NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 4.1464 8.2548 109.1030 45.2541 0.0000 174.7051 17 I 3.8483 7.2901 122.5417 63.1324 37.4464 175.4889 18 T 3.9270 7.6171 116.8262 63.7610 70.1206 172.9953 19 G 3.5324 8.2729 112.0207 44.3592 0.0000 171.7131 20 T 4.4959 7.8474 116.9180 62.3342 69.5636 174.7169 21 W 4.8761 9.0103 125.6924 54.9311 33.5109 173.9615 22 Y 5.4740 9.4452 119.9327 56.3292 40.5899 175.3272 23 A 4.9104 9.3856 126.4143 50.3297 19.7012 178.3233 24 Q 3.9889 8.7720 117.6183 59.1044 28.5893 178.3189 25 L 4.1143 7.8134 117.2392 55.5793 41.9397 177.2328 26 G 4.1176 8.0447 105.7770 45.5277 0.0000 174.7149 27 S 4.5873 8.2525 116.0551 59.0553 64.4386 173.2582 28 T 5.0244 8.5200 118.8438 61.7037 71.9762 172.6647 29 F 4.7966 8.7976 128.5702 56.4636 41.7368 173.9599 30 I 4.5297 8.4661 128.2045 59.3215 39.3109 175.2564 31 V 4.5921 7.9846 125.7162 60.2217 35.2382 173.4989 32 T 4.6794 8.8443 117.3334 60.1687 70.1699 172.3678 33 A 4.9807 9.0754 131.3769 50.0973 20.5025 176.8797 34 G 3.8425 9.0763 111.9264 45.0759 0.0000 174.3514 35 A 4.1800 8.4998 123.4442 54.5609 18.7422 179.0542 36 D 4.3463 8.1146 115.1819 56.5503 39.8582 176.2089 37 G 2.9186 7.5912 106.8573 44.4617 0.0000 172.9942 38 A 4.8195 8.4076 123.2599 51.3389 20.4648 176.8625 39 L 5.1518 8.7786 119.8877 53.3086 44.9240 175.9952 40 T 4.9017 9.4534 119.8357 60.9467 72.8613 174.6855 41 G 3.7153 7.2851 110.3462 46.4963 0.0000 170.7307 42 T 5.2353 8.0257 114.7479 60.8713 71.7244 173.4338 43 Y 5.0990 9.6460 128.5928 55.7399 42.3140 173.6999 44 E 5.0999 9.2784 127.7884 54.6059 31.6448 174.9479 45 S 4.7141 9.3186 121.8362 57.8766 63.3576 173.7930 46 A 4.4133 8.6734 128.6540 53.1636 19.0419 177.6148 47 V 4.4269 7.2999 107.8409 60.3497 35.8466 177.1412 48 G 3.5739 8.3954 108.7915 45.1050 0.0000 173.3535 49 N 4.5627 8.1008 113.6561 51.6606 37.3735 174.9459 50 A 4.9260 7.3269 121.3323 50.7319 22.8242 175.6931 51 E 4.6295 9.6895 121.5233 55.9381 33.4153 176.6879 52 S 3.9201 8.3899 119.4070 58.0413 61.7802 170.2749 53 R 4.9246 8.3489 116.4702 55.6667 31.8914 175.6569 54 Y 4.8224 8.5632 117.8274 55.9422 42.1060 175.3094 55 V 4.3019 8.6647 123.5943 63.0043 32.6615 175.0095 56 L 5.2546 9.0500 126.7481 53.2812 44.0770 175.1751 57 T 5.0419 8.2696 114.1812 61.2035 71.4928 172.9046 58 G 4.6246 8.4492 112.8210 46.3657 0.0000 171.9292 59 R 5.6528 8.8180 117.5356 54.8213 34.7039 174.2880 60 Y 5.3129 8.3600 117.7353 55.4645 41.9808 174.3984 61 D 4.4059 9.3141 121.4951 53.5599 41.1699 177.4077 62 S 4.1710 8.2627 121.7384 60.0659 63.9383 174.2255 63 A 4.7078 8.2524 123.7467 49.6395 18.2846 173.3387 64 P 4.9798 0.0000 0.0000 60.8546 32.6814 176.8954 65 A 4.2826 8.3588 122.4061 52.6831 19.1531 177.4044 66 T 4.5281 8.1798 107.3772 61.7359 70.1918 175.6210 67 D 4.5235 8.0587 120.2512 54.2742 39.2976 176.3823 68 G 4.2436 7.7832 109.2220 46.1222 0.0000 174.0593 69 S 4.6442 7.9364 114.6829 56.6024 64.3054 174.3134 70 G 3.9596 8.3855 110.6668 46.5396 0.0000 172.7238 71 T 4.7316 8.8878 116.9393 61.9939 69.8935 174.8973 72 A 4.8338 8.7187 129.2908 52.1086 19.9279 175.8902 73 L 5.0314 8.9859 120.4706 55.4171 44.6842 174.2331 74 G 4.5761 9.5643 105.6612 45.5650 0.0000 172.0738 75 W 5.8176 8.5313 117.7646 55.6577 32.3496 173.3571 76 T 5.2696 9.4082 116.0908 61.8415 72.4993 173.5049 77 V 4.2418 8.9838 124.5999 60.8740 34.4377 174.2456 78 A 4.5315 8.4442 130.4198 50.1241 18.9198 178.3885 79 W 4.1555 8.2990 127.3544 56.8078 26.9752 176.9533 80 K 5.1466 7.9823 119.6263 54.7186 34.8290 174.4541 81 N 4.9534 9.4593 123.3743 51.6418 40.1021 173.9032 82 N 3.8764 8.6989 114.1354 56.6913 38.5119 175.4599 83 Y 4.5150 8.3968 114.2641 59.1181 39.3509 175.3196 84 R 4.5033 7.5882 113.9642 55.5950 32.4582 173.0008 85 N 5.3149 8.6235 115.6794 52.1280 40.8042 173.3927 86 A 4.3255 9.0832 128.2366 51.6555 19.9819 176.1612 87 H 4.1884 8.4064 113.7038 56.0010 26.9697 173.1886 88 S 5.0806 7.4720 111.4073 58.1060 66.7158 174.5538 89 A 5.2023 9.0321 120.7254 50.9871 22.9999 175.2925 90 T 4.8700 8.9390 117.2486 61.7029 72.1619 173.1150 91 T 4.8727 8.3735 116.2985 59.6557 71.4384 173.0239 92 W 4.7927 8.6098 126.6072 55.0935 30.8883 175.0839 93 S 4.8738 8.8436 120.3780 56.1531 64.4819 173.0197 94 G 4.3260 8.5369 115.5843 46.0437 0.0000 171.6438 95 Q 5.1599 8.3120 119.4791 54.9947 32.6998 173.6403 96 Y 4.9122 9.3264 122.6279 56.7707 40.7887 174.3037 97 V 4.1535 8.2296 126.4563 60.9814 34.2461 175.5606 98 G 4.0251 8.1787 116.1370 44.8699 0.0000 171.7410 99 G 3.9879 9.6946 105.0972 44.7300 0.0000 174.8909 100 A 3.6409 7.3609 119.5484 54.3383 19.3447 178.6087 101 E 4.3771 7.6172 119.8969 53.7043 28.4373 175.4407 102 A 4.4856 8.2611 124.1287 52.3165 19.6456 177.0922 103 R 5.3192 9.0240 117.2748 54.9370 35.6034 174.3448 104 I 4.7371 8.6896 121.9869 59.8763 39.8390 174.5175 105 N 5.3239 9.3983 126.6327 52.0576 39.9846 174.5315 106 T 5.2627 9.2448 114.0848 59.9546 72.8942 172.8329 107 Q 5.0045 9.1632 121.1515 53.8972 32.4869 174.7655 108 W 5.3724 8.5240 118.3386 54.6864 32.5195 173.8660 109 L 5.0885 8.7241 120.1551 52.9898 44.6274 175.3715 110 L 4.9277 9.5431 127.3421 53.8230 43.9774 174.9892 111 T 4.8872 8.7370 124.6192 62.3644 70.0969 174.4163 112 S 5.0325 8.6145 123.2038 56.7480 64.7743 174.5854 113 G 3.9090 8.5928 111.4668 46.6118 0.0000 173.0608 114 T 4.8046 8.2730 113.0023 59.3233 72.5077 173.3225 115 T 4.4112 8.1072 111.9960 61.4106 69.6635 175.2176 116 E 4.0410 8.6900 120.9695 59.2493 29.1614 179.3442 117 A 4.1595 7.5358 120.0122 54.4554 18.6874 178.3306 118 N 4.7779 7.8721 112.3873 53.3127 39.0239 176.8212 119 A 4.3318 8.1844 126.0303 54.0485 18.1591 179.8774 120 W 4.3054 8.4283 114.1888 58.7454 28.1428 176.8105 121 K 4.0801 6.4383 117.5644 55.9502 32.3150 177.6291 122 S 4.0762 7.7701 117.0338 61.3600 63.3764 173.2740 123 T 5.0143 7.5019 116.7660 61.6386 70.8746 173.5741 124 L 4.5982 8.8865 127.6501 53.7345 43.4994 176.3791 125 V 4.3573 7.8399 121.6824 60.3151 34.2221 175.1463 126 G 3.1077 6.3566 107.9856 45.6884 0.0000 171.1026 127 H 5.3263 8.1261 114.1350 53.9254 31.6411 172.5378 128 D 5.2472 9.1613 121.2070 52.9340 44.3363 174.8100 129 T 5.0006 8.4757 119.5791 62.1915 70.6873 173.5546 130 F 5.4913 9.4188 125.6117 56.4243 41.9953 174.7592 131 T 5.4186 9.3708 115.7664 60.6045 71.7493 174.0618 132 K 3.7968 8.2141 122.8131 56.5540 32.0740 177.2115 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 16 G 8.25 4.15 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 0.00 0.00 0.00 17 I 7.29 3.85 1.34 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.36 0.54 0.00 0.00 18 T 7.62 3.93 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 1.11 0.00 0.00 19 G 8.27 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.85 4.50 3.97 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 0.71 0.00 0.00 21 W 9.01 4.88 0.00 3.21 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 22 Y 9.45 5.47 0.00 2.96 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 23 A 9.39 4.91 0.97 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 0.00 0.00 24 Q 8.77 3.99 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.05 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 25 L 7.81 4.11 0.00 1.74 1.84 0.99 1.00 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 26 G 8.04 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 0.00 0.00 0.00 27 S 8.25 4.59 0.00 4.01 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 28 T 8.52 5.02 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 1.03 0.00 0.00 29 F 8.80 4.80 0.00 2.65 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 30 I 8.47 4.53 1.71 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.21 0.74 0.00 0.00 31 V 7.98 4.59 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 0.15 0.00 0.00 0.51 0.00 0.00 32 T 8.84 4.68 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 1.16 0.00 0.00 33 A 9.08 4.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.08 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 35 A 8.50 4.18 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 36 D 8.11 4.35 0.00 2.78 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 37 G 7.59 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 0.00 0.00 0.00 38 A 8.41 4.82 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.78 5.15 0.00 1.84 1.58 0.77 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 40 T 9.45 4.90 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 41 G 7.29 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 42 T 8.03 5.24 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 1.17 0.00 0.00 43 Y 9.65 5.10 0.00 2.98 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 44 E 9.28 5.10 0.00 2.09 1.82 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 2.28 2.50 0.00 45 S 9.32 4.71 0.00 4.15 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 46 A 8.67 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 47 V 7.30 4.43 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 0.73 0.00 0.00 0.86 0.00 0.00 48 G 8.40 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 4.56 0.00 2.59 2.60 0.00 0.00 6.55 7.96 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 50 A 7.33 4.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.69 4.63 0.00 1.93 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 1.97 2.08 0.00 52 S 8.39 3.92 0.00 3.69 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 53 R 8.35 4.92 0.00 1.75 1.85 0.00 3.21 0.00 0.00 3.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 54 Y 8.56 4.82 0.00 3.00 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 55 V 8.66 4.30 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 0.80 0.00 0.00 0.94 0.00 0.00 56 L 9.05 5.25 0.00 1.94 1.75 0.83 0.59 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 57 T 8.27 5.04 4.28 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 1.26 0.00 0.00 58 G 8.45 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.82 5.65 0.00 1.79 1.79 0.00 3.11 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 1.60 0.00 60 Y 8.36 5.31 0.00 3.00 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 61 D 9.31 4.41 0.00 2.75 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 62 S 8.26 4.17 0.00 3.92 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.25 4.71 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 64 P 0.00 4.98 0.00 2.27 2.17 0.00 3.49 0.00 0.00 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 65 A 8.36 4.28 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 66 T 8.18 4.53 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 1.24 0.00 0.00 67 D 8.06 4.52 0.00 2.80 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 68 G 7.78 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 0.00 0.00 0.00 0.00 69 S 7.94 4.64 0.00 3.91 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 70 G 8.39 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 71 T 8.89 4.73 4.52 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 1.45 0.00 0.00 72 A 8.72 4.83 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 73 L 8.99 5.03 0.00 2.10 1.95 1.06 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.56 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 75 W 8.53 5.82 0.00 3.55 3.32 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 76 T 9.41 5.27 4.30 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 1.24 0.00 0.00 77 V 8.98 4.24 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 -0.33 0.00 0.00 0.84 0.00 0.00 78 A 8.44 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 W 8.30 4.16 0.00 3.28 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 80 K 7.98 5.15 0.00 1.92 1.75 0.00 1.79 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.47 7.81 81 N 9.46 4.95 0.00 2.67 2.58 0.00 0.00 6.52 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 82 N 8.70 3.88 0.00 2.11 1.93 0.00 0.00 6.71 7.46 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 83 Y 8.40 4.52 0.00 3.06 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 84 R 7.59 4.50 0.00 2.12 2.10 0.00 2.87 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 85 N 8.62 5.31 0.00 2.69 2.65 0.00 0.00 6.86 7.96 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 86 A 9.08 4.33 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.41 4.19 0.00 3.36 3.32 0.00 5.66 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.47 5.08 0.00 4.00 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 89 A 9.03 5.20 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 90 T 8.94 4.87 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 -0.75 0.00 0.00 91 T 8.37 4.87 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 1.15 0.00 0.00 92 W 8.61 4.79 0.00 1.78 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 0.00 0.00 0.00 0.00 93 S 8.84 4.87 0.00 3.77 3.63 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 94 G 8.54 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 0.00 0.00 0.00 95 Q 8.31 5.16 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 96 Y 9.33 4.91 0.00 3.01 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 97 V 8.23 4.15 2.00 0.00 0.00 0.00 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 0.91 0.00 0.00 98 G 8.18 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 99 G 9.69 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 0.00 100 A 7.36 3.64 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 0.00 101 E 7.62 4.38 0.00 1.95 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 2.26 2.42 0.00 102 A 8.26 4.49 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 0.00 103 R 9.02 5.32 0.00 1.81 1.92 0.00 3.15 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.87 0.00 104 I 8.69 4.74 1.78 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.36 1.06 0.00 0.00 105 N 9.40 5.32 0.00 2.67 2.82 0.00 0.00 6.09 6.62 0.00 0.00 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 9.24 5.26 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 0.00 107 Q 9.16 5.00 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.71 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 108 W 8.52 5.37 0.00 2.64 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 0.00 109 L 8.72 5.09 0.00 1.51 1.54 0.87 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.54 4.93 0.00 1.54 1.74 0.96 0.41 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 0.00 111 T 8.74 4.89 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 8.61 5.03 0.00 3.71 3.76 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 0.00 113 G 8.59 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 0.00 0.00 0.00 0.00 114 T 8.27 4.80 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 1.19 0.00 0.00 115 T 8.11 4.41 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 0.00 116 E 8.69 4.04 0.00 2.02 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 0.00 2.41 2.33 0.00 117 A 7.54 4.16 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 0.00 118 N 7.87 4.78 0.00 2.73 2.68 0.00 0.00 6.79 6.73 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 0.00 119 A 8.18 4.33 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 0.00 120 W 8.43 4.31 0.00 3.55 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 0.00 121 K 6.44 4.08 0.00 1.03 0.74 0.00 1.22 0.00 0.00 1.20 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.30 0.64 7.81 122 S 7.77 4.08 0.00 4.14 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 0.00 123 T 7.50 5.01 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 8.89 4.60 0.00 1.83 1.72 0.95 0.60 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 0.00 125 V 7.84 4.36 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 0.51 0.00 0.00 0.70 0.00 0.00 126 G 6.36 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 0.00 0.00 0.00 127 H 8.13 5.33 0.00 3.17 3.12 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.16 5.25 0.00 3.06 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 0.00 0.00 0.00 0.00 129 T 8.48 5.00 4.30 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 1.38 0.00 0.00 130 F 9.42 5.49 0.00 3.12 3.33 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 0.00 131 T 9.37 5.42 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 1.41 0.00 0.00 132 K 8.21 3.80 0.00 1.52 1.44 0.00 1.36 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.87 7.81