NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4753 8.3049 118.1951 54.6748 33.0927 175.3705 2 T 3.7929 7.8341 116.4884 64.1071 68.8582 173.0092 3 T 4.2004 8.8729 122.4454 62.6306 70.7162 173.6990 4 F 2.3000 7.1997 117.9429 56.8224 35.9738 175.6138 5 R 4.7307 7.1260 127.7461 54.1346 33.8969 174.8172 6 F 5.4403 8.6561 119.2577 55.3055 43.1696 175.2912 7 C 3.6587 8.8030 121.3186 57.4931 43.8415 175.0097 8 R 3.7480 7.6532 125.9152 59.5753 30.0892 177.4312 9 D 4.4674 7.8102 116.3445 57.1434 41.1816 176.5777 10 C 4.3389 7.9686 111.4831 55.6485 42.4283 173.4163 11 N 4.1649 7.8509 116.7842 54.4752 37.5476 173.0901 12 N 5.1214 7.7909 112.7082 50.9977 41.4537 174.1596 13 M 4.3795 8.6987 120.2163 56.0264 33.0083 175.2896 14 L 4.8875 7.8080 123.4970 53.5751 43.9005 175.6441 15 Y 5.0470 8.8520 118.8299 55.5280 41.7316 173.6992 16 P 4.2712 0.0000 0.0000 62.9519 32.4999 175.9996 17 R 4.5779 8.7141 120.0348 55.0084 35.1431 173.7164 18 E 4.3800 8.5841 124.4178 55.2494 30.9827 175.8644 19 D 4.5268 9.1585 127.4501 53.3822 40.1164 176.4715 20 K 3.9655 8.5171 126.2851 59.3610 32.4637 178.8210 21 E 4.0870 8.2553 117.0502 58.8168 29.4966 177.3407 22 N 4.7293 8.1545 112.1363 52.1224 39.8179 174.0950 23 N 4.1513 8.1376 114.6725 54.6140 36.3888 172.9402 24 R 4.7351 7.1425 115.8912 54.3225 36.1497 175.6330 25 L 4.7559 8.3077 122.2803 54.0459 43.5245 175.1155 26 L 5.1295 8.7329 126.5910 53.0332 44.9149 175.5063 27 F 5.5242 9.0887 121.2195 56.2741 40.6816 175.2187 28 E 4.8045 9.3838 122.4377 54.8388 32.8859 174.1022 29 C 5.1505 8.8674 120.0996 58.1140 33.1422 173.8701 30 R 4.4058 9.0113 121.6888 57.2687 30.5809 177.5462 31 T 4.2568 8.0660 113.9396 65.0261 69.4433 174.4059 32 C 4.7241 7.7764 116.9970 58.6579 30.4031 173.4683 33 S 4.7972 8.2848 114.7481 58.6357 63.2014 173.7708 34 Y 4.3869 8.0353 122.5069 58.1221 39.2582 175.1138 35 V 5.0553 8.0874 118.2989 58.8824 36.1367 174.1380 36 E 4.7794 8.3248 118.4146 55.5325 32.5644 174.2086 37 E 4.8246 8.7547 119.0708 55.5723 31.7497 174.8948 38 A 4.7406 8.3383 122.3585 50.5604 19.9269 177.8177 39 G 3.6902 9.1495 112.2444 48.0526 0.0000 173.2649 40 S 4.7882 7.7226 111.8439 55.5126 66.1374 171.4916 41 P 4.5266 0.0000 0.0000 62.4337 31.3136 175.3329 42 L 4.2530 7.4460 120.8578 54.8136 41.3945 176.2428 43 V 4.1978 8.0927 125.8112 63.5099 32.5456 175.0158 44 Y 4.7001 7.3796 116.3849 57.0863 41.2921 172.8620 45 R 4.4140 8.0200 125.4138 54.8547 33.3202 174.3564 46 H 4.4080 8.2695 123.3362 54.9786 30.9384 172.4357 47 E 4.3843 8.5626 127.4826 54.9998 29.5845 176.7782 48 L 4.0496 8.4781 125.1645 56.5243 42.0445 177.0325 49 I 4.3260 7.5892 118.9283 59.6678 37.6125 174.3455 50 T 4.6715 8.1929 118.8799 60.2571 70.2374 173.4137 51 N 4.8482 8.4947 122.5758 53.1517 39.8385 174.8632 52 I 4.0845 7.5223 120.9212 62.4707 37.5742 176.3330 53 G 4.0049 9.1656 113.3597 44.9217 0.0000 174.5806 54 E 3.7881 8.3313 120.2704 59.1739 29.8758 178.7217 55 T 4.3847 7.5676 111.4328 62.4937 69.6357 172.8425 56 A 3.7242 7.0757 124.5237 54.4513 18.2249 177.8326 57 G 3.7354 8.8035 110.0993 45.4369 0.0000 173.6791 58 V 3.8102 7.2657 119.8392 61.9622 31.2366 175.3122 59 V 4.4880 7.8648 126.4844 60.4349 34.5613 175.6981 60 Q 3.9620 8.9068 125.3370 59.6842 28.8586 177.6489 61 D 4.7953 7.9622 115.7703 54.5701 40.9418 178.2018 62 I 3.7119 7.9026 123.0950 63.5347 38.0401 177.6267 63 G 3.8748 7.9830 107.2508 46.4099 0.0000 174.0613 64 S 4.4285 7.7272 113.5267 58.1124 63.0296 173.4218 65 D 4.5901 7.7936 122.9999 52.8026 40.8226 175.0224 66 P 4.4698 0.0000 0.0000 64.3668 31.8944 177.0522 67 T 4.0826 8.4057 109.0049 62.5740 69.0281 174.2025 68 L 4.4984 7.1467 122.6708 52.4716 43.4301 174.6429 69 P 4.4537 0.0000 0.0000 62.7682 32.7723 175.1238 70 R 5.8655 8.7448 118.8997 53.6569 33.1947 174.8559 71 S 4.9865 8.8162 115.6869 56.3139 67.2160 173.3612 72 D 5.1954 8.4912 117.2605 53.2131 39.7648 176.9859 73 R 3.9863 7.4683 117.8178 57.0894 30.6107 175.2040 74 E 5.0193 8.2259 120.4166 54.2981 31.7775 175.3672 75 C 3.5363 8.3624 120.0189 56.5650 30.6264 172.9368 76 P 3.8750 0.0000 0.0000 65.1916 31.1376 177.0005 77 K 4.1360 7.1487 117.5241 58.2045 33.1142 175.1668 78 C 4.2921 7.8632 112.1864 56.1664 42.2189 173.6551 79 H 3.8259 7.8041 113.8532 56.0157 26.8700 174.2188 80 S 4.0483 7.3554 113.4726 58.5733 63.0699 175.0716 81 R 5.5321 8.2746 125.9499 55.5464 29.9035 177.1353 82 E 4.6579 8.2060 119.1748 54.7024 31.8857 176.0185 83 N 5.8013 8.6957 121.6328 51.1886 42.8397 173.9936 84 V 5.1067 9.0089 121.1829 60.0776 34.5735 174.5358 85 F 5.2860 8.7422 116.5749 55.3905 41.0120 173.5171 86 F 4.9921 8.1829 114.7566 55.9983 41.8925 173.4185 87 Q 4.9494 8.6833 118.8853 54.3002 30.5656 175.7706 88 S 4.1469 8.8714 114.5708 59.5623 62.4457 173.9206 89 Q 4.2592 8.3508 125.0336 56.1522 28.7693 175.9417 90 Q 4.1803 7.5306 117.4933 56.4914 29.1883 177.4959 91 R 4.5526 8.0739 117.0860 54.3075 31.1234 174.5964 92 R 4.7757 7.8716 119.4809 53.6440 33.4437 176.5738 93 K 4.1256 8.8107 120.5883 58.9259 32.1773 177.7394 94 D 4.8669 7.7803 114.4171 52.8992 40.1889 176.4778 95 T 3.9812 7.8082 116.9700 64.0872 68.9415 173.8851 96 S 4.6297 8.3929 119.2029 58.0819 64.5994 173.4657 97 M 4.6190 8.1904 117.6574 54.9129 32.1308 176.9904 98 V 3.7221 7.1190 118.1147 62.1633 32.2589 175.1872 99 L 4.5246 8.2129 121.8063 53.3988 43.7693 175.6168 100 F 4.6124 8.3997 121.4911 55.4933 42.2961 173.9989 101 F 5.1100 8.6967 122.5708 55.6077 41.8962 175.1685 102 V 4.5292 8.6235 121.8400 61.0146 34.0929 173.7832 103 C 5.0105 9.5538 130.2167 56.9967 44.2777 173.6490 104 L 4.4890 9.0614 125.5148 55.1413 41.5985 177.5464 105 S 4.5171 8.2247 115.2727 59.7825 63.6425 174.5284 106 C 4.7542 7.7375 110.8657 56.4594 30.7092 173.7641 107 S 3.8892 7.7129 112.5358 59.5815 62.0984 171.4027 108 H 4.8259 8.1862 119.3497 56.5344 31.4311 173.4048 109 I 5.0872 8.2336 125.4146 59.6745 38.7475 174.9671 110 F 5.1810 8.6777 121.1159 55.6917 41.5527 173.7751 111 T 5.2490 8.8849 116.7261 61.2412 70.3091 175.0858 112 S 4.2876 8.8072 117.6105 59.7586 63.7197 173.4071 113 D 4.3274 8.0572 120.1131 54.6175 40.0582 175.3212 114 Q 4.1026 8.6342 126.3953 58.3580 29.2903 178.0554 115 K 4.3693 7.8060 117.6727 55.5358 31.8581 177.1960 116 N 4.4319 7.9547 117.3859 53.9301 39.1475 173.8084 117 K 4.2186 8.5721 125.7267 58.0078 33.2403 177.8577 118 R 3.7141 8.0088 116.6415 57.1884 30.2757 176.4113 119 T 3.9412 8.5589 119.9198 66.1432 68.2271 174.6243 120 Q 4.3046 6.9880 116.3130 54.2918 31.3081 175.5783 121 F 4.3791 7.9234 122.0118 58.0447 38.4797 174.5283 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 4.48 0.00 2.15 2.25 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 2.52 0.00 2 T 7.83 3.79 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 3 T 8.87 4.20 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 1.27 0.00 0.00 4 F 7.20 2.30 0.00 3.31 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 R 7.13 4.73 0.00 1.20 1.58 0.00 2.99 0.00 0.00 3.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.27 0.00 6 F 8.66 5.44 0.00 2.77 2.82 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 7 C 8.80 3.66 0.00 3.01 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.65 3.75 0.00 1.72 1.65 0.00 3.32 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 9 D 7.81 4.47 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 10 C 7.97 4.34 0.00 3.09 3.22 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 11 N 7.85 4.16 0.00 2.79 2.87 0.00 0.00 7.10 7.80 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 12 N 7.79 5.12 0.00 2.79 2.80 0.00 0.00 6.65 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 13 M 8.70 4.38 0.00 1.57 1.92 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.07 0.00 14 L 7.81 4.89 0.00 1.29 1.63 1.00 0.73 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 15 Y 8.85 5.05 0.00 2.90 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 16 P 0.00 4.27 0.00 1.76 1.42 0.00 3.81 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 2.01 2.14 0.00 17 R 8.71 4.58 0.00 1.57 1.71 0.00 3.25 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.86 0.00 18 E 8.58 4.38 0.00 1.92 1.79 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 0.00 2.22 2.26 0.00 19 D 9.16 4.53 0.00 2.68 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 20 K 8.52 3.97 0.00 1.76 1.85 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 21 E 8.26 4.09 0.00 1.94 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 2.30 2.32 0.00 22 N 8.15 4.73 0.00 2.83 2.79 0.00 0.00 6.95 8.00 0.00 0.00 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 N 8.14 4.15 0.00 2.85 2.84 0.00 0.00 6.66 7.25 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 24 R 7.14 4.74 0.00 1.67 1.74 0.00 3.10 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 25 L 8.31 4.76 0.00 1.67 1.46 0.71 0.25 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 26 L 8.73 5.13 0.00 1.51 1.49 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 27 F 9.09 5.52 0.00 2.91 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 28 E 9.38 4.80 0.00 2.06 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 0.00 2.43 2.35 0.00 29 C 8.87 5.15 0.00 3.14 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 30 R 9.01 4.41 0.00 1.96 1.99 0.00 2.87 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.44 0.00 31 T 8.07 4.26 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 1.26 0.00 0.00 32 C 7.78 4.72 0.00 3.16 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 33 S 8.28 4.80 0.00 3.86 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 34 Y 8.04 4.39 0.00 2.81 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 35 V 8.09 5.06 2.02 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 0.92 0.00 0.00 0.83 0.00 0.00 36 E 8.32 4.78 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 37 E 8.75 4.82 0.00 2.00 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 2.25 2.34 0.00 38 A 8.34 4.74 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 39 G 9.15 3.69 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 0.00 0.00 0.00 40 S 7.72 4.79 0.00 3.95 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 41 P 0.00 4.53 0.00 2.20 2.18 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 42 L 7.45 4.25 0.00 1.68 1.67 1.01 0.90 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 43 V 8.09 4.20 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 0.90 0.00 0.00 0.94 0.00 0.00 44 Y 7.38 4.70 0.00 2.85 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.02 4.41 0.00 1.64 1.55 0.00 3.32 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 46 H 8.27 4.41 0.00 2.80 3.15 0.00 5.97 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.56 4.38 0.00 1.99 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 2.25 2.29 0.00 48 L 8.48 4.05 0.00 1.61 1.71 0.89 0.61 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 49 I 7.59 4.33 1.88 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 1.31 0.60 0.93 0.00 0.00 50 T 8.19 4.67 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 1.23 0.00 0.00 51 N 8.49 4.85 0.00 2.90 2.90 0.00 0.00 7.06 7.49 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 52 I 7.52 4.08 1.87 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 1.24 0.74 0.91 0.00 0.00 53 G 9.17 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 54 E 8.33 3.79 0.00 2.03 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 2.39 2.47 0.00 55 T 7.57 4.38 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 1.27 0.00 0.00 56 A 7.08 3.72 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 57 G 8.80 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 58 V 7.27 3.81 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 0.81 0.00 0.00 1.12 0.00 0.00 59 V 7.86 4.49 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 0.96 0.00 0.00 0.90 0.00 0.00 60 Q 8.91 3.96 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.45 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 61 D 7.96 4.80 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 7.90 3.71 1.86 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 1.26 1.31 0.96 0.00 0.00 63 G 7.98 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 64 S 7.73 4.43 0.00 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.79 4.59 0.00 2.60 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 66 P 0.00 4.47 0.00 2.20 2.14 0.00 3.79 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 67 T 8.41 4.08 4.19 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 1.17 0.00 0.00 68 L 7.15 4.50 0.00 1.76 1.56 0.89 0.90 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 69 P 0.00 4.45 0.00 1.48 1.87 0.00 3.38 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.37 0.00 70 R 8.74 5.87 0.00 1.76 2.02 0.00 3.23 0.00 0.00 3.99 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.44 0.00 71 S 8.82 4.99 0.00 3.89 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 72 D 8.49 5.20 0.00 2.82 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 73 R 7.47 3.99 0.00 1.68 1.74 0.00 2.24 0.00 0.00 2.85 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.40 0.00 74 E 8.23 5.02 0.00 1.85 1.72 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 2.11 2.34 0.00 75 C 8.36 3.54 0.00 2.74 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 3.87 0.00 1.91 2.10 0.00 2.77 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.91 0.00 77 K 7.15 4.14 0.00 1.62 1.71 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.21 7.81 78 C 7.86 4.29 0.00 3.12 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 79 H 7.80 3.83 0.00 3.29 3.40 0.00 5.74 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.36 4.05 0.00 3.94 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 81 R 8.27 5.53 0.00 1.72 2.13 0.00 3.25 0.00 0.00 4.01 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 82 E 8.21 4.66 0.00 2.02 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 2.24 2.42 0.00 83 N 8.70 5.80 0.00 2.70 2.88 0.00 0.00 6.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 9.01 5.11 2.18 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 0.86 0.00 0.00 0.98 0.00 0.00 85 F 8.74 5.29 0.00 2.06 2.57 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 86 F 8.18 4.99 0.00 3.15 3.08 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 87 Q 8.68 4.95 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.88 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 88 S 8.87 4.15 0.00 4.06 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 89 Q 8.35 4.26 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 90 Q 7.53 4.18 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 7.04 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 91 R 8.07 4.55 0.00 1.72 1.81 0.00 3.30 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.55 0.00 92 R 7.87 4.78 0.00 1.78 1.89 0.00 3.23 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 93 K 8.81 4.13 0.00 1.75 1.88 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.44 7.81 94 D 7.78 4.87 0.00 2.77 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.81 3.98 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 1.26 0.00 0.00 96 S 8.39 4.63 0.00 3.99 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 97 M 8.19 4.62 0.00 2.01 2.09 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 2.53 2.51 0.00 98 V 7.12 3.72 1.98 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 0.39 0.00 0.00 0.65 0.00 0.00 99 L 8.21 4.52 0.00 1.14 0.53 0.48 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.40 4.61 0.00 1.70 2.24 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 0.00 101 F 8.70 5.11 0.00 1.51 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 0.00 0.00 0.00 102 V 8.62 4.53 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 1.04 0.00 0.00 1.11 0.00 0.00 103 C 9.55 5.01 0.00 3.31 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.06 4.49 0.00 1.74 1.73 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.22 4.52 0.00 3.88 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 0.00 106 C 7.74 4.75 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 0.00 107 S 7.71 3.89 0.00 4.25 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 0.00 108 H 8.19 4.83 0.00 3.37 3.32 0.00 5.83 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.23 5.09 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.61 0.60 0.00 0.00 110 F 8.68 5.18 0.00 3.08 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 0.00 111 T 8.88 5.25 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 0.89 0.00 0.00 112 S 8.81 4.29 0.00 3.90 4.19 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 0.00 113 D 8.06 4.33 0.00 2.54 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 0.00 114 Q 8.63 4.10 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 7.32 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 115 K 7.81 4.37 0.00 1.74 1.80 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.41 7.81 116 N 7.95 4.43 0.00 2.84 2.78 0.00 0.00 7.23 6.68 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 0.00 117 K 8.57 4.22 0.00 1.77 1.84 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.50 7.81 118 R 8.01 3.71 0.00 1.61 1.44 0.00 3.73 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 119 T 8.56 3.94 4.19 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 1.19 0.00 0.00 120 Q 6.99 4.30 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 5.87 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 121 F 7.92 4.38 0.00 3.16 3.27 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