NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 F 5.0965 8.3201 119.4304 57.6487 40.2086 174.0630 17 A 4.5702 8.8748 127.0691 48.7694 21.1513 176.2759 18 R 4.2084 8.2793 114.3657 58.3172 31.0124 174.6895 19 S 4.6817 7.5204 110.9163 56.1638 66.4625 173.6193 20 L 4.5004 8.4383 123.3010 55.5518 42.2341 176.0488 21 S 4.8139 9.1530 119.7450 57.1296 67.1576 172.6654 22 I 5.0392 8.1103 120.5320 59.6716 39.8866 175.6106 23 T 3.8975 8.5146 123.9584 64.7268 67.5883 173.5839 24 T 3.2872 8.8178 125.4092 63.4405 65.0674 170.2388 25 P 4.0965 0.0000 0.0000 63.8800 32.8277 175.6882 26 E 5.6631 7.5818 119.6169 54.8580 32.9945 173.9962 27 E 4.8485 8.6830 123.8695 55.2079 34.5842 173.5996 28 M 5.1755 8.6852 121.8441 53.7118 34.4434 175.2624 29 I 4.5853 8.7777 124.2298 59.3141 40.7441 174.0119 30 E 5.0498 8.8722 127.1775 54.4520 31.9312 174.7612 31 K 4.8303 8.9813 124.7034 54.8786 37.5190 174.8060 32 A 4.9961 8.4877 121.8913 49.7316 21.7701 176.7025 33 K 4.0014 7.9758 121.1445 58.4566 32.3445 176.6275 34 G 4.0344 9.2707 114.8830 45.4275 0.0000 173.2761 35 E 4.3631 7.9963 119.1454 56.3097 31.2195 175.6754 36 T 5.0059 8.2737 110.6400 60.0668 70.9762 173.7038 37 A 4.4029 8.6093 127.9066 51.0030 20.4038 175.3498 38 Y 4.9737 8.5199 124.6817 56.2579 39.8506 174.9710 39 L 4.3853 8.1235 128.3586 52.2740 42.8646 173.9743 40 P 4.1636 0.0000 0.0000 62.5285 32.3350 178.0829 41 C 5.0137 9.2645 123.2658 55.5700 40.7733 171.2534 42 K 5.2004 8.2890 121.8450 54.3911 34.1070 175.3668 43 F 5.4839 8.6838 119.2121 55.3648 41.4172 174.1972 44 T 4.7271 9.0031 116.7107 61.9338 71.5983 174.0324 45 L 5.0357 8.7813 125.7072 54.2187 44.3099 175.4258 46 S 5.0177 9.3532 114.8061 54.8493 65.8319 173.5201 47 P 3.3063 0.0000 0.0000 65.1282 31.0417 177.9324 48 E 4.0569 7.7295 114.3032 58.2266 29.9748 177.4932 49 D 4.8099 7.4804 120.1093 54.0848 38.6215 175.7233 50 Q 4.3819 8.0813 119.1164 55.4711 29.9743 176.2271 51 G 3.9348 8.0351 108.2801 43.6208 0.0000 171.5522 52 P 4.4029 0.0000 0.0000 62.0441 31.9609 175.3859 53 L 4.1880 8.3821 123.7180 55.5116 42.9363 176.2422 54 D 4.7584 9.0836 126.3008 53.2976 43.4919 173.2123 55 I 5.1567 9.2465 126.7105 59.2876 40.7630 174.5013 56 E 5.3258 8.9284 122.1950 54.9833 33.4189 173.7416 57 W 5.2863 9.3756 121.7095 55.1412 31.9828 175.0166 58 L 5.2663 9.0453 123.1364 52.8654 45.5691 175.1457 59 I 4.3250 8.4491 121.3526 59.2907 41.2146 174.5229 60 S 5.0112 8.7951 126.0779 55.9187 63.7791 170.8638 61 P 4.8178 0.0000 0.0000 61.9293 32.2668 177.6816 62 A 3.8620 8.5493 125.4612 55.1451 18.7305 178.4270 63 D 4.5653 8.2970 115.1370 56.8928 41.0901 176.0161 64 N 5.1677 7.3833 112.1484 50.7650 40.5434 174.3211 65 Q 4.1313 8.5707 116.4141 58.1420 29.0235 177.5824 66 K 4.1707 7.7503 118.0590 56.2774 32.5893 176.5818 67 V 4.3954 7.8082 120.8383 60.6340 34.6973 174.7079 68 D 4.2245 8.1665 118.9346 55.5395 38.8404 174.5683 69 Q 4.6035 8.0238 118.1623 54.1008 30.7559 177.6941 70 V 4.1113 8.5079 124.9437 62.2841 31.2703 175.7724 71 I 4.5424 8.6456 117.8416 62.1515 39.7212 175.5407 72 I 5.0194 7.5970 120.0016 60.0457 41.3639 173.1128 73 L 5.5395 9.3019 126.3835 54.8544 44.8566 173.9890 74 Y 5.8061 9.9174 120.9000 55.0432 41.7616 174.1564 75 S 4.7507 8.6563 119.8396 57.3441 66.7939 174.0294 76 G 4.0487 9.2596 107.4687 46.8265 0.0000 173.1329 77 D 4.3584 7.8358 113.9484 53.7435 38.7748 173.8985 78 K 4.4932 7.2178 116.4785 54.4985 35.7097 175.4711 79 I 5.0158 7.9937 122.2206 60.1518 38.8824 174.9531 80 Y 4.8575 9.1648 122.2150 56.5160 40.5478 175.6692 81 D 5.0211 8.8163 121.3620 53.0209 41.2737 175.9577 82 D 4.7330 7.5334 119.9062 54.0058 40.0467 174.6353 83 Y 4.5881 7.8033 117.8012 59.1304 41.2107 175.7959 84 Y 4.6318 7.9051 123.1896 54.9917 39.2880 173.6010 85 P 4.2093 0.0000 0.0000 65.7783 31.5377 178.6203 86 D 4.4496 7.3873 115.2949 56.0244 40.9189 176.6923 87 L 4.6951 8.0883 118.4291 53.8043 42.4707 175.7940 88 K 3.8914 7.6994 121.0854 58.3344 32.0747 177.1286 89 G 4.0150 9.1441 114.3800 45.6061 0.0000 173.3237 90 R 4.8087 8.3102 117.1974 54.6137 32.1797 175.0718 91 V 5.1640 7.9515 118.7076 60.2567 34.3339 174.2128 92 H 4.8712 8.0400 120.8482 54.0066 31.8797 172.6682 93 F 4.9024 8.6734 119.3492 58.2585 38.8849 175.5241 94 T 4.3930 8.7855 112.5526 62.6896 69.7412 175.3473 95 S 4.5060 8.0533 116.4307 57.6538 63.2144 173.0997 96 N 4.6979 8.6041 122.2402 53.5030 38.4485 174.8050 97 D 4.8206 7.4575 119.1399 51.5873 41.2410 175.4386 98 L 4.0669 8.1035 124.9514 56.7702 42.6047 178.9078 99 K 4.2617 7.8001 115.9198 58.7631 32.8284 177.3415 100 S 4.3385 7.6318 113.6730 58.2216 63.2965 173.7926 101 G 2.3370 6.9274 110.1076 45.0101 0.0000 173.3111 102 D 4.9032 7.7831 120.2538 52.2974 41.5322 174.6600 103 A 4.8016 9.1268 127.2007 51.8050 19.8538 177.2165 104 S 4.8276 8.7598 115.2724 60.0368 64.1409 173.5608 105 I 4.9185 7.8476 115.0666 59.2363 41.1462 173.7154 106 N 5.1654 8.5844 120.3900 51.7011 41.3677 174.5617 107 V 4.6492 8.2574 122.6441 61.2869 33.3985 174.8676 108 T 4.3758 8.7956 119.0994 60.8947 70.6298 173.8614 109 N 4.4049 8.4294 117.5498 53.0812 37.3296 174.6781 110 L 4.1640 8.1007 118.0812 55.6485 42.9498 177.3868 111 Q 4.9833 8.7607 120.6245 53.6746 31.5329 176.8072 112 L 4.1244 8.2840 118.2829 57.5743 41.9716 179.6623 113 S 4.1452 8.2169 112.6015 61.4721 62.2496 174.4400 114 D 4.8199 7.8015 116.6182 54.7603 40.9134 176.2817 115 I 4.1159 7.8011 122.1070 60.6189 38.2575 176.2912 116 G 4.3236 7.8298 112.0893 47.1377 0.0000 170.2824 117 T 5.2613 7.7054 116.5805 62.4090 70.5355 173.7956 118 Y 5.0769 9.6299 124.6789 56.3323 40.5907 174.3802 119 Q 4.9769 9.3550 125.6379 54.3895 32.0293 173.1185 120 C 3.8271 8.4585 127.2455 54.7210 44.2900 172.2314 121 K 4.7558 8.6275 127.3323 54.7504 33.8676 175.5258 122 V 4.3470 8.5689 126.3958 60.9174 33.6292 174.3670 123 K 4.8925 8.6824 127.4883 54.5874 35.1728 175.5898 124 K 4.7609 9.0960 125.4843 53.7202 34.4444 174.3969 125 A 4.4626 8.6125 128.8081 51.7314 19.1161 175.9812 126 P 4.4408 0.0000 0.0000 63.1815 32.3225 176.9591 127 G 3.7414 8.1196 110.1313 45.9597 0.0000 173.1933 128 V 4.9864 7.9785 115.1055 59.7324 35.7057 174.1098 129 A 4.8894 9.1956 126.6386 50.0495 22.7400 174.4235 130 N 5.3987 8.6550 116.9201 50.8722 40.6242 173.5570 131 K 4.7563 8.9004 122.2689 54.6020 35.9099 174.5899 132 K 5.0054 8.6616 126.0979 54.7296 34.8992 175.1687 133 I 4.8433 9.1168 125.3402 59.8561 40.5173 174.2727 134 H 5.2212 9.2641 125.6643 54.6875 29.9514 173.9461 135 L 4.9350 9.1728 127.4729 53.5617 43.7929 175.1956 136 V 4.5791 8.7371 126.5614 61.0753 34.2761 174.3627 137 V 4.8634 8.3169 126.3359 61.1411 33.9534 175.0564 138 L 4.3668 8.6815 127.1184 54.9149 41.8055 176.6972 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 F 8.32 5.10 0.00 3.07 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 17 A 8.87 4.57 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 18 R 8.28 4.21 0.00 1.92 2.07 0.00 3.02 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 19 S 7.52 4.68 0.00 3.82 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 20 L 8.44 4.50 0.00 1.84 1.61 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.15 4.81 0.00 3.92 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 22 I 8.11 5.04 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.69 1.02 0.00 0.00 23 T 8.51 3.90 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 1.23 0.00 0.00 24 T 8.82 3.29 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 25 P 0.00 4.10 0.00 2.10 2.28 0.00 3.68 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 2.07 1.96 0.00 26 E 7.58 5.66 0.00 1.94 1.81 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 2.24 2.24 0.00 27 E 8.68 4.85 0.00 1.92 1.77 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 2.31 2.35 0.00 28 M 8.69 5.18 0.00 1.89 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 2.62 2.64 0.00 29 I 8.78 4.59 1.84 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 1.12 0.79 0.88 0.00 0.00 30 E 8.87 5.05 0.00 1.94 1.81 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 2.17 2.30 0.00 31 K 8.98 4.83 0.00 1.65 1.63 0.00 1.94 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.49 7.81 32 A 8.49 5.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.98 4.00 0.00 1.83 1.77 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.57 7.81 34 G 9.27 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 35 E 8.00 4.36 0.00 2.11 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 2.32 2.25 0.00 36 T 8.27 5.01 4.22 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 1.21 0.00 0.00 37 A 8.61 4.40 1.11 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 38 Y 8.52 4.97 0.00 2.88 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 39 L 8.12 4.39 0.00 0.94 1.38 0.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.16 0.00 1.95 1.99 0.00 3.74 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 2.16 2.04 0.00 41 C 9.26 5.01 0.00 3.16 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 42 K 8.29 5.20 0.00 1.77 1.66 0.00 1.75 0.00 0.00 1.90 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.66 1.49 7.81 43 F 8.68 5.48 0.00 2.99 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 44 T 9.00 4.73 4.32 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 1.31 0.00 0.00 45 L 8.78 5.04 0.00 2.00 1.80 1.14 1.00 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 46 S 9.35 5.02 0.00 3.73 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 47 P 0.00 3.31 0.00 1.81 1.84 0.00 3.38 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.52 0.00 48 E 7.73 4.06 0.00 2.01 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 2.19 2.27 0.00 49 D 7.48 4.81 0.00 2.84 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 50 Q 8.08 4.38 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 51 G 8.04 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 52 P 0.00 4.40 0.00 2.24 2.20 0.00 3.70 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 2.07 1.95 0.00 53 L 8.38 4.19 0.00 1.76 1.79 0.78 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 54 D 9.08 4.76 0.00 2.94 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 55 I 9.25 5.16 2.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.63 1.01 0.00 0.00 56 E 8.93 5.33 0.00 2.03 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 2.13 2.25 0.00 57 W 9.38 5.29 0.00 3.26 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 58 L 9.05 5.27 0.00 1.53 1.43 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.45 4.32 1.07 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.88 -0.15 0.00 0.00 60 S 8.80 5.01 0.00 3.70 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 61 P 0.00 4.82 0.00 2.17 2.20 0.00 3.92 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 2.12 2.11 0.00 62 A 8.55 3.86 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 63 D 8.30 4.57 0.00 2.67 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 64 N 7.38 5.17 0.00 2.64 2.76 0.00 0.00 7.16 7.27 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 65 Q 8.57 4.13 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 66 K 7.75 4.17 0.00 1.88 1.79 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 67 V 7.81 4.40 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 0.76 0.00 0.00 0.91 0.00 0.00 68 D 8.17 4.22 0.00 2.79 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 69 Q 8.02 4.60 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 70 V 8.51 4.11 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 0.41 0.00 0.00 0.60 0.00 0.00 71 I 8.65 4.54 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 1.30 0.74 0.51 0.00 0.00 72 I 7.60 5.02 1.82 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.61 0.63 0.00 0.00 73 L 9.30 5.54 0.00 2.14 1.81 1.17 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.92 5.81 0.00 2.89 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 75 S 8.66 4.75 0.00 3.90 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 76 G 9.26 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 77 D 7.84 4.36 0.00 2.78 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 78 K 7.22 4.49 0.00 1.63 1.05 0.00 1.63 0.00 0.00 1.50 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.21 1.47 7.81 79 I 7.99 5.02 1.99 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.83 1.22 0.00 0.00 80 Y 9.16 4.86 0.00 3.29 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 81 D 8.82 5.02 0.00 2.78 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 82 D 7.53 4.73 0.00 2.51 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.80 4.59 0.00 3.14 3.04 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 84 Y 7.91 4.63 0.00 3.24 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 85 P 0.00 4.21 0.00 2.04 2.02 0.00 3.34 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 86 D 7.39 4.45 0.00 2.20 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 87 L 8.09 4.70 0.00 2.00 1.76 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.70 3.89 0.00 1.73 1.90 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.45 7.81 89 G 9.14 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 90 R 8.31 4.81 0.00 1.86 2.06 0.00 3.30 0.00 0.00 3.20 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 91 V 7.95 5.16 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 0.77 0.00 0.00 0.91 0.00 0.00 92 H 8.04 4.87 0.00 3.27 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.67 4.90 0.00 3.06 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 94 T 8.79 4.39 4.41 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 1.37 0.00 0.00 95 S 8.05 4.51 0.00 4.10 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.60 4.70 0.00 2.87 2.94 0.00 0.00 5.79 8.06 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 97 D 7.46 4.82 0.00 2.67 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 0.00 0.00 0.00 98 L 8.10 4.07 0.00 1.40 1.08 -0.31 -0.32 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 99 K 7.80 4.26 0.00 2.01 2.02 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.18 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.58 1.45 7.81 100 S 7.63 4.34 0.00 3.87 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 0.00 101 G 6.93 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 0.00 0.00 0.00 102 D 7.78 4.90 0.00 2.65 2.49 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 0.00 103 A 9.13 4.80 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 0.00 104 S 8.76 4.83 0.00 3.96 3.45 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 0.00 105 I 7.85 4.92 1.36 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 -0.30 0.06 0.12 0.00 0.00 106 N 8.58 5.17 0.00 2.29 2.60 0.00 0.00 6.73 8.52 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 0.00 107 V 8.26 4.65 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 0.98 0.00 0.00 0.63 0.00 0.00 108 T 8.80 4.38 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 1.24 0.00 0.00 109 N 8.43 4.40 0.00 2.84 2.89 0.00 0.00 7.35 7.78 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 0.00 110 L 8.10 4.16 0.00 1.71 1.60 0.93 0.73 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 0.00 111 Q 8.76 4.98 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 112 L 8.28 4.12 0.00 1.73 1.74 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.22 4.15 0.00 3.86 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 0.00 114 D 7.80 4.82 0.00 2.94 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 0.00 115 I 7.80 4.12 1.92 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 1.27 1.09 1.02 0.00 0.00 116 G 7.83 4.32 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 0.00 0.00 0.00 117 T 7.71 5.26 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 1.28 0.00 0.00 118 Y 9.63 5.08 0.00 2.95 3.25 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 0.00 119 Q 9.36 4.98 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.09 2.29 0.00 120 C 8.46 3.83 0.00 1.23 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 0.00 0.00 0.00 121 K 8.63 4.76 0.00 1.57 1.59 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.21 7.81 122 V 8.57 4.35 1.76 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 0.13 0.00 0.00 0.61 0.00 0.00 123 K 8.68 4.89 0.00 1.83 1.61 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.26 7.81 124 K 9.10 4.76 0.00 1.75 1.63 0.00 1.78 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.34 7.81 125 A 8.61 4.46 1.24 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 0.00 126 P 0.00 4.44 0.00 2.17 2.15 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 127 G 8.12 3.74 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 0.00 0.00 0.00 128 V 7.98 4.99 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 0.63 0.00 0.00 0.95 0.00 0.00 129 A 9.20 4.89 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 N 8.65 5.40 0.00 2.69 2.66 0.00 0.00 5.79 7.13 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 0.00 131 K 8.90 4.76 0.00 1.70 1.44 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.28 1.46 7.81 132 K 8.66 5.01 0.00 1.71 1.62 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.36 7.81 133 I 9.12 4.84 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.94 0.91 0.00 0.00 134 H 9.26 5.22 0.00 3.09 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 9.17 4.94 0.00 1.60 1.63 0.85 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.74 4.58 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 0.90 0.00 0.00 0.96 0.00 0.00 137 V 8.32 4.86 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 0.90 0.00 0.00 0.97 0.00 0.00 138 L 8.68 4.37 0.00 1.66 1.54 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00