NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5344 8.3049 118.1874 55.1228 33.4044 174.9868 2 K 4.3796 7.7281 118.9169 55.4775 32.8895 174.7478 3 T 3.9572 8.3569 117.9207 62.0463 72.1809 170.7451 4 F 4.1244 7.3160 115.0460 57.5656 38.2410 178.6760 5 T 4.1738 8.7035 105.9775 61.2946 69.4389 171.0531 6 A 4.0173 8.4570 130.8894 50.2736 20.0801 177.4707 7 K 4.5371 8.0347 125.8598 56.4798 33.2753 175.9888 8 P 3.4011 0.0000 0.0000 66.6651 31.3248 175.3235 9 E 4.3931 8.4736 121.4014 53.7864 32.7589 176.5936 10 T 3.6362 7.8912 106.9502 63.5412 68.1637 171.7774 11 V 4.7249 7.2827 128.0412 62.2910 34.1148 172.9264 12 K 4.3750 7.9427 121.3283 56.1825 29.8639 176.9526 13 R 4.3033 7.4589 118.5755 56.7362 31.2205 176.4975 14 D 4.0830 8.1670 118.1148 53.6210 44.5955 175.6320 15 W 5.1488 8.4629 115.5340 57.5392 32.9341 173.9117 16 Y 3.8888 7.8976 117.1665 57.3500 37.7341 176.3192 17 V 4.6563 8.2581 127.3377 61.4912 30.1109 174.7124 18 V 3.7857 8.3302 120.9466 62.6342 30.7804 175.9565 19 D 4.3314 9.1006 127.0562 56.4493 41.6338 178.9653 20 A 3.5327 8.0926 119.1755 53.3623 16.2663 177.9844 21 T 4.5253 8.1172 105.6558 63.4777 69.5310 174.1220 22 G 4.0016 7.6323 115.4013 45.0709 0.0000 175.5251 23 K 4.2158 8.8709 124.3714 57.6144 31.8827 177.6015 24 T 4.2572 7.2929 109.8773 60.1165 67.6443 173.3847 25 L 4.9005 7.6341 129.6468 54.6407 45.5673 179.7604 26 G 3.8654 8.9163 111.0203 46.4876 0.0000 175.7510 27 R 3.6088 9.3159 122.1640 59.5955 28.8028 177.1883 28 L 3.9286 7.9163 120.2616 58.0235 41.8368 178.8683 29 A 4.0766 8.9897 122.1198 55.2842 18.1514 179.3101 30 T 3.8130 7.8966 108.2959 65.4510 68.4617 176.2692 31 E 3.8828 7.8466 119.8860 59.0467 29.2669 179.3862 32 L 3.9980 7.8408 117.2870 57.2820 41.9313 179.1139 33 A 4.1171 8.0433 120.9825 55.2466 18.5803 179.9246 34 R 3.7590 8.8256 117.6824 59.3519 30.2397 178.7835 35 R 4.0021 8.2844 115.8286 57.3809 30.5046 176.8729 36 L 4.9727 7.7510 117.0186 56.9847 42.2296 178.9846 37 R 3.7162 7.5472 116.1541 56.7891 30.4452 176.6949 38 G 3.4554 7.7043 105.6233 46.3269 0.0000 172.9847 39 K 4.0733 7.9156 125.4460 59.0770 33.0671 177.6777 40 H 4.0990 8.1811 116.6909 57.2882 29.6725 172.8435 41 K 3.6250 7.9661 123.5280 56.4088 29.3632 174.8966 42 A 4.0858 8.3409 126.7411 53.0416 19.1420 176.8674 43 E 4.8155 7.8933 118.6280 56.5786 33.2135 175.8597 44 Y 4.2418 7.8518 119.1226 58.1252 39.2438 174.9304 45 T 4.2650 8.6856 111.0514 62.7479 72.0547 173.1489 46 P 4.1932 0.0000 0.0000 65.4090 31.6670 176.3180 47 H 4.5526 8.0546 115.9765 56.6811 30.5431 175.0836 48 V 3.6262 7.2189 118.7412 61.3036 32.2271 175.6190 49 D 4.4395 7.8595 123.4970 53.4512 40.3173 173.6711 50 T 3.1826 8.6842 118.3845 64.3182 65.3985 172.0485 51 G 4.0480 8.1566 114.4237 44.6687 0.0000 170.9655 52 D 4.0801 6.9227 118.9428 55.8916 37.4819 171.8839 53 Y 4.1717 5.8782 114.5275 54.9556 38.9091 176.2170 54 I 5.1019 8.7206 124.7786 59.8841 41.7648 175.3998 55 I 5.2208 8.7051 123.9556 58.7485 40.5349 174.8781 56 V 5.0576 7.9569 128.4766 61.4100 31.5817 175.6936 57 L 3.9069 8.2162 129.7117 55.8792 43.0331 174.7933 58 N 4.4841 10.2230 117.1901 49.1486 37.8432 176.5892 59 A 3.9802 8.4623 126.6773 53.9111 18.5276 180.0756 60 D 4.5246 9.3517 110.9345 53.9242 38.9081 175.5408 61 K 4.5840 8.2838 121.2244 55.4080 34.6637 176.0257 62 V 4.4995 8.0448 117.1635 60.3893 35.5358 174.5706 63 A 3.9412 8.7413 127.6569 53.0193 18.8153 178.7158 64 V 3.4362 7.0057 115.5711 62.5744 32.4513 173.3651 65 T 4.3630 8.3037 111.6285 61.9812 68.2012 175.2556 66 G 3.7997 8.5893 107.0828 47.2629 0.0000 173.7048 67 N 4.5932 7.6090 114.6691 54.5427 41.4605 174.7936 68 K 4.1995 8.4812 115.5407 57.3145 31.9435 177.8961 69 R 5.0981 7.9511 122.2451 57.4258 30.3725 177.9778 70 T 4.4528 7.8599 111.6735 63.4239 70.5179 174.2895 71 D 4.7667 8.1231 118.6225 53.5036 41.7848 175.8031 72 K 4.4799 7.8595 120.0239 54.7501 34.4243 176.7250 73 V 4.8233 7.7895 122.6818 60.1691 33.5777 174.3083 74 Y 3.7252 7.8416 113.9292 58.6237 40.0586 172.0573 75 Y 4.1293 8.1495 124.9738 58.0846 37.2471 168.3315 76 H 4.6754 8.7519 120.5696 55.8992 31.2466 171.2856 77 H 3.8841 8.4931 123.7052 55.5237 30.8855 173.0076 78 T 3.9124 8.7209 118.5175 62.2333 68.0108 173.8008 79 G 4.1002 8.3561 112.0217 46.2445 0.0000 175.3060 80 H 4.3888 8.1697 117.5013 59.0008 29.2556 178.1226 81 I 3.1036 8.2656 124.0067 59.5518 39.8734 174.5228 82 G 3.8020 9.0515 106.2910 46.2824 0.0000 173.3175 83 G 3.9279 8.0933 105.1884 46.1781 0.0000 175.7119 84 I 3.5762 7.5745 115.6961 62.0824 38.2558 175.9451 85 K 3.6240 7.8107 130.6441 55.4684 30.0237 173.9328 86 Q 4.3768 8.0750 121.9984 55.7984 30.2617 175.0556 87 A 5.2182 8.3789 122.8777 50.7391 22.4491 175.4324 88 T 4.1694 8.0922 111.3860 60.0128 72.3168 174.3080 89 F 5.0109 7.8001 122.4756 55.8300 41.1636 176.0938 90 E 3.9290 8.9594 120.9001 59.6713 29.5383 178.5266 91 E 4.0316 8.1019 116.3839 59.0506 29.5049 177.7021 92 M 4.3798 7.4463 116.6420 55.9586 32.8185 176.9333 93 I 4.0953 8.3089 123.4009 60.1880 35.8886 175.6370 94 A 4.5588 7.5243 121.3467 52.5078 20.7005 178.5795 95 R 4.1721 7.8916 113.7632 58.3984 31.4198 177.3811 96 R 5.0109 7.4027 115.3528 55.2597 31.2316 173.2099 97 P 4.2700 0.0000 0.0000 65.6820 32.1754 178.9715 98 E 4.0119 8.4557 117.4195 59.5228 29.7867 178.6668 99 R 3.8356 8.0438 118.8052 59.4957 30.0995 177.1154 100 V 3.9707 6.8495 114.0699 62.7605 31.9768 175.6740 101 I 3.7726 8.6887 123.8854 62.7982 35.3082 176.3083 102 E 4.0284 8.0172 118.7374 59.3819 29.4429 179.3990 103 I 3.7775 7.8199 119.2007 64.2955 37.0322 178.1870 104 A 4.0660 8.0860 119.7629 55.3493 18.1176 179.6723 105 V 3.7310 8.7493 118.4367 63.7669 31.0872 176.3477 106 K 4.4510 7.5887 120.2025 56.2632 33.3166 176.0727 107 G 4.3340 8.7627 111.4438 46.6033 0.0000 175.1331 108 M 4.5091 7.3521 113.1667 55.2700 31.7977 175.9892 109 L 4.6683 7.4292 120.3105 53.2280 42.4957 175.6946 110 P 4.0175 0.0000 0.0000 63.7451 31.3584 173.1145 111 K 3.6718 8.1174 124.0104 58.6993 31.0029 174.8258 112 G 3.8086 8.6433 111.2999 43.5702 0.0000 170.4807 113 P 4.1794 0.0000 0.0000 66.1846 30.9961 177.6988 114 L 3.9859 8.0828 116.9998 58.7321 42.0275 178.8964 115 G 3.7647 7.9000 105.4934 46.7389 0.0000 174.9868 116 R 4.1141 7.8556 121.2403 59.1953 29.9999 177.5860 117 A 4.7498 7.6739 119.0616 52.7367 18.4932 177.6815 118 M 4.5423 7.5827 118.8279 56.9585 34.0350 177.5690 119 F 4.2598 8.3197 121.3067 61.0157 39.8967 176.7984 120 R 3.8239 8.2889 120.1447 58.9165 30.0891 177.5414 121 K 4.6407 7.7362 116.5891 57.0722 31.9001 178.1647 122 L 4.0850 7.9956 119.4603 55.8442 43.1862 173.5754 123 K 3.6155 7.8726 127.5439 55.4844 29.9139 176.0862 124 V 3.7196 7.6617 117.3565 59.1744 31.6286 172.8342 125 Y 3.5808 7.8968 128.1570 58.1936 37.9748 170.4582 126 A 5.1638 9.2976 127.5949 47.8541 19.1923 175.8295 127 G 5.0393 8.8091 127.0700 48.3170 0.0000 170.3977 128 N 4.4603 7.8806 115.8357 52.6648 38.9248 174.4229 129 E 4.0538 7.7598 112.9268 57.3204 28.0794 175.6662 130 H 4.6827 7.7596 117.3009 54.9546 33.4487 173.4592 131 N 4.0637 8.4592 116.6757 54.7913 35.9735 175.4858 132 H 4.1385 7.9697 116.9706 57.0585 29.9462 176.0659 133 A 3.9425 7.9911 122.1425 55.3169 18.2327 179.0674 134 A 4.1715 7.2349 117.5464 55.3422 18.5783 177.2065 135 Q 4.7386 7.9560 113.6723 55.0674 31.7203 174.5244 136 Q 4.0318 8.6578 120.2223 58.7226 28.5463 175.4508 137 P 3.8346 0.0000 0.0000 64.8503 31.8523 175.4127 138 Q 4.1875 7.1366 119.5767 54.4998 31.4822 175.7950 139 V 4.6118 7.1303 111.8294 61.5739 35.3153 174.0583 140 L 3.9683 8.1989 121.8460 56.1969 41.7450 175.3545 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 M 8.30 4.53 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 2 K 7.73 4.38 0.00 1.73 1.49 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.45 7.81 3 T 8.36 3.96 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 4 F 7.32 4.12 0.00 2.98 2.30 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 5 T 8.70 4.17 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 1.21 0.00 0.00 6 A 8.46 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.03 4.54 0.00 1.58 1.68 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.19 1.28 7.81 8 P 0.00 3.40 0.00 2.13 1.89 0.00 3.48 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.91 0.00 9 E 8.47 4.39 0.00 1.85 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 2.12 2.21 0.00 10 T 7.89 3.64 4.36 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 0.00 0.00 0.00 0.91 0.00 0.00 11 V 7.28 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 0.63 0.00 0.00 0.94 0.00 0.00 12 K 7.94 4.38 0.00 1.81 1.86 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.45 7.81 13 R 7.46 4.30 0.00 1.62 1.46 0.00 3.03 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.75 0.00 14 D 8.17 4.08 0.00 2.90 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 15 W 8.46 5.15 0.00 2.99 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 16 Y 7.90 3.89 0.00 3.05 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 17 V 8.26 4.66 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 0.89 0.00 0.00 1.13 0.00 0.00 18 V 8.33 3.79 2.13 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 0.91 0.00 0.00 1.00 0.00 0.00 19 D 9.10 4.33 0.00 2.66 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 20 A 8.09 3.53 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 21 T 8.12 4.53 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 1.34 0.00 0.00 22 G 7.63 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.87 4.22 0.00 1.77 1.88 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.43 7.81 24 T 7.29 4.26 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 25 L 7.63 4.90 0.00 1.79 1.83 0.95 0.48 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 26 G 8.92 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 27 R 9.32 3.61 0.00 2.01 2.25 0.00 3.16 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.68 0.00 28 L 7.92 3.93 0.00 1.71 1.65 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.99 4.08 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 30 T 7.90 3.81 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 1.25 0.00 0.00 31 E 7.85 3.88 0.00 2.22 2.01 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 2.30 2.36 0.00 32 L 7.84 4.00 0.00 1.74 1.71 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.04 4.12 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 34 R 8.83 3.76 0.00 1.85 1.93 0.00 3.10 0.00 0.00 3.06 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 35 R 8.28 4.00 0.00 1.79 1.79 0.00 3.14 0.00 0.00 3.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.34 0.00 36 L 7.75 4.97 0.00 1.93 1.58 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.55 3.72 0.00 1.67 1.86 0.00 3.31 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 38 G 7.70 3.46 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 0.00 39 K 7.92 4.07 0.00 1.65 1.75 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.39 7.81 40 H 8.18 4.10 0.00 3.08 3.27 0.00 5.96 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 41 K 7.97 3.62 0.00 2.17 1.75 0.00 1.86 0.00 0.00 2.12 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.68 7.81 42 A 8.34 4.09 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 43 E 7.89 4.82 0.00 2.20 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 0.00 2.07 2.09 0.00 44 Y 7.85 4.24 0.00 2.91 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 45 T 8.69 4.26 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 1.28 0.00 0.00 46 P 0.00 4.19 0.00 2.09 2.17 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 47 H 8.05 4.55 0.00 3.10 3.34 0.00 5.91 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.22 3.63 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 0.58 0.00 0.00 0.66 0.00 0.00 49 D 7.86 4.44 0.00 2.80 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 50 T 8.68 3.18 4.55 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 1.19 0.00 0.00 51 G 8.16 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 0.00 0.00 0.00 52 D 6.92 4.08 0.00 2.79 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 53 Y 5.88 4.17 0.00 3.08 2.88 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 54 I 8.72 5.10 1.99 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.80 1.00 0.00 0.00 55 I 8.71 5.22 1.97 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 1.21 1.57 1.02 0.00 0.00 56 V 7.96 5.06 2.13 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 0.87 0.00 0.00 0.95 0.00 0.00 57 L 8.22 3.91 0.00 1.74 1.56 0.81 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 58 N 10.22 4.48 0.00 3.05 2.72 0.00 0.00 7.53 7.09 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 59 A 8.46 3.98 1.49 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 60 D 9.35 4.52 0.00 2.85 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 61 K 8.28 4.58 0.00 1.65 1.69 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.55 7.81 62 V 8.04 4.50 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 0.69 0.00 0.00 0.96 0.00 0.00 63 A 8.74 3.94 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 64 V 7.01 3.44 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 0.94 0.00 0.00 1.11 0.00 0.00 65 T 8.30 4.36 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 1.21 0.00 0.00 66 G 8.59 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 67 N 7.61 4.59 0.00 2.75 2.69 0.00 0.00 7.25 6.04 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 68 K 8.48 4.20 0.00 1.78 1.81 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 69 R 7.95 5.10 0.00 1.84 1.92 0.00 3.26 0.00 0.00 3.29 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 0.00 70 T 7.86 4.45 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 1.11 0.00 0.00 71 D 8.12 4.77 0.00 2.74 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 72 K 7.86 4.48 0.00 1.80 1.88 0.00 1.35 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.66 1.37 7.81 73 V 7.79 4.82 1.66 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 -1.00 0.00 0.00 0.46 0.00 0.00 74 Y 7.84 3.73 0.00 2.85 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 75 Y 8.15 4.13 0.00 3.07 2.89 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 76 H 8.75 4.68 0.00 3.20 3.29 0.00 5.81 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 77 H 8.49 3.88 0.00 3.21 3.29 0.00 5.93 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 78 T 8.72 3.91 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 1.18 0.00 0.00 79 G 8.36 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 80 H 8.17 4.39 0.00 3.24 3.35 0.00 5.91 0.00 0.00 0.00 0.00 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.27 3.10 1.89 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 1.35 1.24 0.92 0.00 0.00 82 G 9.05 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 83 G 8.09 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 84 I 7.57 3.58 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.89 0.00 0.00 85 K 7.81 3.62 0.00 1.87 1.82 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.21 1.38 7.81 86 Q 8.07 4.38 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.64 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 87 A 8.38 5.22 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.09 4.17 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 89 F 7.80 5.01 0.00 3.23 3.05 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 90 E 8.96 3.93 0.00 2.14 2.22 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 2.43 2.42 0.00 91 E 8.10 4.03 0.00 2.06 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 2.35 2.35 0.00 92 M 7.45 4.38 0.00 2.00 2.42 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.27 2.71 0.00 93 I 8.31 4.10 1.94 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.71 0.85 0.00 0.00 94 A 7.52 4.56 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 95 R 7.89 4.17 0.00 1.78 1.98 0.00 3.30 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 96 R 7.40 5.01 0.00 1.78 1.72 0.00 3.22 0.00 0.00 3.28 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.95 0.00 97 P 0.00 4.27 0.00 2.22 2.11 0.00 3.67 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 2.12 2.40 0.00 98 E 8.46 4.01 0.00 2.05 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 0.00 2.39 2.39 0.00 99 R 8.04 3.84 0.00 1.90 1.85 0.00 3.03 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 100 V 6.85 3.97 1.94 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 0.78 0.00 0.00 1.00 0.00 0.00 101 I 8.69 3.77 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.08 0.95 0.00 0.00 102 E 8.02 4.03 0.00 2.32 2.50 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 2.97 2.41 0.00 103 I 7.82 3.78 2.00 0.00 0.00 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 1.67 1.32 1.16 0.00 0.00 104 A 8.09 4.07 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 0.00 105 V 8.75 3.73 2.22 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 1.07 0.00 0.00 0.97 0.00 0.00 106 K 7.59 4.45 0.00 2.10 1.76 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.40 0.98 7.81 107 G 8.76 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 0.00 108 M 7.35 4.51 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.48 0.00 109 L 7.43 4.67 0.00 1.83 1.81 0.95 1.27 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 0.00 110 P 0.00 4.02 0.00 2.07 2.21 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 111 K 8.12 3.67 0.00 1.88 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.64 7.81 112 G 8.64 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 0.00 113 P 0.00 4.18 0.00 2.17 2.13 0.00 3.63 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 114 L 8.08 3.99 0.00 1.62 1.68 0.96 1.12 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 0.00 115 G 7.90 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 0.00 0.00 0.00 116 R 7.86 4.11 0.00 2.26 2.01 0.00 3.09 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 117 A 7.67 4.75 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 0.00 118 M 7.58 4.54 0.00 1.93 2.22 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 119 F 8.32 4.26 0.00 3.03 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 0.00 120 R 8.29 3.82 0.00 2.02 1.98 0.00 3.36 0.00 0.00 3.40 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 121 K 7.74 4.64 0.00 1.81 1.61 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.83 1.00 7.81 122 L 8.00 4.08 0.00 1.28 1.41 0.78 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.87 3.62 0.00 2.17 2.11 0.00 1.69 0.00 0.00 1.90 0.00 0.00 3.17 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.58 7.81 124 V 7.66 3.72 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 1.01 0.00 0.00 0.71 0.00 0.00 125 Y 7.90 3.58 0.00 3.36 2.97 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 0.00 126 A 9.30 5.16 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 0.00 0.00 127 G 8.81 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 128 N 7.88 4.46 0.00 2.88 2.94 0.00 0.00 6.40 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 0.00 129 E 7.76 4.05 0.00 1.90 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 2.26 2.37 0.00 130 H 7.76 4.68 0.00 3.23 3.19 0.00 5.94 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 8.46 4.06 0.00 3.11 3.27 0.00 0.00 6.56 8.16 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 0.00 132 H 7.97 4.14 0.00 3.05 3.52 0.00 5.88 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.99 3.94 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 0.00 134 A 7.23 4.17 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 0.00 0.00 0.00 0.00 0.00 135 Q 7.96 4.74 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.70 0.00 136 Q 8.66 4.03 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 137 P 0.00 3.83 0.00 1.97 1.87 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 138 Q 7.14 4.19 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.66 0.00 0.00 0.00 0.00 0.00 1.57 1.16 0.00 139 V 7.13 4.61 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 0.59 0.00 0.00 0.85 0.00 0.00 140 L 8.20 3.97 0.00 1.33 1.16 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00