 65 D 8.16 4.21 0.00 1.88 1.67 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 66 V 8.03 4.44 1.83 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 1.04 0.00 0.00 0.53 0.00 0.00 67 D 8.60 4.68 0.00 2.50 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 V 8.63 4.68 2.44 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 1.29 0.00 0.00 0.58 0.00 0.00 69 S 8.80 5.10 0.00 4.03 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 70 S 8.16 4.63 0.00 3.84 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 71 H 8.03 3.95 0.00 2.88 3.06 0.00 5.67 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 72 S 6.81 4.12 0.00 3.63 3.56 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 73 Y 8.46 4.70 0.00 3.14 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 74 T 7.33 4.82 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 1.04 0.00 0.00 75 I 8.69 4.21 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.84 0.68 0.00 0.00 76 N 7.97 5.11 0.00 2.54 2.73 0.00 0.00 7.14 7.51 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 77 G 8.36 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 4.93 0.00 1.55 1.21 0.68 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 79 K 9.00 4.76 0.00 1.89 1.89 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.69 7.81 80 K 8.50 5.15 0.00 1.70 1.96 0.00 1.86 0.00 0.00 2.34 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.64 7.81 81 Y 8.36 4.31 0.00 3.04 3.13 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 82 T 8.03 4.54 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 0.66 0.00 0.00 83 E 8.18 4.73 0.00 1.87 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 0.00 2.28 2.30 0.00 84 Y 8.47 5.01 0.00 2.99 2.38 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 85 S 9.10 4.76 0.00 3.75 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 86 F 8.88 5.70 0.00 3.09 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 87 R 8.72 4.91 0.00 1.72 1.93 0.00 2.29 0.00 0.00 2.97 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.37 0.00 88 V 8.55 4.60 1.74 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 0.29 0.00 0.00 -0.06 0.00 0.00 89 V 8.41 4.47 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 0.61 0.00 0.00 0.63 0.00 0.00 90 A 8.55 4.79 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.38 4.69 0.00 3.12 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 92 N 8.59 5.23 0.00 2.78 2.77 0.00 0.00 6.34 7.36 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 93 K 8.85 3.92 0.00 1.81 1.98 0.00 1.41 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.20 7.81 94 H 7.90 4.14 0.00 3.34 3.46 0.00 5.82 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 95 G 8.25 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 96 P 0.00 4.11 0.00 1.73 1.04 0.00 3.35 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.85 0.00 97 G 8.13 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 98 V 8.21 3.80 2.04 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 0.72 0.00 0.00 0.90 0.00 0.00 99 S 8.21 4.75 0.00 3.66 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 0.00 100 T 8.04 4.21 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 1.23 0.00 0.00 101 P 0.00 4.53 0.00 2.10 2.09 0.00 3.79 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 2.00 1.97 0.00 102 D 8.78 4.47 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.07 4.43 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 1.10 0.00 0.00 1.09 0.00 0.00 104 A 8.37 4.73 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 0.00 105 V 8.69 4.56 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 0.97 0.00 0.00 1.04 0.00 0.00 106 R 8.61 4.92 0.00 1.74 1.79 0.00 2.74 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.29 0.00 107 T 8.72 4.49 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 1.43 0.00 0.00 108 L 8.53 4.49 0.00 1.70 1.70 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.63 4.70 0.00 3.82 3.68 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 0.00 110 D 8.98 4.60 0.00 2.68 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 0.00 111 S 8.13 4.14 0.00 3.79 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 0.00 112 G 6.83 3.95 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 0.00 0.00 0.00 113 P 0.00 4.42 0.00 2.19 2.18 0.00 3.80 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 1.98 0.00 114 S 7.43 3.94 0.00 3.75 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 0.00 115 S 8.69 4.18 0.00 3.84 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 0.00 116 G 8.64 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