NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5542 8.2185 120.1948 53.7626 41.3473 175.5351 3 A 3.9944 8.6368 129.7796 54.0995 18.5533 177.0837 4 K 4.0834 8.6220 119.9871 59.7228 32.4719 177.4108 5 A 4.1341 8.3301 120.7590 55.0214 18.2864 179.5349 6 G 3.7009 8.5318 104.5469 47.6556 0.0000 175.5502 7 E 3.4307 7.7828 120.0983 59.4401 29.4187 178.9258 8 A 4.0886 7.6827 120.3249 55.0781 18.4931 179.8918 9 V 3.5457 7.6937 116.4080 66.0462 31.7472 177.8544 10 F 3.9420 8.4169 120.6534 60.8360 38.7649 177.0708 11 K 3.7966 7.4043 117.2950 59.4978 32.0703 178.8150 12 Q 3.9519 7.8214 118.0028 59.1239 28.6441 178.5464 13 C 3.6731 7.4322 117.0915 62.7047 27.8600 175.7219 14 M 4.5379 7.0154 120.3651 57.2508 31.4261 178.2406 15 T 3.9073 7.4265 115.9164 66.2023 68.9066 174.5615 16 C 4.6075 7.7606 115.4830 59.3868 30.8037 173.0753 17 H 5.0132 8.0704 117.0297 53.7645 31.1992 173.1725 18 R 5.0062 8.1737 120.9057 54.0100 33.4945 177.0969 19 A 4.0255 8.6883 121.2547 55.2341 18.4456 179.0785 20 D 4.8608 8.0393 111.5912 53.9643 42.6444 176.3698 21 K 4.7389 7.6504 117.1106 54.1400 35.5933 175.6299 22 N 4.7776 8.5078 118.2965 53.8779 40.2033 175.1305 23 M 4.3935 8.2388 123.1504 54.5177 35.4549 176.5916 24 V 3.7054 8.8677 114.3900 64.8843 31.7671 175.8508 25 G 3.8065 7.8294 107.3865 42.0888 0.0000 170.6183 26 P 4.2163 0.0000 0.0000 61.6368 31.7931 176.2334 27 A 4.2847 8.4768 123.0910 52.7716 18.8305 177.8775 28 L 4.4211 8.6478 120.5891 54.4249 42.9436 176.8505 29 A 4.2135 7.8502 123.0563 53.4711 18.5735 177.9476 30 G 3.9586 9.3008 110.9601 45.6382 0.0000 175.0037 31 V 3.6228 7.8716 121.3155 64.2953 31.3864 176.1549 32 V 3.9148 7.5565 120.2681 65.9748 30.7487 175.2296 33 G 4.0726 9.2918 116.6337 44.9068 0.0000 171.8453 34 R 4.6274 8.1507 120.5454 53.8896 32.3246 175.4417 35 K 4.3265 8.6145 127.1169 56.1622 32.8690 176.2367 36 A 3.8874 8.4882 129.6842 52.9015 19.6041 177.5623 37 G 2.5209 8.4952 107.0540 46.1999 0.0000 174.3149 38 T 4.5957 7.6551 105.2275 60.4244 70.1001 173.3811 39 A 4.1640 8.9192 126.5642 52.0775 18.8759 177.7625 40 A 4.2637 8.6130 126.2511 53.7672 18.8248 178.1276 41 G 3.9921 9.0541 110.5564 45.2647 0.0000 172.9715 42 F 4.3645 7.8990 121.7995 56.8137 40.4762 175.0897 43 T 4.1475 6.9305 124.4485 62.5844 68.4740 174.1845 44 Y 4.7112 8.3721 124.4779 56.2697 40.0367 176.1922 45 S 4.5158 8.5599 116.1717 57.7359 65.2436 173.3989 46 P 4.3262 0.0000 0.0000 65.7231 31.2112 178.7256 47 L 4.0468 7.9944 118.7143 58.0874 42.1239 178.4882 48 N 4.4086 8.3362 116.7460 56.8863 39.0664 176.1129 49 H 4.0726 8.6190 120.0850 59.7563 29.9063 176.9271 50 N 4.4189 8.9122 118.0202 56.0452 38.2505 177.7806 51 S 4.3935 8.0988 116.7503 61.6326 62.9613 176.8531 52 G 3.6487 7.7964 109.7350 47.1665 0.0000 175.2462 53 E 3.9638 7.9044 120.5444 58.8422 29.7258 178.0793 54 A 4.2881 7.9462 118.0863 52.2933 18.6886 177.7359 55 G 3.9664 8.3185 105.2346 44.5992 0.0000 174.1137 56 L 3.5187 8.1113 123.5553 55.3136 42.7707 175.7241 57 V 4.5038 7.8356 126.1171 60.4932 33.8193 175.0908 58 W 4.7660 8.5947 128.4675 57.1122 30.2683 175.4070 59 T 5.0618 9.7558 113.5697 58.9468 71.8865 174.7740 60 A 4.0696 8.8269 123.1272 55.1567 17.2650 179.2460 61 D 4.5270 8.0824 117.3696 57.0395 41.3415 177.9899 62 N 4.6656 8.4979 116.4851 54.6804 37.8118 177.3228 63 I 3.6984 7.8735 122.8389 63.9989 36.8281 178.0300 64 V 3.5943 7.0761 119.2004 65.6886 31.2454 176.0771 65 P 4.4250 0.0000 0.0000 65.7677 31.3240 177.5054 66 Y 3.8534 7.4246 118.9271 60.6604 38.5381 178.3926 67 L 3.7293 8.0157 119.2549 57.4306 41.3811 179.3928 68 A 4.2181 7.4042 121.0920 53.7541 19.3057 177.0484 69 D 4.3700 7.7947 112.9329 51.7289 43.4264 173.7912 70 P 4.0257 0.0000 0.0000 65.2839 31.4167 177.6386 71 N 4.4291 8.1907 114.2230 56.4100 38.6206 177.1308 72 A 4.0434 8.3412 122.1811 55.0621 18.3591 179.5525 73 F 4.0072 8.4691 119.0719 61.6142 39.6839 177.5334 74 L 4.1577 8.3790 118.6379 57.6205 41.3470 179.7280 75 K 4.0174 8.5215 118.9014 59.3632 31.9598 179.2717 76 K 3.8661 7.9824 119.8464 59.2770 32.0247 178.3523 77 F 3.9267 8.2797 121.2944 61.5522 39.3092 177.2583 78 L 3.8247 8.1040 118.3103 57.7206 41.3118 179.7272 79 T 3.7852 8.0319 115.9332 66.8009 68.2341 176.3286 80 E 3.8733 7.9603 119.0879 59.3374 29.5394 178.8963 81 K 4.1296 7.2044 115.1174 56.1459 32.1956 177.4407 82 G 3.8908 8.0070 107.4993 46.1802 0.0000 173.9618 83 K 4.6021 7.9533 117.4721 55.1591 33.5584 178.7357 84 A 4.0164 8.4294 124.0839 55.3976 18.4720 180.5166 85 D 4.3967 8.0421 113.7227 56.3983 39.4354 177.3011 86 Q 4.1708 8.0060 116.4842 56.8333 29.0911 176.0924 87 A 4.7604 7.9462 121.1263 51.9290 19.2858 179.2065 88 V 3.6533 7.9005 113.9197 64.9358 32.1807 176.9418 89 G 4.1126 7.1123 106.8845 44.6410 0.0000 172.8034 90 V 4.7159 8.0125 112.1406 59.6210 35.5256 175.0045 91 T 4.4874 9.0217 116.3985 61.2841 67.9941 175.2643 92 K 4.0805 8.6300 124.4742 58.8950 32.3408 177.1343 93 M 4.2917 7.9992 119.0644 55.2609 31.2922 175.6139 94 T 4.3641 8.4418 115.9240 61.5541 69.7505 174.5707 95 F 4.7214 7.8628 124.1755 57.3403 40.7676 174.5804 96 K 4.3820 7.0035 123.0103 54.4475 35.6309 175.9489 97 L 4.2172 8.3279 122.6996 52.9452 43.5415 177.1710 98 A 3.8782 8.4908 130.1464 54.8823 18.8704 177.8931 99 N 4.4172 7.9550 115.1200 53.3546 39.9667 175.1141 100 E 3.9255 8.8033 128.7066 59.4938 29.8193 178.4640 101 Q 3.9848 8.1069 119.1379 59.2537 29.2063 178.0184 102 Q 4.0142 8.9794 119.6152 58.8958 28.7146 178.9835 103 R 3.9693 8.0581 119.1956 59.2124 30.0471 179.2599 104 K 4.0325 8.2306 118.3310 59.4943 31.9972 179.2091 105 D 4.3867 8.4829 119.7850 57.4063 40.7033 179.2794 106 V 3.7616 8.0026 119.6941 64.7180 31.4547 178.6568 107 V 3.5808 8.0941 118.8327 65.6711 31.1288 177.8303 108 A 3.9931 8.1304 120.0640 55.1285 18.4518 178.5615 109 Y 3.9803 8.2063 118.0669 60.9704 38.8398 178.4260 110 L 3.7947 8.3369 119.8591 57.7838 41.5043 179.3913 111 A 3.9583 7.9040 119.7138 54.6216 18.3305 178.8046 112 T 4.2538 7.3546 106.3654 61.6713 70.4256 175.7809 113 L 4.0709 7.3330 123.4616 53.6900 40.2666 177.1334 114 K 4.1091 8.0346 121.2459 56.4076 32.0539 177.2523 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 2 D 8.22 4.55 0.00 2.78 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 3 A 8.64 3.99 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 4 K 8.62 4.08 0.00 1.95 1.99 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.52 7.81 5 A 8.33 4.13 1.48 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 0.00 0.00 0.00 6 G 8.53 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.78 3.43 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 8 A 7.68 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 9 V 7.69 3.55 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 1.08 0.00 0.00 0.95 0.00 0.00 10 F 8.42 3.94 0.00 2.74 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 11 K 7.40 3.80 0.00 1.85 1.79 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.62 7.81 12 Q 7.82 3.95 0.00 2.10 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 13 C 7.43 3.67 0.00 1.91 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 14 M 7.02 4.54 0.00 1.86 2.08 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 2.32 2.31 0.00 15 T 7.43 3.91 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 1.13 0.00 0.00 16 C 7.76 4.61 0.00 2.65 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 H 8.07 5.01 0.00 3.09 3.08 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.17 5.01 0.00 1.98 1.85 0.00 3.13 0.00 0.00 3.51 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 19 A 8.69 4.03 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 20 D 8.04 4.86 0.00 2.67 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.65 4.74 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.43 7.81 22 N 8.51 4.78 0.00 2.81 2.96 0.00 0.00 6.67 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 23 M 8.24 4.39 0.00 2.06 1.54 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 24 V 8.87 3.71 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 0.82 0.00 0.00 0.91 0.00 0.00 25 G 7.83 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 26 P 0.00 4.22 0.00 2.03 1.19 0.00 3.24 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 27 A 8.48 4.28 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 28 L 8.65 4.42 0.00 1.78 1.69 0.80 0.24 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 29 A 7.85 4.21 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 9.30 3.96 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 0.00 31 V 7.87 3.62 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 0.68 0.00 0.00 0.77 0.00 0.00 32 V 7.56 3.91 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 0.81 0.00 0.00 0.93 0.00 0.00 33 G 9.29 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 0.00 0.00 0.00 34 R 8.15 4.63 0.00 2.17 2.01 0.00 3.17 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 35 K 8.61 4.33 0.00 1.74 1.64 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.33 7.81 36 A 8.49 3.89 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 37 G 8.50 2.52 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 0.00 38 T 7.66 4.60 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 1.21 0.00 0.00 39 A 8.92 4.16 1.45 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 0.00 0.00 40 A 8.61 4.26 1.31 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 0.00 0.00 0.00 41 G 9.05 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.90 4.36 0.00 3.16 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 43 T 6.93 4.15 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 1.10 0.00 0.00 44 Y 8.37 4.71 0.00 3.11 3.11 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 45 S 8.56 4.52 0.00 4.16 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 0.00 46 P 0.00 4.33 0.00 2.24 2.20 0.00 3.68 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 2.16 2.19 0.00 47 L 7.99 4.05 0.00 1.85 1.80 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.34 4.41 0.00 3.11 3.08 0.00 0.00 6.84 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.62 4.07 0.00 3.36 3.49 0.00 5.84 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 50 N 8.91 4.42 0.00 2.81 3.04 0.00 0.00 7.11 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 51 S 8.10 4.39 0.00 3.97 3.65 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 52 G 7.80 3.65 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 0.00 0.00 0.00 53 E 7.90 3.96 0.00 2.05 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 2.29 2.25 0.00 54 A 7.95 4.29 1.46 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 55 G 8.32 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 0.00 0.00 0.00 56 L 8.11 3.52 0.00 0.27 0.89 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.84 4.50 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 0.87 0.00 0.00 0.91 0.00 0.00 58 W 8.59 4.77 0.00 3.49 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 59 T 9.76 5.06 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 1.27 0.00 0.00 60 A 8.83 4.07 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 61 D 8.08 4.53 0.00 2.76 2.78 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 62 N 8.50 4.67 0.00 3.33 3.27 0.00 0.00 7.03 7.16 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 63 I 7.87 3.70 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.88 0.77 0.00 0.00 64 V 7.08 3.59 2.25 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 0.87 0.00 0.00 0.95 0.00 0.00 65 P 0.00 4.43 0.00 2.62 2.44 0.00 3.92 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 2.40 2.21 0.00 66 Y 7.42 3.85 0.00 1.92 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 67 L 8.02 3.73 0.00 1.83 1.67 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.40 4.22 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.79 4.37 0.00 2.65 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 70 P 0.00 4.03 0.00 2.16 1.86 0.00 3.54 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.60 0.00 71 N 8.19 4.43 0.00 2.78 2.93 0.00 0.00 6.96 7.69 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 72 A 8.34 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 8.47 4.01 0.00 3.42 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 74 L 8.38 4.16 0.00 1.98 1.89 1.27 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.52 4.02 0.00 1.89 1.89 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.66 7.81 76 K 7.98 3.87 0.00 1.92 1.85 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.42 7.81 77 F 8.28 3.93 0.00 2.73 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 78 L 8.10 3.82 0.00 1.77 1.88 1.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.03 3.79 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 80 E 7.96 3.87 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 81 K 7.20 4.13 0.00 1.55 1.61 0.00 1.51 0.00 0.00 1.39 0.00 0.00 2.66 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.69 0.87 7.81 82 G 8.01 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.95 4.60 0.00 1.83 1.72 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.41 7.81 84 A 8.43 4.02 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 85 D 8.04 4.40 0.00 2.80 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 86 Q 8.01 4.17 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.26 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 87 A 7.95 4.76 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 88 V 7.90 3.65 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 0.73 0.00 0.00 1.01 0.00 0.00 89 G 7.11 4.11 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 0.00 90 V 8.01 4.72 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 91 T 9.02 4.49 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 92 K 8.63 4.08 0.00 1.95 1.97 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.53 7.81 93 M 8.00 4.29 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 94 T 8.44 4.36 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 1.25 0.00 0.00 95 F 7.86 4.72 0.00 2.91 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 96 K 7.00 4.38 0.00 1.42 1.39 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.29 7.81 97 L 8.33 4.22 0.00 1.59 1.43 0.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.49 3.88 1.22 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 0.00 0.00 99 N 7.96 4.42 0.00 2.75 2.70 0.00 0.00 6.83 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 0.00 100 E 8.80 3.93 0.00 2.08 1.93 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 2.39 2.38 0.00 101 Q 8.11 3.98 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.70 0.00 102 Q 8.98 4.01 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 103 R 8.06 3.97 0.00 2.04 1.98 0.00 3.38 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 1.64 1.89 0.00 104 K 8.23 4.03 0.00 1.96 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.64 7.81 105 D 8.48 4.39 0.00 2.83 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 0.00 106 V 8.00 3.76 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 1.05 0.00 0.00 1.11 0.00 0.00 107 V 8.09 3.58 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 1.00 0.00 0.00 108 A 8.13 3.99 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 0.00 109 Y 8.21 3.98 0.00 3.24 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.34 3.79 0.00 1.86 1.65 0.88 0.85 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 0.00 111 A 7.90 3.96 1.31 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 0.00 0.00 0.00 112 T 7.35 4.25 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 1.05 0.00 0.00 113 L 7.33 4.07 0.00 1.76 1.53 0.83 0.60 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 0.00 114 K 8.03 4.11 0.00 1.66 1.67 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.40 1.44 7.81