NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 F 4.5352 8.3244 122.8155 57.3355 41.2370 174.4345 3 L 4.4789 7.9727 120.6455 49.8147 43.8108 174.1857 4 T 3.9459 8.8620 118.7444 61.7488 69.5812 174.3727 5 A 4.1462 8.4449 123.0292 53.9209 18.2788 179.3363 6 E 3.9850 8.4320 118.8731 58.8908 29.9162 177.9804 7 E 3.8996 8.0567 118.0934 59.4653 29.6426 179.2564 8 K 4.0184 8.2373 119.6549 59.0878 32.1596 179.1917 9 G 3.5369 7.8011 105.1426 48.1330 0.0000 175.0501 10 L 3.8978 7.8715 121.6775 58.1768 41.6927 179.4824 11 V 3.4393 8.2715 116.4715 66.7947 31.3130 177.7964 12 N 4.4802 8.4678 114.8884 56.6253 38.5073 177.2440 13 G 3.9204 8.4734 105.6973 48.0861 0.0000 174.8966 14 L 3.9131 7.9683 123.0140 57.3048 42.0904 178.8917 15 W 4.3571 8.7817 128.4112 60.5781 30.4781 177.9180 16 G 3.8112 8.2309 104.8846 47.2443 0.0000 174.1017 17 K 4.5049 7.5891 117.3804 55.8752 32.4140 175.8269 18 V 4.0102 8.0506 120.8287 61.5577 31.8572 176.8693 19 N 4.4898 8.3451 126.0652 52.9075 37.3326 174.8441 20 V 3.4425 7.9916 126.9395 64.6693 30.8692 177.7736 21 D 4.2914 7.9653 118.6973 57.2270 40.6303 178.2093 22 E 3.7054 8.1653 116.8008 57.7947 29.9563 177.6143 23 V 4.0495 7.3061 117.8598 65.0125 32.5301 177.5587 24 G 3.7915 7.8332 105.1646 48.0365 0.0000 175.8185 25 G 3.6226 7.7237 107.3777 46.9416 0.0000 175.0710 26 E 4.0657 7.8774 120.4109 58.0380 30.0813 177.7253 27 A 3.9356 8.0825 121.2647 55.2421 18.3394 179.4477 28 L 3.9915 7.8646 118.3598 57.9219 42.3854 178.9094 29 G 3.6598 8.1602 105.8782 48.0263 0.0000 175.9013 30 R 3.8430 8.1574 120.6116 58.8613 30.1189 178.7495 31 L 3.9743 7.8566 120.2230 58.5390 42.0290 179.2842 32 L 4.1645 7.7033 119.8792 57.0634 41.3221 179.7300 33 V 3.5419 7.3132 117.2508 65.6923 31.5481 177.8809 34 V 3.5543 8.1096 117.4910 64.1324 32.8532 175.6685 35 Y 4.1106 7.4445 115.3678 53.9707 38.3829 173.7251 36 P 4.4726 0.0000 0.0000 65.0806 30.4606 178.0673 37 W 4.5726 8.3484 114.8290 58.5107 27.7831 177.7875 38 T 4.4661 8.0148 111.7482 64.8433 68.1667 176.5342 39 Q 4.2419 8.4669 120.8744 59.5056 28.4717 179.6335 40 R 4.5197 7.2646 119.7921 60.1843 30.1889 178.4020 41 F 4.1933 8.0624 114.9237 58.6247 39.1690 175.4794 42 F 4.8801 8.8537 118.9503 57.0384 39.8583 176.2357 43 E 4.1626 8.3540 121.7657 59.1520 29.6772 179.1099 44 S 4.3832 8.2956 111.8228 60.1006 62.4157 174.1144 45 F 4.9081 8.7062 116.6748 57.6077 40.7194 176.4406 46 G 3.9427 7.9485 111.0881 46.3001 0.0000 176.9912 47 D 4.5759 8.7961 128.8600 53.6267 39.6513 174.8270 48 L 4.8336 8.2298 126.7416 54.3651 42.6395 178.4929 49 S 4.2811 8.3813 116.1296 60.5280 63.7225 174.9047 50 S 4.7552 7.6886 113.8101 55.6062 65.6845 173.9258 51 A 3.9579 8.5255 128.9761 55.9785 18.0440 180.1298 52 D 4.2900 8.0831 116.1268 57.0478 40.9764 178.3644 53 A 3.9821 8.1223 121.0648 55.5623 17.9848 179.7116 54 I 3.7022 7.4361 116.3605 64.8919 37.3776 178.4270 55 M 4.1621 7.7922 117.9832 57.7915 31.7419 178.2030 56 S 4.5620 7.8992 113.3525 58.9953 63.8301 173.8356 57 N 3.9039 7.8958 120.5579 53.2214 38.3649 174.8533 58 A 4.0924 8.6231 127.9640 54.3816 18.5675 178.8335 59 K 3.8069 7.9788 116.5255 58.4869 32.2152 179.1851 60 V 3.6714 8.0179 119.0279 65.9365 31.5670 177.7354 61 K 3.8219 7.6808 117.3878 59.8709 32.0136 179.0426 62 A 4.0188 7.6754 120.2576 55.3470 18.1995 179.1905 63 H 4.4521 8.2407 116.9387 59.7624 29.8563 176.8761 64 G 4.0949 8.6420 108.9170 46.7071 0.0000 175.9563 65 K 4.3701 8.2923 120.8493 58.1772 33.0215 178.4945 66 K 3.9723 8.1274 120.0799 59.5508 31.9131 178.7464 67 V 3.7060 8.4070 119.2006 66.2683 31.4521 177.9913 68 L 4.3370 8.7921 119.0186 57.7621 41.2962 179.4042 69 N 4.5092 8.4031 116.8086 56.5178 38.4087 177.4885 70 S 4.0836 7.8690 113.6268 61.3947 62.9891 176.2687 71 F 4.1569 8.0875 123.0189 61.3420 39.1340 177.0528 72 S 4.1632 8.5582 114.9114 62.2287 62.6535 176.7741 73 D 4.4651 8.6484 121.1941 56.6383 40.5763 179.0324 74 G 3.5538 7.8341 106.8694 47.8309 0.0000 175.7406 75 L 3.9422 7.5120 119.9128 57.3242 41.6847 179.3630 76 K 4.1620 7.6619 117.7995 58.6450 32.2210 178.2167 77 N 4.8177 7.5810 115.5005 52.9414 39.1037 176.7425 78 I 3.5037 6.9133 123.0258 64.0652 38.0773 176.3546 79 D 4.4452 7.8302 117.9113 55.2731 41.2094 176.2591 80 D 4.6055 7.7279 117.2457 51.6098 42.3587 175.2563 81 L 4.1357 7.9051 126.2028 57.7785 41.9913 177.9005 82 K 3.7689 8.2964 116.1134 60.6647 31.6725 178.6308 83 G 3.7458 8.5536 109.0389 47.9917 0.0000 174.8518 84 A 4.0504 7.7566 121.7947 53.9226 18.6094 177.9187 85 F 4.5377 8.0648 113.0251 56.3393 40.7296 176.6110 86 A 4.0735 8.2282 123.8862 55.2898 17.5423 179.6091 87 K 3.8435 7.9283 117.3754 59.7796 32.4437 178.9062 88 L 4.0926 7.9829 118.7238 58.5081 41.5203 178.3603 89 S 4.3196 8.8265 114.9185 59.9981 62.2159 176.0539 90 E 3.7440 8.1080 120.0827 59.6561 29.6431 179.1756 91 L 3.8925 7.7273 119.7453 58.7759 42.1352 178.6013 92 H 4.2001 8.3774 115.6882 59.4576 28.7982 176.1457 93 C 4.0475 8.2656 121.0930 61.1550 30.5948 174.9438 94 D 4.3449 7.2139 122.4367 56.8218 41.2439 177.8546 95 K 4.4648 7.6965 114.4935 56.1415 32.8111 176.6686 96 L 4.5735 7.0757 115.8331 53.4229 44.3131 176.5386 97 H 4.3089 8.3134 113.4916 56.5336 26.6428 174.6432 98 V 3.8272 7.9263 119.8055 62.3318 31.8670 175.2001 99 D 4.4014 8.6651 126.9511 53.2669 41.2528 174.6933 100 P 2.0000 0.0000 0.0000 64.7910 31.5684 178.0498 101 E 3.7353 8.0891 118.7396 59.7313 29.3300 178.8560 102 N 4.4183 8.5389 116.6196 55.7829 38.4898 177.2917 103 F 4.6077 7.9883 119.8807 60.4306 38.8927 177.6382 104 R 4.0149 7.7105 116.6918 59.2491 29.8332 178.9096 105 L 3.9182 7.7067 118.5898 57.5728 41.5636 179.3843 106 L 4.0695 8.0296 119.8062 58.1574 42.1491 178.6764 107 G 3.9860 8.1221 105.7868 48.4323 0.0000 175.2726 108 N 4.4520 8.8007 119.3102 55.9126 38.6211 177.8483 109 V 3.6784 8.1407 119.8276 65.4911 31.5594 177.9155 110 L 3.8183 8.4783 120.6478 58.1976 41.9354 178.8651 111 V 3.6012 7.9755 118.2683 66.5715 31.2990 177.7883 112 C 4.1014 8.1075 116.2016 62.6517 27.8648 176.3372 113 V 3.4760 7.6973 119.8500 65.7345 31.0364 177.7997 114 L 3.8302 7.7881 118.5575 57.8207 41.3656 179.0428 115 A 3.5098 7.2186 120.4201 55.5024 18.0114 178.8229 116 H 3.8570 7.8985 114.8513 60.0811 29.9563 176.8085 117 H 4.0116 8.2578 116.6073 57.9952 28.2678 176.9573 118 F 4.7071 8.4708 118.1581 55.9822 40.1657 177.3966 119 G 3.9281 8.9790 108.6392 46.2827 0.0000 175.9483 120 H 4.1947 9.2755 121.9508 59.1590 29.5526 175.8823 121 D 4.4958 7.8428 117.1570 56.8119 41.2979 176.7716 122 F 4.5411 8.4543 123.9511 56.5615 38.3612 175.2911 123 N 4.1910 7.7161 120.3469 52.8013 40.9260 173.7163 124 P 4.1559 0.0000 0.0000 66.3297 30.5952 178.8665 125 Q 3.9779 7.9085 115.9463 58.4207 28.7154 178.5248 126 V 3.6235 7.4841 118.9826 65.8369 31.6708 177.4026 127 Q 3.4674 7.5317 119.0563 59.2612 28.7939 178.4519 128 A 4.0593 7.6477 121.1826 55.1550 18.2603 179.5395 129 A 3.8651 7.5205 119.6493 55.3073 18.4348 179.9178 130 F 3.9593 8.1023 116.1008 60.7788 39.0688 177.8665 131 Q 4.2304 8.9043 118.0695 58.7891 28.3352 179.3286 132 K 3.9310 7.9549 119.5797 59.4243 32.1234 179.2822 133 V 3.6471 8.0700 118.7725 66.1174 31.3982 177.7714 134 V 3.8795 8.4371 118.0662 66.3820 31.3378 177.8281 135 A 4.1267 8.0541 119.6598 55.0849 18.2151 179.5041 136 G 3.7443 8.3987 104.6068 48.1551 0.0000 175.6489 137 V 2.8577 7.9120 121.3337 65.4349 31.2485 177.7688 138 A 3.9487 8.0250 119.2765 55.3069 18.2452 178.8374 139 N 4.5221 8.2129 114.3080 55.7780 38.7208 177.5168 140 A 3.9712 7.7481 121.4154 55.2487 18.2563 179.4983 141 L 4.0582 7.8740 117.1238 57.0318 41.2294 178.4739 142 A 4.7925 7.3595 118.9915 52.1705 19.1037 176.8559 143 H 4.6400 8.2018 119.8135 58.9961 31.4096 176.3591 144 K 4.3128 7.5455 117.7413 55.9289 30.7605 175.0808 145 Y 4.7601 7.1329 116.2207 56.4053 41.4820 176.3605 146 H 4.3186 8.5810 115.4125 56.7193 27.9588 174.1805 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 F 8.32 4.54 0.00 2.98 3.09 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 3 L 7.97 4.48 0.00 1.86 1.58 0.86 0.72 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 4 T 8.86 3.95 4.20 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 1.25 0.00 0.00 5 A 8.44 4.15 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 6 E 8.43 3.99 0.00 1.99 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 0.00 2.24 2.32 0.00 7 E 8.06 3.90 0.00 2.11 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 0.00 2.32 2.31 0.00 8 K 8.24 4.02 0.00 1.92 1.78 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 9 G 7.80 3.54 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 0.00 0.00 0.00 10 L 7.87 3.90 0.00 1.87 1.71 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.27 3.44 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 0.55 0.00 0.00 0.27 0.00 0.00 12 N 8.47 4.48 0.00 2.99 2.95 0.00 0.00 7.03 6.89 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 13 G 8.47 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 0.00 0.00 0.00 14 L 7.97 3.91 0.00 1.94 2.16 0.83 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.78 4.36 0.00 3.67 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 16 G 8.23 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 17 K 7.59 4.50 0.00 1.90 1.94 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.38 7.81 18 V 8.05 4.01 1.28 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 0.12 0.00 0.00 0.90 0.00 0.00 19 N 8.35 4.49 0.00 2.69 2.56 0.00 0.00 6.91 7.71 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 20 V 7.99 3.44 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 0.72 0.00 0.00 0.95 0.00 0.00 21 D 7.97 4.29 0.00 2.66 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 22 E 8.17 3.71 0.00 1.89 1.86 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 2.23 2.25 0.00 23 V 7.31 4.05 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 0.91 0.00 0.00 0.62 0.00 0.00 24 G 7.83 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.72 3.62 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 0.00 0.00 0.00 26 E 7.88 4.07 0.00 1.98 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 2.25 2.28 0.00 27 A 8.08 3.94 1.28 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 0.00 0.00 0.00 28 L 7.86 3.99 0.00 1.85 1.61 0.85 1.03 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 29 G 8.16 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 30 R 8.16 3.84 0.00 1.89 1.88 0.00 3.18 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 31 L 7.86 3.97 0.00 1.80 1.86 1.03 0.60 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 32 L 7.70 4.16 0.00 1.65 1.69 0.80 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.31 3.54 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 8.11 3.55 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 -0.11 0.00 0.00 0.70 0.00 0.00 35 Y 7.44 4.11 0.00 2.67 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 36 P 0.00 4.47 0.00 2.37 2.37 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.98 0.00 37 W 8.35 4.57 0.00 3.63 3.59 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 0.00 0.00 0.00 0.00 38 T 8.01 4.47 4.40 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 1.08 0.00 0.00 39 Q 8.47 4.24 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.54 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 40 R 7.26 4.52 0.00 2.20 1.64 0.00 3.06 0.00 0.00 3.09 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 41 F 8.06 4.19 0.00 2.51 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 8.85 4.88 0.00 2.73 2.35 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 43 E 8.35 4.16 0.00 2.10 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 2.43 2.41 0.00 44 S 8.30 4.38 0.00 3.96 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 0.00 45 F 8.71 4.91 0.00 3.20 3.05 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 46 G 7.95 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 0.00 0.00 0.00 47 D 8.80 4.58 0.00 2.65 2.66 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 48 L 8.23 4.83 0.00 1.69 1.66 1.10 1.06 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 49 S 8.38 4.28 0.00 4.03 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 50 S 7.69 4.76 0.00 3.89 3.73 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 51 A 8.53 3.96 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 52 D 8.08 4.29 0.00 2.72 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 53 A 8.12 3.98 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 54 I 7.44 3.70 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 1.54 0.69 0.93 0.00 0.00 55 M 7.79 4.16 0.00 1.99 2.10 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 2.59 2.78 0.00 56 S 7.90 4.56 0.00 4.02 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 57 N 7.90 3.90 0.00 2.91 2.96 0.00 0.00 7.05 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 58 A 8.62 4.09 1.28 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 0.00 0.00 0.00 59 K 7.98 3.81 0.00 1.34 0.96 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.33 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.30 7.81 60 V 8.02 3.67 2.33 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 1.01 0.00 0.00 1.08 0.00 0.00 61 K 7.68 3.82 0.00 2.02 1.85 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.47 7.81 62 A 7.68 4.02 1.27 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 0.00 0.00 63 H 8.24 4.45 0.00 3.38 3.60 0.00 5.80 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 64 G 8.64 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 0.00 0.00 0.00 65 K 8.29 4.37 0.00 2.02 2.00 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.46 1.61 7.81 66 K 8.13 3.97 0.00 2.19 2.11 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.59 7.81 67 V 8.41 3.71 2.20 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 1.05 0.00 0.00 0.90 0.00 0.00 68 L 8.79 4.34 0.00 2.01 1.88 0.92 0.94 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 69 N 8.40 4.51 0.00 3.10 2.95 0.00 0.00 6.67 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 70 S 7.87 4.08 0.00 4.14 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 71 F 8.09 4.16 0.00 3.50 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 72 S 8.56 4.16 0.00 4.36 4.16 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 73 D 8.65 4.47 0.00 2.53 2.59 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 0.00 0.00 0.00 0.00 74 G 7.83 3.55 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 0.00 0.00 0.00 75 L 7.51 3.94 0.00 1.65 1.60 0.47 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.66 4.16 0.00 1.62 1.83 0.00 1.58 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.51 7.81 77 N 7.58 4.82 0.00 2.57 2.69 0.00 0.00 6.58 7.33 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 78 I 6.91 3.50 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.93 0.90 0.00 0.00 79 D 7.83 4.45 0.00 2.66 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 80 D 7.73 4.61 0.00 2.54 2.47 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 0.00 81 L 7.91 4.14 0.00 1.51 1.62 0.49 0.60 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 82 K 8.30 3.77 0.00 1.73 1.77 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.65 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.39 7.81 83 G 8.55 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 0.00 0.00 0.00 84 A 7.76 4.05 1.26 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 0.00 0.00 0.00 85 F 8.06 4.54 0.00 3.16 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 86 A 8.23 4.07 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 87 K 7.93 3.84 0.00 1.81 1.79 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.52 7.81 88 L 7.98 4.09 0.00 1.88 1.89 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.83 4.32 0.00 4.00 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 90 E 8.11 3.74 0.00 2.23 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 2.30 2.36 0.00 91 L 7.73 3.89 0.00 1.78 1.81 0.92 0.96 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 92 H 8.38 4.20 0.00 3.55 3.68 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.27 4.05 0.00 1.23 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 94 D 7.21 4.34 0.00 2.80 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 95 K 7.70 4.46 0.00 1.84 1.78 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.35 7.81 96 L 7.08 4.57 0.00 1.69 1.68 0.77 1.08 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 97 H 8.31 4.31 0.00 3.42 3.46 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.93 3.83 2.27 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 0.46 0.00 0.00 0.92 0.00 0.00 99 D 8.67 4.40 0.00 2.75 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 0.00 100 P 0.00 2.00 0.00 1.84 1.81 0.00 3.38 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 1.43 0.78 0.00 101 E 8.09 3.74 0.00 2.19 1.86 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 2.24 2.37 0.00 102 N 8.54 4.42 0.00 2.50 2.74 0.00 0.00 6.99 5.77 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 0.00 103 F 7.99 4.61 0.00 3.03 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 0.00 104 R 7.71 4.01 0.00 1.89 2.00 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 105 L 7.71 3.92 0.00 1.65 1.28 0.35 0.14 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 0.00 106 L 8.03 4.07 0.00 1.85 1.75 0.95 1.09 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 0.00 107 G 8.12 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 0.00 108 N 8.80 4.45 0.00 3.04 2.99 0.00 0.00 6.72 7.70 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 0.00 109 V 8.14 3.68 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 1.08 0.00 0.00 1.13 0.00 0.00 110 L 8.48 3.82 0.00 1.69 1.77 0.88 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.98 3.60 2.19 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 1.33 0.00 0.00 1.13 0.00 0.00 112 C 8.11 4.10 0.00 3.18 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 0.00 113 V 7.70 3.48 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 1.07 0.00 0.00 0.89 0.00 0.00 114 L 7.79 3.83 0.00 1.08 1.00 0.27 0.71 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 0.00 115 A 7.22 3.51 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 0.00 116 H 7.90 3.86 0.00 3.07 3.39 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.26 4.01 0.00 2.70 2.51 0.00 5.88 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.47 4.71 0.00 3.15 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 0.00 119 G 8.98 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 0.00 120 H 9.28 4.19 0.00 3.13 3.44 0.00 5.94 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 7.84 4.50 0.00 2.94 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 0.00 122 F 8.45 4.54 0.00 3.03 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 0.00 123 N 7.72 4.19 0.00 2.82 2.74 0.00 0.00 6.94 8.03 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 0.00 124 P 0.00 4.16 0.00 2.11 2.12 0.00 3.55 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 2.11 2.21 0.00 125 Q 7.91 3.98 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 126 V 7.48 3.62 1.69 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 1.02 0.00 0.00 0.92 0.00 0.00 127 Q 7.53 3.47 0.00 1.78 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 128 A 7.65 4.06 1.28 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 0.00 0.00 0.00 129 A 7.52 3.87 1.28 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 0.00 0.00 0.00 130 F 8.10 3.96 0.00 3.29 3.31 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 0.00 131 Q 8.90 4.23 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 132 K 7.95 3.93 0.00 1.88 1.71 0.00 1.46 0.00 0.00 1.19 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.47 7.81 133 V 8.07 3.65 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 1.01 0.00 0.00 0.83 0.00 0.00 134 V 8.44 3.88 2.45 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 1.15 0.00 0.00 1.27 0.00 0.00 135 A 8.05 4.13 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 0.00 136 G 8.40 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 0.00 137 V 7.91 2.86 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 0.32 0.00 0.00 -0.01 0.00 0.00 138 A 8.03 3.95 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 0.00 139 N 8.21 4.52 0.00 3.03 2.86 0.00 0.00 6.80 6.92 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 0.00 140 A 7.75 3.97 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.87 4.06 0.00 1.20 1.21 0.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.36 4.79 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 0.00 143 H 8.20 4.64 0.00 3.32 3.59 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.55 4.31 0.00 1.86 1.76 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.46 7.81 145 Y 7.13 4.76 0.00 2.90 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 0.00 146 H 8.58 4.32 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00