NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.9114 8.3016 109.1155 44.9766 0.0000 174.0612 4 D 4.2095 8.4578 124.3083 53.2755 42.8780 175.3604 5 K 3.9608 9.3906 128.5518 59.6614 32.7716 178.8573 6 K 4.0084 8.0889 118.3201 59.0222 32.0318 179.2948 7 V 3.6743 8.3836 118.9971 66.2342 31.3733 178.2218 8 I 3.8017 7.6723 118.9464 64.2541 36.8619 178.3582 9 Q 3.9540 8.0394 118.9401 59.3186 28.6151 178.5516 10 H 4.1062 8.3162 117.0900 59.0066 28.7693 177.5943 11 L 3.9996 8.3738 120.9113 58.2601 41.5461 179.5758 12 N 4.4173 8.5787 116.4463 55.9823 38.3625 177.5170 13 K 3.9605 8.1564 121.3518 59.5346 32.2612 179.0229 14 I 3.7249 8.3525 120.5120 64.2085 36.9142 178.0539 15 L 4.0335 8.4375 121.8345 58.2199 42.0025 179.3741 16 G 3.5653 8.1084 105.5919 47.8016 0.0000 175.4559 17 N 4.3750 8.1130 118.8428 56.1464 38.6646 177.3938 18 E 4.0907 8.3722 120.1852 59.4218 29.1749 179.2601 19 L 4.0591 8.1411 119.1974 57.7808 41.5306 179.8482 20 I 3.6333 7.6357 118.9772 64.2657 37.1235 177.9910 21 A 3.2412 7.8672 121.6921 55.1349 18.0711 179.3596 22 I 3.5691 7.7697 118.2559 65.0174 37.2631 178.4290 23 N 4.3869 7.7637 116.3691 56.2018 38.2788 177.4528 24 Q 3.8677 8.2591 121.3883 59.5135 29.1513 177.9768 25 Y 4.6467 8.3727 118.1038 61.0604 38.0009 178.1663 26 F 3.9336 8.4825 121.9009 61.0011 39.4898 177.1235 27 L 4.0399 8.2803 120.1630 58.2944 41.9223 178.4075 28 H 3.7943 8.4049 116.5851 58.9195 28.5371 177.5174 29 S 4.3565 8.2528 114.7930 61.6860 62.2254 176.4274 30 R 3.9147 7.7346 119.8675 58.7350 29.7371 179.0036 31 M 3.4673 7.7028 118.9762 57.9187 31.8892 178.6584 32 W 4.3962 8.1045 119.3758 59.8583 29.1802 178.4098 33 N 4.3869 8.5754 116.8181 56.4068 37.7979 176.7712 34 D 4.3485 8.0861 118.5448 57.2446 41.3071 177.8631 35 W 4.8203 8.1026 116.9298 57.3190 29.3362 177.2525 36 G 4.0293 8.5435 108.3544 45.5041 0.0000 173.9501 37 L 4.8085 7.9487 122.1823 53.2871 40.2978 177.4372 38 K 4.0642 8.4400 122.0049 59.1902 32.4041 178.9746 39 R 3.8623 8.0831 119.2162 59.3426 29.8903 178.6402 40 L 3.8941 7.7701 118.5647 57.4245 41.5317 179.4108 41 G 3.7694 8.2390 105.5594 47.8853 0.0000 175.6336 42 A 3.9884 8.3039 123.6316 55.0053 18.4319 179.2299 43 H 3.9743 8.2288 116.8461 59.4392 29.9619 177.2126 44 E 4.0298 8.6435 121.4605 59.1221 29.4818 177.8852 45 Y 3.9991 8.1864 119.8888 61.2480 38.8037 178.1518 46 H 4.1319 8.0949 116.6711 58.7189 28.7551 177.7034 47 E 3.9072 8.0460 120.5778 59.2203 29.1001 179.3184 48 S 4.2763 8.1642 113.3577 61.4551 62.6353 176.1944 49 I 3.5837 7.6360 122.5269 64.5390 36.8288 178.1868 50 D 4.2959 8.1847 119.6519 57.2691 40.5981 178.7102 51 E 4.2434 8.1357 120.4765 59.1675 29.4736 179.0537 52 M 4.0260 8.2831 118.9705 58.5832 32.1066 179.0625 53 K 4.0088 7.9345 118.1392 59.6182 32.2161 179.2384 54 H 4.2997 8.1067 116.3759 58.7206 28.5897 177.7226 55 A 4.0008 8.1923 122.6958 54.9935 18.2186 178.8583 56 D 4.2957 8.1760 116.6460 57.7905 41.2369 179.0072 57 K 4.0220 7.9797 118.3372 59.2980 31.9805 179.3729 58 L 4.0068 8.0695 119.2562 57.8953 41.5427 179.4221 59 I 3.7084 8.1369 120.0753 64.6095 37.0902 178.3382 60 E 3.9796 8.2894 119.1302 59.4854 29.2853 179.4566 61 R 4.0679 8.2039 118.7598 59.4292 30.0424 178.6481 62 I 3.7597 8.0263 119.7882 64.3099 37.1276 178.3846 63 L 3.9780 8.1696 119.9529 57.6664 41.2385 179.1897 64 F 4.2983 8.0966 119.3627 61.4306 39.5041 176.6090 65 L 3.8429 8.2167 116.0257 54.4803 41.0876 176.9707 66 E 3.4498 8.0175 117.4916 57.6330 26.8703 174.3456 67 G 4.0200 8.0652 107.8173 43.8465 0.0000 173.3360 68 L 4.6067 8.0297 118.7342 51.9947 42.8993 175.2176 69 P 4.3797 0.0000 0.0000 62.3640 31.8768 175.8478 70 N 4.6779 9.4272 122.0208 52.5206 38.5812 174.2415 71 L 4.6033 8.3082 124.3425 54.5433 42.5053 177.4184 72 Q 4.0390 8.4257 121.6558 57.8964 29.2259 175.3649 73 D 4.5677 7.9832 117.9639 52.5970 39.9854 174.5168 74 L 4.2782 8.1338 125.9419 53.2887 42.6691 177.4581 75 G 3.8102 8.3171 116.3720 44.9957 0.0000 171.1857 76 K 4.2044 8.3366 120.7342 55.2785 32.7526 176.9828 77 L 4.1146 8.3938 126.8715 54.5913 42.1260 177.2490 78 L 4.3343 8.5891 124.8118 53.5242 40.4053 174.9318 79 I 4.2420 7.9536 123.4917 59.5370 37.7533 176.5995 80 G 3.9506 8.6861 114.6830 45.2890 0.0000 172.5950 81 E 4.5919 9.2340 118.5564 56.5088 30.7194 176.0190 82 N 5.1248 7.6758 115.7588 50.5444 41.8068 175.0273 83 T 4.4191 8.6275 116.1183 67.3332 68.5812 176.4722 84 Q 4.0070 8.1938 120.7067 59.2586 29.0458 178.1169 85 E 4.0230 8.7243 119.6811 59.6634 29.5447 179.1382 86 M 3.9760 8.6112 119.0973 58.3462 32.0210 178.8994 87 L 4.2158 8.3403 119.2399 57.8136 41.8573 179.2572 88 Q 4.0192 8.3166 119.5957 59.3648 28.9764 178.0496 89 C 4.2417 8.8833 118.2058 62.8318 28.0552 175.7819 90 D 4.6560 8.3669 120.6428 57.3652 40.3616 178.5923 91 L 3.9693 7.9548 120.6042 58.2346 42.0675 178.7856 92 N 4.3501 8.3942 116.5270 56.2169 38.4091 177.1813 93 L 4.0225 8.0831 121.7861 58.3028 42.1473 178.9443 94 E 4.0836 8.5419 118.6884 59.1465 29.3421 179.3238 95 L 4.0018 8.2516 119.5783 57.5179 41.6882 179.4046 96 K 3.9126 7.9874 119.0158 59.4063 32.1936 178.6035 97 A 4.0267 8.2236 121.2164 55.6874 18.3417 179.7414 98 T 3.8513 8.1866 114.3031 66.5078 68.3537 176.8240 99 K 3.9253 8.0695 121.5298 59.7775 32.3249 178.6822 100 D 4.4283 8.1930 119.0742 57.2205 40.6707 178.8841 101 L 4.0122 8.0081 119.6799 57.7606 41.6401 179.5185 102 R 3.9469 7.9065 117.9116 59.5472 30.0630 179.0242 103 E 3.9750 8.0668 117.8278 59.2800 29.3543 179.2975 104 A 3.6185 8.1011 120.9081 54.9597 18.3653 179.8557 105 I 3.6663 7.8514 118.4165 64.3511 37.2377 178.5377 106 V 3.5774 7.8399 119.1901 66.3835 31.3015 177.5942 107 H 4.0805 8.1969 117.5710 59.4686 29.7202 176.6176 108 C 3.8197 8.2808 119.0414 63.0341 28.0846 175.9106 109 E 3.9036 8.2490 120.4124 59.4040 29.0095 178.6156 110 Q 3.9822 7.8594 118.1088 58.8224 29.1362 177.7508 111 V 3.9618 7.2102 110.3423 60.7450 31.8679 175.6005 112 H 3.0635 7.4686 113.8608 57.1880 26.5387 176.2356 113 D 4.5249 7.6671 121.0436 53.3994 38.8090 175.3799 114 Y 4.3663 7.5583 121.8110 60.1805 38.3692 177.4674 115 V 3.7047 7.8580 119.2516 65.9132 31.7757 177.9613 116 S 4.1573 8.2660 114.6383 61.5816 62.6241 176.6369 117 R 3.9007 8.0431 121.3347 59.5301 29.8481 177.9651 118 D 4.3652 8.2830 117.8037 57.2664 41.1882 178.0518 119 L 3.9488 7.9805 120.7845 58.2621 42.0886 179.0379 120 L 4.0371 8.0857 118.9616 57.4894 41.5243 179.3794 121 K 3.9558 8.5232 120.1879 59.4871 31.9908 178.5918 122 D 4.3583 8.0866 119.1280 57.4931 40.7103 178.6805 123 I 3.4903 7.7433 120.1935 64.4142 37.0453 178.1839 124 L 3.9327 8.2888 121.3872 58.1549 41.8860 178.6761 125 E 3.9327 8.3215 119.3522 59.2717 29.5724 178.7679 126 S 4.2021 7.9764 113.3220 61.2658 62.3806 175.9858 127 E 4.1225 8.5534 121.7583 59.4013 29.1070 179.1424 128 E 4.0264 8.5611 118.9167 59.2659 29.4601 179.1327 129 E 4.0075 8.3556 118.8689 59.7025 29.5270 178.8590 130 H 4.3796 8.2680 118.2634 59.3726 29.8610 177.4347 131 I 3.7348 8.0647 121.8890 64.1853 36.9091 177.6796 132 D 4.3417 8.3793 119.1383 57.7488 41.0624 177.7261 133 Y 4.1315 8.2410 119.7981 60.7279 38.7437 178.3037 134 L 3.7382 7.9796 119.7007 57.9063 41.7905 179.2381 135 E 3.9456 8.4479 118.8466 59.6984 29.2779 179.7261 136 T 3.8028 7.9594 115.7727 66.6469 68.4991 176.8037 137 Q 3.8192 7.7781 119.9463 58.8186 28.2948 178.9270 138 L 3.8415 7.8459 120.0975 57.5093 41.6342 179.4361 139 G 3.7832 8.0809 105.8641 48.2093 0.0000 175.6625 140 L 4.0552 7.8793 121.4009 57.2021 41.7156 179.4184 141 I 3.5178 7.3302 119.9514 64.5609 36.7665 178.4550 142 Q 3.9576 7.4176 117.0709 58.9595 28.6471 178.6087 143 K 4.1618 7.8319 118.3735 58.5010 32.2769 178.8700 144 V 4.2230 8.2558 110.1000 59.7234 33.0793 176.4701 145 G 4.0976 7.7000 106.6301 45.8736 0.0000 174.3957 146 L 3.9660 8.5645 123.2245 58.0715 42.1106 179.3734 147 E 3.9702 8.1380 117.7870 59.6489 29.4410 178.7840 148 N 4.3125 8.2354 115.9077 56.5594 38.3699 176.5398 149 Y 3.9847 7.8786 119.6915 60.8131 39.1890 178.0047 150 L 4.0793 8.2077 119.8791 57.6810 41.5948 179.1575 151 Q 3.9205 8.1723 119.5746 59.3023 28.8290 178.1991 152 S 4.2819 8.1286 113.7804 60.0707 63.1055 174.4155 153 H 4.6122 7.5244 118.4215 55.6277 29.5115 175.9903 154 M 4.2199 7.8712 121.4353 57.8516 31.9178 176.0205 155 H 5.0391 7.6952 114.3028 54.0366 30.5982 174.8672 156 E 4.1869 8.6807 120.4121 56.5104 29.7655 176.0318 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 3 G 8.30 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 4 D 8.46 4.21 0.00 2.85 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.39 3.96 0.00 1.85 1.77 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.51 7.81 6 K 8.09 4.01 0.00 2.12 1.60 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.53 1.06 7.81 7 V 8.38 3.67 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 1.07 0.00 0.00 1.05 0.00 0.00 8 I 7.67 3.80 2.02 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 1.52 0.65 0.90 0.00 0.00 9 Q 8.04 3.95 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.60 0.00 10 H 8.32 4.11 0.00 3.42 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.37 4.00 0.00 1.78 1.76 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.58 4.42 0.00 2.87 2.86 0.00 0.00 6.72 6.86 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 13 K 8.16 3.96 0.00 1.88 1.93 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 8.35 3.72 2.01 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 1.68 0.75 0.92 0.00 0.00 15 L 8.44 4.03 0.00 1.79 1.91 0.92 0.99 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 16 G 8.11 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 17 N 8.11 4.37 0.00 2.95 2.88 0.00 0.00 7.01 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 18 E 8.37 4.09 0.00 2.11 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 2.55 2.52 0.00 19 L 8.14 4.06 0.00 1.64 1.69 0.90 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.64 3.63 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.83 0.89 0.00 0.00 21 A 7.87 3.24 0.96 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 22 I 7.77 3.57 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.03 0.86 0.00 0.00 23 N 7.76 4.39 0.00 2.76 2.83 0.00 0.00 6.77 7.43 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 24 Q 8.26 3.87 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 25 Y 8.37 4.65 0.00 3.06 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.48 3.93 0.00 3.34 3.10 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 27 L 8.28 4.04 0.00 1.85 1.72 0.88 0.87 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 28 H 8.40 3.79 0.00 3.41 2.72 0.00 5.70 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 29 S 8.25 4.36 0.00 3.99 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 30 R 7.73 3.91 0.00 2.02 1.88 0.00 2.94 0.00 0.00 2.62 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 31 M 7.70 3.47 0.00 0.82 1.50 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 32 W 8.10 4.40 0.00 3.53 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 33 N 8.58 4.39 0.00 2.70 2.85 0.00 0.00 6.64 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.09 4.35 0.00 2.50 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 35 W 8.10 4.82 0.00 3.73 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 36 G 8.54 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 37 L 7.95 4.81 0.00 1.97 1.63 1.31 0.68 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 38 K 8.44 4.06 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.48 7.81 39 R 8.08 3.86 0.00 2.00 1.94 0.00 3.15 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 40 L 7.77 3.89 0.00 1.21 0.22 0.24 0.25 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 41 G 8.24 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 42 A 8.30 3.99 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 43 H 8.23 3.97 0.00 3.35 3.39 0.00 5.78 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 44 E 8.64 4.03 0.00 2.57 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 2.75 2.63 0.00 45 Y 8.19 4.00 0.00 3.02 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 46 H 8.09 4.13 0.00 3.28 3.23 0.00 5.69 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 47 E 8.05 3.91 0.00 1.96 1.75 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 2.19 2.12 0.00 48 S 8.16 4.28 0.00 4.13 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.64 3.58 1.83 0.00 0.00 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 0.97 0.65 0.84 0.00 0.00 50 D 8.18 4.30 0.00 2.84 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 4.24 0.00 2.18 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 2.69 2.45 0.00 52 M 8.28 4.03 0.00 2.01 2.24 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 2.91 2.55 0.00 53 K 7.93 4.01 0.00 1.87 1.79 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.55 7.81 54 H 8.11 4.30 0.00 3.50 3.34 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.19 4.00 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 56 D 8.18 4.30 0.00 2.93 2.86 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 57 K 7.98 4.02 0.00 2.04 1.86 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.65 7.81 58 L 8.07 4.01 0.00 1.88 1.73 0.94 0.67 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 59 I 8.14 3.71 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.72 0.92 0.00 0.00 60 E 8.29 3.98 0.00 2.17 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 2.34 2.40 0.00 61 R 8.20 4.07 0.00 2.08 2.12 0.00 3.31 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 62 I 8.03 3.76 2.03 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 1.54 0.64 0.92 0.00 0.00 63 L 8.17 3.98 0.00 1.99 1.78 0.93 0.89 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 64 F 8.10 4.30 0.00 2.99 3.36 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 65 L 8.22 3.84 0.00 1.66 1.58 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.02 3.45 0.00 2.05 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 2.16 2.12 0.00 67 G 8.07 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 0.00 0.00 0.00 68 L 8.03 4.61 0.00 1.60 1.59 0.91 0.99 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 69 P 0.00 4.38 0.00 2.04 1.98 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 70 N 9.43 4.68 0.00 2.60 2.84 0.00 0.00 7.06 7.65 0.00 0.00 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 L 8.31 4.60 0.00 1.61 1.63 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.43 4.04 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 7.98 4.57 0.00 2.68 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.13 4.28 0.00 1.55 1.56 0.88 1.07 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 75 G 8.32 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 76 K 8.34 4.20 0.00 1.72 1.72 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.45 7.81 77 L 8.39 4.11 0.00 1.64 1.56 0.88 0.99 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 78 L 8.59 4.33 0.00 1.77 1.68 0.96 0.75 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 79 I 7.95 4.24 1.88 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 1.33 0.77 0.91 0.00 0.00 80 G 8.69 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 81 E 9.23 4.59 0.00 2.10 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 2.32 2.27 0.00 82 N 7.68 5.12 0.00 2.89 2.83 0.00 0.00 6.26 7.22 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 83 T 8.63 4.42 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 1.49 0.00 0.00 84 Q 8.19 4.01 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 85 E 8.72 4.02 0.00 2.34 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 2.35 2.46 0.00 86 M 8.61 3.98 0.00 1.37 2.29 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 1.96 0.00 87 L 8.34 4.22 0.00 1.91 1.74 0.84 0.66 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 88 Q 8.32 4.02 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 89 C 8.88 4.24 0.00 3.27 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.37 4.66 0.00 3.07 2.76 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 91 L 7.95 3.97 0.00 1.94 1.89 0.93 0.59 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 92 N 8.39 4.35 0.00 2.97 2.88 0.00 0.00 6.68 6.36 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 L 8.08 4.02 0.00 1.98 1.97 0.92 0.94 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 94 E 8.54 4.08 0.00 2.19 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 0.00 2.68 2.49 0.00 95 L 8.25 4.00 0.00 1.85 1.73 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.99 3.91 0.00 1.87 2.00 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 97 A 8.22 4.03 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.19 3.85 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 1.23 0.00 0.00 99 K 8.07 3.93 0.00 1.86 1.99 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 D 8.19 4.43 0.00 2.90 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 0.00 101 L 8.01 4.01 0.00 1.95 1.72 0.93 0.95 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 0.00 102 R 7.91 3.95 0.00 2.04 2.00 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 103 E 8.07 3.97 0.00 2.14 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 2.52 0.00 104 A 8.10 3.62 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 0.00 105 I 7.85 3.67 2.03 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 1.42 0.75 0.93 0.00 0.00 106 V 7.84 3.58 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 1.01 0.00 0.00 0.98 0.00 0.00 107 H 8.20 4.08 0.00 3.28 3.34 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.28 3.82 0.00 3.09 3.17 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 0.00 109 E 8.25 3.90 0.00 2.20 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 0.00 2.37 2.45 0.00 110 Q 7.86 3.98 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 111 V 7.21 3.96 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 0.64 0.00 0.00 0.82 0.00 0.00 112 H 7.47 3.06 0.00 3.15 3.13 0.00 5.66 0.00 0.00 0.00 0.00 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.67 4.52 0.00 2.57 2.46 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 0.00 114 Y 7.56 4.37 0.00 3.08 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 0.00 115 V 7.86 3.70 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.27 4.16 0.00 4.25 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 0.00 117 R 8.04 3.90 0.00 1.94 2.20 0.00 3.24 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 118 D 8.28 4.37 0.00 3.04 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 0.00 119 L 7.98 3.95 0.00 1.79 1.87 0.95 0.74 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 0.00 120 L 8.09 4.04 0.00 1.88 1.71 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.52 3.96 0.00 1.93 2.07 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.35 7.81 122 D 8.09 4.36 0.00 2.92 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 0.00 123 I 7.74 3.49 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.83 0.83 0.00 0.00 124 L 8.29 3.93 0.00 1.82 1.87 0.94 0.75 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 0.00 125 E 8.32 3.93 0.00 2.11 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 0.00 2.33 2.34 0.00 126 S 7.98 4.20 0.00 3.94 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.55 4.12 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 128 E 8.56 4.03 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 129 E 8.36 4.01 0.00 2.24 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 0.00 2.37 2.54 0.00 130 H 8.27 4.38 0.00 3.29 3.51 0.00 5.61 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 0.00 131 I 8.06 3.73 2.06 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 1.43 0.64 0.93 0.00 0.00 132 D 8.38 4.34 0.00 2.92 2.96 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 0.00 133 Y 8.24 4.13 0.00 3.15 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.98 3.74 0.00 2.09 1.66 1.08 0.70 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 0.00 135 E 8.45 3.95 0.00 2.04 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 2.31 2.44 0.00 136 T 7.96 3.80 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 1.18 0.00 0.00 137 Q 7.78 3.82 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 1.36 1.87 0.00 138 L 7.85 3.84 0.00 1.70 1.61 0.82 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.08 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 0.00 140 L 7.88 4.06 0.00 1.84 1.86 1.01 0.69 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 0.00 141 I 7.33 3.52 1.77 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.04 0.79 0.00 0.00 142 Q 7.42 3.96 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 143 K 7.83 4.16 0.00 1.74 1.86 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.60 7.81 144 V 8.26 4.22 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 0.78 0.00 0.00 1.13 0.00 0.00 145 G 7.70 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 0.00 146 L 8.56 3.97 0.00 1.76 1.69 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.14 3.97 0.00 2.06 1.99 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 2.40 2.40 0.00 148 N 8.24 4.31 0.00 3.10 2.90 0.00 0.00 6.68 7.48 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 0.00 149 Y 7.88 3.98 0.00 3.04 3.18 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 0.00 150 L 8.21 4.08 0.00 1.91 1.73 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.17 3.92 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 152 S 8.13 4.28 0.00 3.77 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 0.00 153 H 7.52 4.61 0.00 2.96 3.05 0.00 5.81 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 0.00 154 M 7.87 4.22 0.00 1.81 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.44 0.00 155 H 7.70 5.04 0.00 3.10 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.68 4.19 0.00 2.06 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 2.23 2.29 0.00