NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 E 4.3092 8.4293 120.2257 56.3493 31.1013 176.0229 9 T 4.0688 8.0869 113.5044 60.4758 71.1347 174.2964 10 L 3.9458 9.1445 122.8526 58.1772 42.0995 180.6996 11 E 3.9976 8.3297 117.5790 59.6188 29.0271 179.2248 12 A 4.0297 7.7853 120.6258 55.1343 18.3277 179.9855 13 R 3.9179 8.0965 116.5094 59.5334 30.2650 179.0279 14 I 3.3333 8.2313 118.7481 64.1914 37.3666 177.6101 15 N 4.2722 8.2051 117.2992 56.1827 38.0794 177.3797 16 R 3.9230 7.4731 117.9806 59.1867 30.3114 178.1051 17 A 4.0477 8.2149 120.3458 54.1045 18.5630 178.1487 18 T 4.0086 7.5325 105.6542 60.9144 69.4718 173.1866 19 N 4.0771 7.5455 120.8346 53.8249 38.9847 173.9240 20 P 4.4967 0.0000 0.0000 65.4533 31.7688 177.8234 21 L 4.1795 8.4350 117.9921 57.3377 41.6980 177.5419 22 N 4.2259 7.9164 114.4046 53.8318 38.7371 175.2012 23 K 4.1210 8.8153 122.9977 58.6544 32.5754 176.4238 24 E 4.8377 7.7822 114.1244 54.1208 32.6220 174.5383 25 L 3.8737 8.6259 119.1435 55.6985 42.5520 178.8088 26 D 4.6864 8.0513 123.8551 52.2934 37.8146 176.5365 27 W 4.2905 7.9103 123.3180 59.7574 29.0635 177.7448 28 A 4.0783 8.1751 119.9806 55.5991 17.6814 179.7217 29 S 4.2534 8.2325 111.9395 61.3235 63.2182 176.7750 30 I 3.7532 8.2032 123.1278 64.5758 36.9242 178.2207 31 N 4.6108 8.7917 117.5608 56.3282 37.8561 177.8143 32 G 3.6634 7.9363 106.2182 47.3288 0.0000 175.7672 33 F 4.0530 8.1432 123.0003 61.4391 39.8342 176.5933 34 C 3.9850 8.2914 115.6706 60.1113 39.8586 175.7425 35 E 3.4538 8.0755 119.2190 58.6410 29.4246 177.8711 36 Q 4.1363 7.3969 118.7452 57.8745 29.3725 177.1789 37 L 3.6912 7.4537 120.4308 58.1213 40.0575 177.9403 38 N 4.4095 7.0832 115.0892 54.8713 37.4395 175.7838 39 E 3.5821 7.1619 115.5529 60.0903 30.1253 177.5593 40 D 4.6440 7.7373 120.3106 54.7278 41.7982 176.9906 41 F 4.4655 8.9239 115.3696 58.4780 38.5735 176.3637 42 E 4.2011 6.9170 117.4955 55.6600 29.9731 177.7962 43 G 3.4955 7.7678 108.6261 47.6143 0.0000 174.1563 44 P 4.2311 0.0000 0.0000 65.1110 31.2080 176.7762 45 P 4.4453 0.0000 0.0000 64.8714 31.1326 178.3899 46 L 4.0768 7.6020 117.5121 57.7950 42.0126 178.7964 47 A 4.2464 8.4434 121.6295 55.3699 18.2787 179.7405 48 T 3.7340 8.1489 108.3606 64.6901 68.7812 177.2267 49 R 3.9948 7.7380 119.6118 59.2587 30.2011 178.7923 50 L 4.0700 8.1478 118.7927 57.9203 41.6361 179.7670 51 L 3.9820 8.2044 118.5972 57.7943 41.4942 179.3591 52 A 4.2052 8.5559 120.9014 55.3660 17.9233 179.2723 53 H 4.1585 8.2911 116.5700 59.4915 29.9046 177.7503 54 K 3.9423 8.1001 120.3020 59.4918 31.5878 179.4561 55 I 3.7929 8.2092 119.6814 63.7399 37.0454 177.3877 56 Q 4.3772 7.3656 116.7741 54.6511 29.0312 175.8374 57 S 4.1378 6.8237 113.1637 57.6334 62.8293 172.6700 58 P 4.2408 0.0000 0.0000 65.2688 31.4862 176.3329 59 Q 4.2587 7.9850 117.8594 54.7450 28.2894 175.8468 60 E 3.8860 9.0270 124.2874 59.5215 29.6455 178.4321 61 W 4.8717 8.4364 127.3759 60.6197 30.5422 177.4470 62 E 3.8535 8.5002 120.4515 58.4078 29.0664 178.6039 63 A 4.2595 7.6798 121.6676 54.5366 18.4817 179.4523 64 I 3.6113 8.1381 118.7065 64.6575 37.1571 178.5752 65 Q 3.5555 7.3213 117.9685 58.8874 28.5171 178.8520 66 A 3.8011 7.6985 121.5247 55.1055 18.1834 179.8013 67 L 4.0091 7.9719 117.5871 58.3380 41.6723 179.6258 68 T 3.6519 8.1054 115.9871 66.7853 68.3652 176.7801 69 V 3.4889 7.9606 120.4034 65.4586 31.4275 177.9634 70 L 4.2208 7.8529 120.2841 57.9076 41.9325 178.1680 71 E 4.1922 9.2008 120.1901 59.8989 29.6215 178.8071 72 T 4.0722 8.3512 115.7636 67.2119 68.6609 176.0552 73 C 4.3548 8.3443 118.0467 60.1254 39.8579 176.0919 74 M 4.2910 8.1902 119.8911 58.2820 31.5904 178.7067 75 K 4.2577 7.8341 117.9685 59.5862 32.4109 179.4735 76 S 4.2894 7.8925 113.9873 61.1816 63.1349 174.9678 77 C 4.4322 7.7751 117.2674 59.6112 29.4237 172.8539 78 G 4.2966 7.8673 108.9659 44.2580 0.0000 173.7202 79 K 3.8647 8.7750 118.6869 60.6835 31.8855 178.3740 80 R 3.8520 8.2422 117.2149 59.5003 29.6636 178.2174 81 F 4.2887 8.0385 119.3583 62.0367 39.9412 177.0638 82 H 3.8069 7.8980 115.7085 59.2724 28.3057 177.1801 83 D 4.3235 7.7200 118.7837 57.3388 40.9052 178.4366 84 E 3.9481 7.4607 117.6224 59.4275 29.2545 179.6846 85 V 3.4270 7.1359 117.0642 65.0640 31.3793 177.2116 86 G 3.7998 7.2773 103.9077 43.8143 0.0000 173.1684 87 K 4.4270 7.0034 119.7816 54.0056 34.6698 177.7097 88 F 4.7818 8.1239 119.9261 60.3861 38.5575 177.8366 89 R 4.1106 8.1907 117.6665 58.7766 29.5764 177.0389 90 F 4.7374 7.9735 118.8174 59.3269 40.4715 177.4524 91 L 4.0046 8.4482 119.2554 57.7883 41.3675 178.9784 92 N 4.2354 8.6741 116.8400 56.4649 38.3491 177.2726 93 E 3.8642 7.7574 119.1454 59.0745 29.3324 179.3515 94 L 4.0212 7.3401 118.7196 57.4952 41.8733 179.1745 95 I 3.7150 7.9448 120.0762 64.4156 37.1951 178.5520 96 K 3.7616 8.1799 119.6163 59.4351 31.6389 179.5704 97 V 3.6609 7.4153 117.1626 65.3510 31.3021 177.5718 98 V 4.2330 7.4473 108.7806 60.2268 32.3393 175.4670 99 S 4.7828 7.6695 115.2015 55.6115 63.8947 172.7079 100 P 4.1952 0.0000 0.0000 65.8417 31.1097 177.7147 101 K 3.9160 7.8050 114.5800 58.2495 33.2775 175.6433 102 Y 4.9566 7.4621 116.3164 58.2142 38.2786 177.5557 103 L 4.3079 8.3424 133.7738 56.2739 42.2211 178.3584 104 G 4.1275 8.2452 108.4482 49.5353 0.0000 175.8695 105 S 4.1480 8.0913 115.8324 60.1254 62.9444 175.5160 106 R 4.5396 8.0733 117.1785 55.9638 30.7345 175.6602 107 T 4.6050 7.6485 115.5241 61.5199 70.4590 175.3747 108 S 4.2711 8.3587 120.2639 58.2345 64.8795 174.8888 109 E 3.8816 8.9260 125.2327 59.4493 29.2314 179.1082 110 K 3.8818 8.0010 118.9007 59.5241 32.3809 178.6421 111 V 3.5881 7.5784 117.8381 65.9875 31.4877 178.0408 112 K 3.9533 8.1717 118.1031 59.7150 31.9402 179.1169 113 N 4.3610 8.5542 117.0836 56.0753 38.3979 177.3142 114 K 3.9013 8.2496 121.1275 59.6506 32.1958 178.8919 115 I 3.6582 7.8069 119.9821 64.4177 36.8025 178.4852 116 L 4.0701 8.0587 119.6467 57.4874 41.2691 179.5514 117 E 3.9891 8.0606 118.9358 59.2381 29.4943 179.1201 118 L 3.3851 7.5577 118.9389 57.4881 41.6371 179.3874 119 L 3.5987 7.4338 118.9338 57.8322 41.4204 179.0847 120 Y 3.1763 7.2692 119.1370 60.5275 38.7177 177.9621 121 S 3.8930 8.0614 115.4858 61.3795 62.6259 176.7023 122 W 4.3413 7.7867 122.5261 59.7497 28.7369 178.5834 123 T 3.8845 7.5386 108.0303 63.8793 67.9944 175.6874 124 V 3.9641 6.9793 120.2259 64.7990 32.3438 177.5015 125 G 3.8168 8.1585 103.9753 45.8106 0.0000 173.6200 126 L 5.3454 8.6511 120.3290 51.6980 42.1708 176.1427 127 P 4.3390 0.0000 0.0000 65.4236 32.0407 177.9014 128 E 4.0385 8.2094 118.5670 59.1562 29.9690 176.2801 129 E 4.2433 7.9671 120.1051 54.3870 28.2685 176.8755 130 V 3.6467 8.0418 116.5977 64.5144 31.9594 177.5877 131 K 3.8816 8.0105 117.2673 59.6486 31.7727 179.0640 132 I 3.8139 7.6582 119.1460 64.4047 37.0399 178.3467 133 A 4.1336 8.0186 120.9980 55.0865 18.2369 178.8876 134 E 3.9434 8.7556 118.0819 59.5548 29.7123 178.8937 135 A 4.0806 8.4146 120.5871 55.3993 18.5337 178.8739 136 Y 4.1471 8.3137 117.9750 61.0481 38.8323 178.0508 137 Q 3.9187 8.9368 120.7804 59.3774 29.1323 178.0494 138 M 3.9837 8.3759 119.3574 58.7345 32.3548 178.0722 139 L 3.9646 8.0175 119.1457 57.7588 41.7316 179.5903 140 K 3.9621 7.8136 119.5278 59.2497 31.9202 178.9089 141 K 3.9904 8.0874 119.2056 58.8890 32.5441 177.7815 142 Q 4.3490 8.2083 116.6708 55.3484 28.8137 177.3434 143 G 4.0678 7.9781 108.9614 45.3917 0.0000 174.9486 144 I 3.6637 7.0208 118.7669 63.3725 37.2640 176.1594 145 V 4.2510 7.3066 119.3569 60.9313 32.5984 175.1907 146 K 4.1945 8.6836 127.2898 58.5919 32.6223 176.8400 147 S 4.5352 7.2862 109.7106 56.8943 65.5182 173.2887 148 D 4.1149 8.2991 121.4647 53.1097 40.9831 175.1026 149 P 4.3199 0.0000 0.0000 62.8757 31.2527 176.1631 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 8 E 8.43 4.31 0.00 1.98 1.96 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 2.22 2.31 0.00 9 T 8.09 4.07 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 10 L 9.14 3.95 0.00 1.71 1.82 0.61 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.33 4.00 0.00 2.07 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 2.42 2.48 0.00 12 A 7.79 4.03 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 13 R 8.10 3.92 0.00 2.30 2.16 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 14 I 8.23 3.33 1.60 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.97 0.00 0.00 15 N 8.21 4.27 0.00 2.77 2.83 0.00 0.00 6.67 7.63 0.00 0.00 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 R 7.47 3.92 0.00 1.84 2.07 0.00 3.27 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 17 A 8.21 4.05 1.14 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 0.00 0.00 18 T 7.53 4.01 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 0.96 0.00 0.00 19 N 7.55 4.08 0.00 2.99 2.94 0.00 0.00 7.21 7.59 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 20 P 0.00 4.50 0.00 2.14 2.21 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 21 L 8.43 4.18 0.00 1.87 1.78 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.92 4.23 0.00 3.11 3.21 0.00 0.00 7.09 7.54 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 23 K 8.82 4.12 0.00 1.77 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.37 7.81 24 E 7.78 4.84 0.00 2.10 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 2.27 2.37 0.00 25 L 8.63 3.87 0.00 1.61 1.03 0.90 0.93 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 26 D 8.05 4.69 0.00 2.70 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.91 4.29 0.00 3.51 3.33 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 28 A 8.18 4.08 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 29 S 8.23 4.25 0.00 3.95 3.92 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 30 I 8.20 3.75 1.68 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.38 0.77 0.00 0.00 31 N 8.79 4.61 0.00 2.98 2.97 0.00 0.00 7.03 8.42 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 32 G 7.94 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.14 4.05 0.00 3.04 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 34 C 8.29 3.99 0.00 2.99 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 35 E 8.08 3.45 0.00 2.22 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 0.00 2.29 2.45 0.00 36 Q 7.40 4.14 0.00 2.24 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.50 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 37 L 7.45 3.69 0.00 1.33 1.02 0.66 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.08 4.41 0.00 2.81 2.87 0.00 0.00 6.92 7.54 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 39 E 7.16 3.58 0.00 2.08 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 2.30 2.58 0.00 40 D 7.74 4.64 0.00 2.58 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 41 F 8.92 4.47 0.00 3.16 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 42 E 6.92 4.20 0.00 1.68 1.12 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 1.94 1.88 0.00 43 G 7.77 3.50 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 0.00 0.00 0.00 44 P 0.00 4.23 0.00 2.13 2.15 0.00 3.51 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.24 0.00 45 P 0.00 4.45 0.00 2.07 2.06 0.00 3.85 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 46 L 7.60 4.08 0.00 1.74 1.83 0.93 0.86 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 47 A 8.44 4.25 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 48 T 8.15 3.73 3.60 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 0.00 0.00 0.00 0.83 0.00 0.00 49 R 7.74 3.99 0.00 2.17 2.06 0.00 3.15 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 50 L 8.15 4.07 0.00 1.84 1.78 1.04 0.53 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 51 L 8.20 3.98 0.00 2.13 1.93 1.19 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.56 4.21 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 53 H 8.29 4.16 0.00 3.26 3.50 0.00 5.60 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 54 K 8.10 3.94 0.00 2.02 1.76 0.00 1.59 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.42 7.81 55 I 8.21 3.79 1.92 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 1.56 0.66 0.91 0.00 0.00 56 Q 7.37 4.38 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 57 S 6.82 4.14 0.00 3.80 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 0.00 58 P 0.00 4.24 0.00 2.08 2.11 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 59 Q 7.99 4.26 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 60 E 9.03 3.89 0.00 2.08 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 0.00 2.47 2.44 0.00 61 W 8.44 4.87 0.00 3.38 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 62 E 8.50 3.85 0.00 2.02 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 0.00 2.18 2.23 0.00 63 A 7.68 4.26 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 64 I 8.14 3.61 2.03 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.81 1.01 0.00 0.00 65 Q 7.32 3.56 0.00 1.52 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 1.48 1.16 0.00 66 A 7.70 3.80 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 67 L 7.97 4.01 0.00 1.87 1.76 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.11 3.65 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 1.05 0.00 0.00 69 V 7.96 3.49 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 0.67 0.00 0.00 0.69 0.00 0.00 70 L 7.85 4.22 0.00 2.07 2.05 1.16 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 71 E 9.20 4.19 0.00 2.16 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 2.47 2.51 0.00 72 T 8.35 4.07 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 1.48 0.00 0.00 73 C 8.34 4.35 0.00 2.92 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.19 4.29 0.00 2.13 2.61 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.98 0.00 75 K 7.83 4.26 0.00 1.93 1.95 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.85 7.81 76 S 7.89 4.29 0.00 3.87 3.92 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 77 C 7.78 4.43 0.00 3.03 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 78 G 7.87 4.30 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 0.00 79 K 8.78 3.86 0.00 1.86 1.85 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.51 1.61 7.81 80 R 8.24 3.85 0.00 1.83 1.84 0.00 3.33 0.00 0.00 3.25 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 81 F 8.04 4.29 0.00 2.84 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 82 H 7.90 3.81 0.00 3.23 3.36 0.00 5.69 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 83 D 7.72 4.32 0.00 2.84 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 84 E 7.46 3.95 0.00 1.91 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 2.25 2.49 0.00 85 V 7.14 3.43 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 0.20 0.00 0.00 -0.51 0.00 0.00 86 G 7.28 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 87 K 7.00 4.43 0.00 1.88 1.65 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.49 7.81 88 F 8.12 4.78 0.00 3.10 3.14 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 89 R 8.19 4.11 0.00 1.85 2.03 0.00 3.23 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 90 F 7.97 4.74 0.00 3.07 3.06 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 0.00 0.00 0.00 91 L 8.45 4.00 0.00 1.96 1.90 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.67 4.24 0.00 2.72 2.76 0.00 0.00 7.04 7.68 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 93 E 7.76 3.86 0.00 1.80 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 2.45 2.49 0.00 94 L 7.34 4.02 0.00 1.78 1.68 1.15 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.94 3.72 1.93 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 1.56 0.86 0.94 0.00 0.00 96 K 8.18 3.76 0.00 1.78 1.74 0.00 1.50 0.00 0.00 1.39 0.00 0.00 2.63 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.64 1.34 7.81 97 V 7.42 3.66 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 1.03 0.00 0.00 0.96 0.00 0.00 98 V 7.45 4.23 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 0.79 0.00 0.00 1.06 0.00 0.00 99 S 7.67 4.78 0.00 3.99 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 0.00 100 P 0.00 4.20 0.00 2.01 2.08 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 101 K 7.81 3.92 0.00 0.79 1.10 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.24 1.28 7.81 102 Y 7.46 4.96 0.00 3.09 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 0.00 0.00 0.00 103 L 8.34 4.31 0.00 1.98 1.72 0.92 0.75 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 0.00 104 G 8.25 4.13 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 0.00 105 S 8.09 4.15 0.00 3.87 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 0.00 106 R 8.07 4.54 0.00 1.76 1.93 0.00 3.15 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 107 T 7.65 4.60 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 1.22 0.00 0.00 108 S 8.36 4.27 0.00 4.11 4.01 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 0.00 109 E 8.93 3.88 0.00 2.06 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 2.39 2.39 0.00 110 K 8.00 3.88 0.00 1.88 1.82 0.00 1.84 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.53 7.81 111 V 7.58 3.59 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 0.98 0.00 0.00 0.95 0.00 0.00 112 K 8.17 3.95 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.79 0.00 0.00 3.16 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.49 7.81 113 N 8.55 4.36 0.00 2.76 2.87 0.00 0.00 6.71 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 0.00 114 K 8.25 3.90 0.00 1.95 1.99 0.00 1.52 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 115 I 7.81 3.66 2.02 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 0.58 0.91 0.00 0.00 116 L 8.06 4.07 0.00 1.87 1.80 0.96 0.80 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 0.00 117 E 8.06 3.99 0.00 2.08 1.96 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 2.31 2.60 0.00 118 L 7.56 3.39 0.00 1.11 0.40 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.43 3.60 0.00 1.66 1.77 1.05 1.24 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 Y 7.27 3.18 0.00 2.74 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 0.00 121 S 8.06 3.89 0.00 3.99 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 0.00 122 W 7.79 4.34 0.00 3.55 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 0.00 123 T 7.54 3.88 4.18 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 1.13 0.00 0.00 124 V 6.98 3.96 1.70 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 0.74 0.00 0.00 0.24 0.00 0.00 125 G 8.16 3.82 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 0.00 0.00 0.00 126 L 8.65 5.35 0.00 1.72 1.47 0.52 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.34 0.00 2.16 2.18 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 128 E 8.21 4.04 0.00 2.05 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 0.00 2.38 2.38 0.00 129 E 7.97 4.24 0.00 2.02 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 2.19 2.25 0.00 130 V 8.04 3.65 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 0.82 0.00 0.00 0.91 0.00 0.00 131 K 8.01 3.88 0.00 1.59 1.13 0.00 1.40 0.00 0.00 1.39 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 1.25 7.81 132 I 7.66 3.81 2.06 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 1.50 0.74 1.19 0.00 0.00 133 A 8.02 4.13 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 0.00 134 E 8.76 3.94 0.00 2.16 2.40 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 2.45 2.44 0.00 135 A 8.41 4.08 1.61 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 0.00 0.00 136 Y 8.31 4.15 0.00 3.24 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 0.00 137 Q 8.94 3.92 0.00 2.36 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 138 M 8.38 3.98 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.69 0.00 139 L 8.02 3.96 0.00 1.74 1.65 1.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.81 3.96 0.00 1.42 1.79 0.00 1.56 0.00 0.00 1.36 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.32 7.81 141 K 8.09 3.99 0.00 1.84 1.93 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.46 7.81 142 Q 8.21 4.35 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.28 0.00 0.00 0.00 0.00 0.00 2.31 2.67 0.00 143 G 7.98 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 0.00 144 I 7.02 3.66 1.97 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 1.17 0.55 0.95 0.00 0.00 145 V 7.31 4.25 1.83 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 0.65 0.00 0.00 0.74 0.00 0.00 146 K 8.68 4.19 0.00 1.75 1.81 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.34 7.81 147 S 7.29 4.54 0.00 3.88 3.75 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 0.00 148 D 8.30 4.11 0.00 2.35 1.54 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 0.00 149 P 0.00 4.32 0.00 1.97 1.92 0.00 3.28 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 1.99 2.02 0.00