NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 V 4.1403 8.0393 120.4027 62.6950 32.5473 175.6895 5 S 4.4140 8.4825 122.5156 56.6913 65.3488 173.0551 6 L 3.3696 8.2284 125.5603 58.4852 41.8283 180.7550 7 Q 3.9043 7.8669 115.2299 59.2695 28.5593 177.6667 8 E 4.0699 7.8069 119.9631 58.7707 30.1134 178.1222 9 F 4.5195 9.2246 121.7556 60.6124 39.6154 175.3714 10 L 3.9579 7.6207 117.2294 55.3647 42.0658 175.8398 11 K 4.1554 8.7100 121.2990 57.1527 30.6626 176.8278 12 T 4.0512 7.3650 109.8143 61.4718 67.9891 173.6697 13 E 3.6669 8.0067 118.8121 56.7974 26.4650 172.5245 14 P 4.0485 0.0000 0.0000 63.0211 32.0484 176.4969 15 D 4.4542 9.1120 120.2477 55.4124 40.7566 176.0766 16 G 4.3729 8.2738 113.6261 43.7579 0.0000 171.7111 17 T 4.3242 8.1042 113.8007 61.5663 69.3900 175.2606 18 L 4.1831 8.4166 125.6260 57.7358 41.7460 179.6265 19 E 4.0469 8.2248 118.7608 59.2872 29.3556 179.5214 20 V 3.7136 7.8235 118.8785 64.7483 31.6256 178.3731 21 V 3.7807 7.9260 118.3145 65.6900 31.2729 177.6265 22 A 4.1142 8.4420 120.9453 55.3403 18.3056 179.3545 23 E 3.9380 8.2397 115.7518 59.8315 29.3543 179.1179 24 Q 4.0178 8.2023 118.1910 58.5171 28.8061 177.7453 25 Y 4.1729 8.0389 114.7204 56.3944 38.5551 174.9065 26 N 4.1840 8.5700 117.4699 54.8894 38.1205 172.7832 27 T 4.6177 8.1030 111.3116 60.2907 70.9546 172.8051 28 T 4.5916 8.0942 110.4874 60.2720 72.1192 174.9096 29 L 4.0567 8.4464 122.7878 58.2704 42.0115 178.7268 30 L 3.2915 8.0498 120.1973 58.1981 41.7207 178.9718 31 E 3.8628 7.9161 117.0068 59.0853 29.6558 179.3306 32 V 3.7118 7.6885 118.0734 66.2051 31.6999 178.6528 33 V 3.7199 8.0101 112.1273 64.2052 31.0979 178.5473 34 R 3.8979 8.0007 118.2336 58.9404 29.9625 177.3240 35 N 4.6467 7.6094 113.3405 52.3444 39.4312 175.3018 36 L 4.2193 7.3917 122.5536 53.2769 42.5015 174.8327 37 P 4.3467 0.0000 0.0000 64.2933 31.5963 176.4364 38 S 3.7822 8.8893 115.4971 59.0080 60.7266 172.1090 39 S 4.5584 7.7095 114.7202 58.8034 63.8948 173.7741 40 T 4.7146 8.8508 118.2674 61.7368 71.0814 173.4081 41 V 4.9153 8.4519 125.8102 59.9698 33.8483 175.3096 42 V 4.7170 8.7948 117.7948 58.3227 36.2209 173.6077 43 P 4.8226 0.0000 0.0000 61.7430 32.1016 177.7078 44 G 4.1952 8.4315 106.8577 46.7944 0.0000 174.9443 45 D 4.4605 8.1853 119.2695 57.2596 41.3100 177.4105 46 K 4.3454 8.1570 116.8798 56.2143 32.1590 178.0219 47 F 4.0886 8.2411 123.2661 61.7705 39.1804 176.8112 48 D 4.3508 8.2828 117.4137 57.7935 40.8416 178.7854 49 T 3.8567 7.9062 115.5674 66.5878 68.4769 176.6457 50 V 3.3646 8.1026 120.3451 65.6771 31.6328 177.8188 51 W 3.5878 8.3839 128.2857 60.5785 30.2990 177.7316 52 D 4.5138 8.3770 117.8515 57.3817 40.4716 178.7702 53 T 3.8940 7.6194 116.2258 66.7477 68.5508 177.3346 54 V 2.0000 7.0559 113.8255 63.5376 31.0839 178.3292 55 C 4.0546 7.4557 115.7349 61.9849 27.9601 174.7790 56 E 4.4550 7.6451 117.9492 56.2368 29.5381 176.6887 57 W 4.6933 7.9618 118.7521 56.9180 30.4827 177.5916 58 G 3.9382 8.0621 105.4711 44.1577 0.0000 171.7653 59 N 4.9430 8.4925 118.0169 53.6497 39.4547 175.0838 60 V 4.6663 8.7752 115.2759 60.4863 37.4799 173.7439 61 T 5.0444 8.8518 117.9198 62.4270 70.9845 173.7622 62 T 5.1118 9.1049 124.1035 62.0237 70.9121 173.6952 63 L 5.4042 9.4190 127.7264 53.2923 46.1595 174.9958 64 V 4.8283 8.7624 125.0120 61.2958 34.4454 173.4142 65 H 5.2846 9.0040 127.1380 54.7480 31.6079 172.4902 66 T 4.6311 8.8921 119.2556 59.6095 70.3724 174.0790 67 A 3.8382 8.5347 124.9934 54.0887 18.4125 177.8467 68 D 4.9454 7.4910 112.9279 54.1633 43.3995 176.4076 69 V 4.4865 7.2896 110.7982 59.8055 35.6331 173.9048 70 I 5.0352 8.1615 121.6729 59.9519 40.0904 174.5101 71 L 5.0100 8.7414 127.6876 52.6356 44.5114 175.7844 72 E 5.4000 8.8258 120.1433 54.4995 32.9617 174.5851 73 F 4.7016 9.4634 124.5074 56.6206 42.0738 173.8094 74 S 4.9373 8.7744 122.3306 56.1597 64.4756 174.3281 75 G 4.2938 8.0432 112.1065 43.9865 0.0000 171.6680 76 E 5.0750 8.1093 119.0033 55.3769 29.9618 177.0545 77 L 4.1248 8.3151 124.8687 54.0615 42.6234 174.9635 78 P 4.6788 0.0000 0.0000 62.7679 32.1853 176.3164 79 S 4.8082 8.8329 116.6592 58.8214 64.7788 172.5708 80 G 3.5857 8.4093 106.5675 44.8512 0.0000 171.9038 81 F 5.0247 7.2680 114.1919 55.0103 41.6523 173.6339 82 H 4.9538 9.1241 119.2570 55.9563 29.4672 175.0076 83 R 4.3948 9.4366 121.6960 56.9028 33.4597 174.2612 84 H 4.4187 9.6566 121.6714 57.2773 25.9706 175.8169 85 G 3.8912 8.6922 104.8155 45.6685 0.0000 173.2822 86 Y 4.6823 7.7962 115.8784 55.8823 42.9106 174.3018 87 F 4.7411 9.3526 124.3547 57.0022 40.8313 174.2549 88 N 4.6767 7.8697 125.3790 51.7963 39.6571 174.9437 89 L 4.2196 8.1579 124.9391 54.3669 42.8628 177.4767 90 R 4.2280 9.5230 124.8537 55.3381 29.7431 175.4246 91 G 3.7775 7.6942 113.0888 44.0834 0.0000 171.5634 92 K 4.4066 8.5202 128.7641 56.3813 35.6559 176.0469 *93 H 4.1580 8.5745 124.4591 56.1591 26.1422 174.2585 94 G 3.9223 9.1088 108.0717 47.5400 0.0000 172.6456 95 M 3.9630 6.7862 121.6691 54.0419 32.6035 175.2020 96 S 4.7925 8.4175 119.7225 57.0106 66.8107 172.0345 97 G 3.5676 7.3457 105.3297 45.0235 0.0000 171.9785 98 H 5.1443 8.2059 117.9982 54.1256 33.0127 172.6059 99 I 4.5567 8.6341 123.7273 59.5778 39.9752 176.1890 100 K 4.2161 8.3242 125.5037 54.6968 30.5065 177.1500 101 A 3.3025 7.5639 125.4863 54.6787 19.0547 180.1433 102 E 3.8607 7.9272 114.9860 59.3887 29.7343 178.2129 103 N 4.5740 8.1099 114.6818 53.7575 39.3428 174.0872 104 C 4.8026 8.2308 121.4899 59.0329 31.2235 173.4072 105 T 4.4522 8.6882 117.9425 62.8942 70.4527 174.1892 106 H 5.1704 8.0963 117.9464 54.5402 33.7230 172.3757 107 I 5.2126 9.3449 121.3649 59.5949 41.2538 174.3103 108 A 5.2821 9.2048 127.5967 50.0928 22.7347 174.6237 109 L 5.2618 9.0105 121.4269 52.9301 44.3002 175.8746 110 I 5.1650 9.0701 116.4956 59.3387 41.6616 174.0091 111 E 5.2488 8.5082 121.4122 54.9566 33.2304 174.9258 112 R 4.5186 8.5521 118.0809 55.4628 33.3189 173.3185 113 K 4.8101 8.6349 121.4626 55.4860 33.8416 175.8667 114 F 4.7134 8.8939 128.4493 57.9122 41.9370 174.2396 115 M 3.0943 8.9867 128.6336 56.5150 28.8365 178.3175 116 G 3.9529 8.3736 105.5063 45.8244 0.0000 173.8154 117 M 4.8223 7.4345 119.0796 53.0859 35.1162 175.2544 118 D 4.7645 8.7224 122.2948 54.9391 41.9988 175.6672 119 T 4.8302 9.0562 116.1259 60.3424 71.5731 172.3549 120 A 5.0552 8.4293 127.7657 50.2709 22.4695 175.0983 121 S 4.9308 9.1393 116.1747 56.8569 67.5257 172.8170 122 I 4.8922 9.0283 121.4775 59.4445 39.9763 174.6716 123 L 4.7567 8.8248 127.1939 52.7753 44.5767 175.3361 124 F 4.9961 8.8835 122.6813 56.0113 41.0099 174.8234 125 F 5.4732 9.6323 123.6081 55.8850 41.7971 175.6292 126 N 5.5562 9.1888 120.2687 50.6304 39.3183 176.0814 127 K 3.9940 8.7292 117.3742 59.9018 32.5662 177.7135 128 E 4.1002 8.1821 116.7376 56.8776 29.7357 177.3723 129 G 3.9323 8.7462 108.6279 45.4783 0.0000 173.3075 130 S 5.1145 7.8012 113.3600 55.8034 65.5055 172.9889 131 A 4.3426 8.2933 124.5385 52.0740 18.6090 177.6056 132 M 4.3571 9.3011 124.5104 58.3742 32.6925 176.7087 133 L 4.7203 7.6818 117.7909 54.0304 46.0904 174.1011 134 K 5.2836 9.1625 121.5144 54.7618 36.8182 175.4111 135 I 5.1441 8.8181 123.5730 59.6315 41.0356 174.3580 136 F 5.1826 9.2376 125.4230 55.2114 41.8007 175.2398 137 L 4.5111 8.7460 123.3931 54.8052 42.4115 177.5777 138 G 3.7695 8.6962 109.2091 46.1463 0.0000 173.4407 139 R 4.7479 8.2925 125.9802 55.2373 29.7900 174.8074 140 D 4.6570 8.1263 122.3554 54.1053 44.3562 175.6302 141 D 4.5656 8.5398 119.9311 56.1348 40.8421 176.9491 142 H 4.7327 8.2908 117.1103 55.9547 29.5815 175.1816 143 R 4.1211 7.9899 117.2510 56.6016 27.3418 180.6927 144 Q 4.7440 7.7352 115.4105 54.4688 31.2474 174.8103 145 L 4.1576 8.3796 120.3174 55.0119 42.4126 176.9184 146 L 4.1377 8.2362 122.4905 54.2337 42.3217 177.9425 147 S 3.9952 8.8604 118.5223 61.6861 62.1821 176.1249 148 E 3.8886 7.9808 120.5509 59.3576 29.2821 179.1549 149 Q 3.2465 7.7218 117.5839 58.5961 28.7304 178.7230 150 V 3.2382 7.6204 119.5129 65.9924 31.4810 178.2926 151 S 4.0865 7.9907 113.6897 61.2653 62.8032 176.2938 152 A 3.9256 7.8453 124.4974 54.6283 18.0212 179.0999 153 F 4.1232 7.9916 119.5190 62.0730 39.3458 177.2187 154 H 4.4446 8.4364 115.7472 59.1760 28.4833 177.9660 155 T 3.8827 8.3131 118.0714 66.4809 68.2375 176.4540 156 L 3.9504 8.8930 122.8424 58.0012 42.2737 178.7919 157 A 3.8175 8.2779 120.8959 55.0462 18.0973 179.4050 158 A 3.9381 8.3519 118.3998 55.4719 18.6044 179.8306 159 S 4.2106 7.9649 111.2552 61.2855 63.0573 176.5162 160 L 4.1318 8.0731 124.5259 57.8144 41.5614 178.3649 161 K 4.3286 7.6615 126.0495 56.7634 32.1847 177.6677 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 4 V 8.04 4.14 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 1.21 0.00 0.00 1.00 0.00 0.00 5 S 8.48 4.41 0.00 4.20 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 0.00 6 L 8.23 3.37 0.00 1.34 1.49 0.81 0.39 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 7 Q 7.87 3.90 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 8 E 7.81 4.07 0.00 2.03 2.23 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 2.37 2.42 0.00 9 F 9.22 4.52 0.00 3.17 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 10 L 7.62 3.96 0.00 1.56 1.49 0.90 1.15 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 11 K 8.71 4.16 0.00 1.73 2.38 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.23 1.29 7.81 12 T 7.36 4.05 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 1.04 0.00 0.00 13 E 8.01 3.67 0.00 2.09 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 2.18 2.38 0.00 14 P 0.00 4.05 0.00 2.06 0.89 0.00 3.53 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.44 0.00 15 D 9.11 4.45 0.00 2.66 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 16 G 8.27 4.37 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 0.00 17 T 8.10 4.32 4.39 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 1.34 0.00 0.00 18 L 8.42 4.18 0.00 1.78 1.77 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.22 4.05 0.00 2.08 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 0.00 2.38 2.46 0.00 20 V 7.82 3.71 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 1.00 0.00 0.00 1.01 0.00 0.00 21 V 7.93 3.78 2.41 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 1.46 0.00 0.00 1.27 0.00 0.00 22 A 8.44 4.11 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 23 E 8.24 3.94 0.00 2.26 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 0.00 2.61 2.43 0.00 24 Q 8.20 4.02 0.00 2.29 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.20 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 25 Y 8.04 4.17 0.00 3.12 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 26 N 8.57 4.18 0.00 2.76 2.87 0.00 0.00 6.75 7.74 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 27 T 8.10 4.62 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 1.34 0.00 0.00 28 T 8.09 4.59 4.47 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 1.27 0.00 0.00 29 L 8.45 4.06 0.00 1.91 2.25 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.05 3.29 0.00 1.32 1.38 0.59 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.92 3.86 0.00 1.98 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 2.29 2.43 0.00 32 V 7.69 3.71 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 1.08 0.00 0.00 1.07 0.00 0.00 33 V 8.01 3.72 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 1.02 0.00 0.00 0.93 0.00 0.00 34 R 8.00 3.90 0.00 1.87 2.04 0.00 3.29 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 35 N 7.61 4.65 0.00 2.80 2.78 0.00 0.00 7.07 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 36 L 7.39 4.22 0.00 1.89 1.58 0.95 0.85 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 37 P 0.00 4.35 0.00 2.16 2.04 0.00 3.88 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 38 S 8.89 3.78 0.00 4.06 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 39 S 7.71 4.56 0.00 3.88 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 40 T 8.85 4.71 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 1.16 0.00 0.00 41 V 8.45 4.92 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 0.70 0.00 0.00 0.86 0.00 0.00 42 V 8.79 4.72 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 0.70 0.00 0.00 0.93 0.00 0.00 43 P 0.00 4.82 0.00 2.19 2.13 0.00 3.86 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.90 0.00 44 G 8.43 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 45 D 8.19 4.46 0.00 2.68 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 46 K 8.16 4.35 0.00 1.93 1.80 0.00 1.76 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.57 7.81 47 F 8.24 4.09 0.00 3.24 3.06 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 48 D 8.28 4.35 0.00 2.81 2.80 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 49 T 7.91 3.86 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 1.19 0.00 0.00 50 V 8.10 3.36 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 0.75 0.00 0.00 0.82 0.00 0.00 51 W 8.38 3.59 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 52 D 8.38 4.51 0.00 2.73 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 53 T 7.62 3.89 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 1.22 0.00 0.00 54 V 7.06 2.00 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 -0.10 0.00 0.00 0.26 0.00 0.00 55 C 7.46 4.05 0.00 3.09 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 56 E 7.65 4.45 0.00 2.14 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 0.00 2.47 2.51 0.00 57 W 7.96 4.69 0.00 3.45 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 58 G 8.06 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 0.00 0.00 0.00 59 N 8.49 4.94 0.00 2.62 2.77 0.00 0.00 6.51 7.68 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 60 V 8.78 4.67 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 0.93 0.00 0.00 1.02 0.00 0.00 61 T 8.85 5.04 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 1.26 0.00 0.00 62 T 9.10 5.11 4.45 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 1.35 0.00 0.00 63 L 9.42 5.40 0.00 1.82 1.69 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.76 4.83 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 0.94 0.00 0.00 1.00 0.00 0.00 65 H 9.00 5.28 0.00 3.18 3.20 0.00 5.92 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.89 4.63 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 1.29 0.00 0.00 67 A 8.53 3.84 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 68 D 7.49 4.95 0.00 2.47 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 69 V 7.29 4.49 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 0.75 0.00 0.00 0.94 0.00 0.00 70 I 8.16 5.04 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.56 0.98 0.00 0.00 71 L 8.74 5.01 0.00 1.65 1.60 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.83 5.40 0.00 1.96 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 2.17 2.27 0.00 73 F 9.46 4.70 0.00 3.11 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 74 S 8.77 4.94 0.00 3.49 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 75 G 8.04 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 0.00 0.00 0.00 0.00 76 E 8.11 5.08 0.00 2.05 1.95 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 2.38 2.32 0.00 77 L 8.32 4.12 0.00 1.35 1.30 0.63 -0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.68 0.00 2.17 2.11 0.00 3.92 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 79 S 8.83 4.81 0.00 4.06 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 80 G 8.41 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 0.00 0.00 0.00 81 F 7.27 5.02 0.00 3.01 3.02 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 0.00 82 H 9.12 4.95 0.00 3.17 3.37 0.00 5.93 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 9.44 4.39 0.00 2.11 1.80 0.00 3.26 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.54 0.00 84 H 9.66 4.42 0.00 3.46 3.43 0.00 5.83 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 85 G 8.69 3.89 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 0.00 86 Y 7.80 4.68 0.00 2.95 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 87 F 9.35 4.74 0.00 2.56 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 88 N 7.87 4.68 0.00 1.44 2.08 0.00 0.00 6.65 6.71 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 89 L 8.16 4.22 0.00 1.35 1.52 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 90 R 9.52 4.23 0.00 1.94 1.91 0.00 3.36 0.00 0.00 3.41 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 91 G 7.69 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 0.00 0.00 0.00 92 K 8.52 4.41 0.00 1.96 1.61 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.47 7.81 *93 H 8.57 4.16 0.00 3.14 2.20 0.00 7.24 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 94 G 9.11 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 95 M 6.79 3.96 0.00 0.56 0.57 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 96 S 8.42 4.79 0.00 3.83 3.70 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 97 G 7.35 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 98 H 8.21 5.14 0.00 2.92 3.05 0.00 5.84 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.63 4.56 1.72 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.97 0.73 0.00 0.00 100 K 8.32 4.22 0.00 1.69 1.50 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.42 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.22 1.43 7.81 101 A 7.56 3.30 0.09 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 0.00 0.00 102 E 7.93 3.86 0.00 1.88 1.91 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 2.28 2.18 0.00 103 N 8.11 4.57 0.00 2.83 2.82 0.00 0.00 6.51 8.10 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 0.00 104 C 8.23 4.80 0.00 2.98 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 0.00 105 T 8.69 4.45 4.17 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 1.22 0.00 0.00 106 H 8.10 5.17 0.00 3.13 3.14 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 9.34 5.21 1.81 0.00 0.00 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 1.15 0.97 0.51 0.00 0.00 108 A 9.20 5.28 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 0.00 109 L 9.01 5.26 0.00 1.37 1.17 0.69 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 110 I 9.07 5.17 1.93 0.00 0.00 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 1.26 0.80 0.97 0.00 0.00 111 E 8.51 5.25 0.00 1.85 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 1.96 2.33 0.00 112 R 8.55 4.52 0.00 1.90 2.00 0.00 2.79 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 113 K 8.63 4.81 0.00 1.80 1.75 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.67 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.44 7.81 114 F 8.89 4.71 0.00 2.98 2.83 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 0.00 115 M 8.99 3.09 0.00 1.96 1.80 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.98 0.00 116 G 8.37 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 0.00 117 M 7.43 4.82 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.47 0.00 118 D 8.72 4.76 0.00 2.54 2.58 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 0.00 119 T 9.06 4.83 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 1.37 0.00 0.00 120 A 8.43 5.06 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.14 4.93 0.00 2.88 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 0.00 122 I 9.03 4.89 1.77 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.68 0.29 0.00 0.00 123 L 8.82 4.76 0.00 1.43 0.72 0.77 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 124 F 8.88 5.00 0.00 3.10 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 0.00 125 F 9.63 5.47 0.00 3.13 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 0.00 126 N 9.19 5.56 0.00 2.85 3.03 0.00 0.00 6.62 7.26 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 0.00 127 K 8.73 3.99 0.00 1.91 2.02 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.49 7.81 128 E 8.18 4.10 0.00 2.02 2.08 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 2.34 2.39 0.00 129 G 8.75 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 0.00 130 S 7.80 5.11 0.00 4.08 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 0.00 131 A 8.29 4.34 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 0.00 132 M 9.30 4.36 0.00 1.92 2.31 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 2.72 2.54 0.00 133 L 7.68 4.72 0.00 1.79 1.56 1.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 134 K 9.16 5.28 0.00 1.83 1.39 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.22 1.40 7.81 135 I 8.82 5.14 1.88 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 1.43 1.23 0.98 0.00 0.00 136 F 9.24 5.18 0.00 3.02 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 0.00 137 L 8.75 4.51 0.00 1.52 1.53 1.19 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.70 3.77 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 0.00 0.00 0.00 139 R 8.29 4.75 0.00 1.80 1.73 0.00 3.46 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 140 D 8.13 4.66 0.00 2.88 2.55 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 0.00 141 D 8.54 4.57 0.00 2.66 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 0.00 142 H 8.29 4.73 0.00 3.06 3.27 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.99 4.12 0.00 1.94 2.07 0.00 3.20 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.41 0.00 144 Q 7.74 4.74 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 145 L 8.38 4.16 0.00 1.58 1.55 0.82 0.96 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 0.00 146 L 8.24 4.14 0.00 1.66 1.53 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.86 4.00 0.00 3.83 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 0.00 148 E 7.98 3.89 0.00 2.00 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 2.36 2.41 0.00 149 Q 7.72 3.25 0.00 2.07 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 150 V 7.62 3.24 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 0.79 0.00 0.00 151 S 7.99 4.09 0.00 4.08 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 0.00 152 A 7.85 3.93 0.99 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 0.00 153 F 7.99 4.12 0.00 2.65 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 0.00 154 H 8.44 4.44 0.00 3.43 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 T 8.31 3.88 4.46 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 1.25 0.00 0.00 156 L 8.89 3.95 0.00 1.97 1.85 0.89 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.28 3.82 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 0.00 158 A 8.35 3.94 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 0.00 159 S 7.96 4.21 0.00 4.05 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 0.00 160 L 8.07 4.13 0.00 1.72 1.72 0.80 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 161 K 7.66 4.33 0.00 1.88 1.55 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.29 7.81 * Residues marked with a * may have inaccurate shift predictions.