NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.9017 8.3431 109.7378 45.5259 0.0000 172.4419 1 G 3.9652 7.5025 108.1471 41.8439 0.0000 170.4180 2 S 4.5415 8.4074 115.6841 57.3646 66.4586 173.3792 3 Q 4.0065 9.3640 122.6514 58.9893 28.6065 177.9164 4 W 4.4804 8.6747 129.5663 60.6476 30.5306 177.4371 5 N 4.2163 8.2584 115.8813 56.7811 38.7217 176.5635 6 Q 4.0347 8.0275 119.5709 58.8400 28.9123 178.7552 7 V 3.1614 7.7474 119.4395 65.8867 31.2582 178.0785 8 Q 3.7962 7.5276 116.5850 58.1931 28.5295 177.8548 9 Q 4.1759 7.3060 116.9787 56.0458 29.2862 176.2605 10 L 4.1351 6.5725 119.3520 53.8778 42.6173 176.7530 11 E 4.1255 8.4885 120.1424 56.3819 30.1860 178.3652 12 I 3.8952 8.5520 122.2319 63.9819 37.8356 178.1656 13 K 4.0597 8.2035 119.2734 59.3801 32.1361 178.8065 14 F 4.2958 8.3059 116.1171 59.6410 37.9181 176.8590 15 L 2.4996 6.3844 121.0373 57.6826 41.1874 178.8501 16 E 3.9550 7.5750 115.7754 59.5007 29.0928 179.2055 17 Q 4.2170 8.1255 118.4114 58.1306 29.1238 177.8131 18 V 4.3913 7.6979 111.5817 61.3276 32.0182 177.1493 19 D 4.5472 7.8481 119.0098 57.5406 41.0172 178.2373 20 Q 4.2460 8.1289 113.2864 57.5900 28.8443 176.3015 21 F 4.1946 8.2815 116.8821 58.1172 39.3865 174.8625 22 Y 4.8972 7.7981 119.0333 56.1027 40.4021 174.8451 23 D 4.6533 8.3702 122.6346 52.7337 41.7851 175.1917 24 D 4.4758 8.8688 117.5130 57.4777 40.9165 177.1357 25 N 4.5794 8.6074 115.7566 54.6065 38.9265 175.1317 26 F 4.6659 8.1703 119.6053 57.0994 40.9292 171.0385 27 P 4.6060 0.0000 0.0000 61.3765 32.9584 176.8448 28 M 3.4699 8.0339 118.6150 58.3679 31.8918 178.2814 29 E 3.8487 7.9276 118.5663 59.4980 29.6249 179.2409 30 I 3.6518 7.3190 119.1301 64.2714 36.9423 178.2737 31 R 3.8511 7.3972 119.0567 59.6232 29.4870 177.8407 32 H 3.6054 7.6992 116.8382 59.1579 30.1380 177.0906 33 L 4.1644 7.8838 119.3368 56.4571 41.7558 177.7596 34 L 4.8198 7.8505 118.8613 53.8479 42.8074 178.6321 35 A 4.1874 8.2983 123.3462 55.0185 18.0555 179.9216 36 Q 4.0226 8.0959 114.3597 58.7057 29.1650 178.4105 37 W 4.1866 8.2655 128.9457 60.5236 30.4524 177.7269 38 I 4.0409 8.6285 120.2658 64.7945 36.4922 177.8192 39 E 4.2971 8.3193 116.2070 58.2030 29.4091 178.3575 40 T 4.1194 7.4825 115.3352 63.9370 69.2912 175.0898 41 Q 3.7901 6.4295 117.9644 55.0718 29.8841 176.5132 42 D 4.5924 7.4750 120.7270 52.7699 38.9581 176.8909 43 W 4.1834 7.7174 123.9506 59.0497 29.2749 177.4517 44 E 3.9999 8.1269 117.5447 59.5306 29.4120 179.1015 45 V 3.7034 7.8398 117.7626 65.8864 31.6085 177.9355 46 A 4.0621 8.0192 120.6988 54.8954 17.9122 179.6837 47 S 4.2692 8.1381 112.2474 60.7394 63.0387 174.9130 48 N 4.7810 7.7359 117.7776 52.7084 38.7064 174.6885 49 N 4.7609 8.1556 117.2859 50.8715 41.5089 173.9174 50 E 3.8774 8.8925 128.8103 60.0601 29.6610 178.7048 51 T 3.8750 7.8701 114.5866 66.9949 68.5619 176.3624 52 M 4.0210 8.7852 120.5916 58.4045 31.9979 178.6907 53 A 4.0686 8.4533 121.2942 55.4299 18.4203 179.9054 54 T 3.9108 8.0932 114.2147 66.8459 68.5596 176.9195 55 I 3.7748 7.8595 121.6747 64.5269 37.0720 178.4589 56 L 4.0784 8.1351 119.7801 57.7539 41.3741 179.4415 57 L 4.2360 8.2804 120.3206 58.2751 42.1520 178.8032 58 Q 3.9488 8.6106 118.4190 59.3663 28.7068 178.9627 59 N 4.4188 8.5485 117.2783 55.8770 38.5694 177.3275 60 L 2.9580 8.3442 122.2827 57.9426 42.2586 179.0385 61 L 4.0210 8.0242 118.8867 57.7842 41.5386 179.7143 62 I 3.6489 7.4659 119.6823 64.4057 37.0674 178.4997 63 Q 3.7788 7.7642 118.9325 58.6047 28.3056 178.4145 64 L 3.8624 8.1044 121.7945 58.3374 42.0835 178.8349 65 D 4.2983 8.0480 118.6848 57.3873 40.7109 178.6079 66 E 3.9515 7.9706 118.5945 59.4631 29.3439 179.4551 67 Q 3.9673 8.1272 118.0411 58.9675 28.7838 178.7856 68 L 4.0583 8.2196 120.4775 57.7272 41.5994 179.8610 69 G 3.5947 8.2331 105.7595 47.5688 0.0000 175.8621 70 R 3.8493 7.8788 121.0113 59.4942 30.1731 179.1928 71 V 3.8236 8.0569 112.1170 64.0770 31.4002 178.9370 72 S 4.0862 8.0886 115.4847 61.4559 62.4878 176.4446 73 K 3.9429 7.7927 121.0596 59.4546 32.0521 178.0955 74 E 4.1380 8.2475 116.5893 56.0989 29.8602 176.5970 75 K 3.7909 7.8432 117.5680 57.4007 30.3590 176.7395 76 N 4.6180 8.1417 118.4973 52.0661 38.1927 173.6778 77 L 3.9617 8.2722 127.2574 57.5742 41.8855 178.6293 78 L 3.9371 7.9208 119.3486 58.4141 41.9997 178.9638 79 L 4.0056 8.1991 118.7445 57.6188 41.5438 179.4753 80 I 3.6634 7.8766 119.8490 64.5820 36.5992 177.8041 81 H 4.1006 8.4392 119.1196 59.4898 29.7601 177.0368 82 N 4.3074 8.4674 118.4349 56.3280 38.3494 177.4520 83 L 3.9881 8.3375 120.7833 57.7966 41.7102 179.7893 84 K 4.0220 8.1196 118.4079 59.4467 32.0443 179.6944 85 R 3.9401 7.6859 117.8076 59.0832 29.8743 179.1226 86 I 3.6814 7.8070 119.6991 64.2662 37.0283 178.1703 87 R 3.8701 8.2936 119.9660 59.5610 29.7873 178.5098 88 K 4.4037 7.7822 118.8312 58.9568 32.1437 179.4675 89 V 3.6053 7.6821 118.0019 66.1380 31.4177 178.1382 90 L 4.1209 8.3470 119.0477 57.8191 41.2573 179.4936 91 Q 4.1803 8.5802 118.6604 58.9618 28.4032 179.1115 92 G 3.7069 7.8601 105.5768 47.6823 0.0000 175.6819 93 K 4.2078 8.0887 120.7265 59.1708 31.8427 179.0442 94 F 4.1688 8.3982 120.3424 61.7392 39.3926 176.4503 95 H 4.3449 8.2252 113.3703 57.1218 28.8143 176.1443 96 G 3.9035 8.0571 106.8083 43.9344 0.0000 173.7593 97 N 4.9368 7.8773 118.8572 49.3314 40.1433 172.7710 98 P 4.3543 0.0000 0.0000 65.2334 31.7316 177.6030 99 M 4.1420 8.0749 117.2891 58.6915 31.8913 178.0412 100 H 4.2003 8.1052 118.5746 59.0563 29.9218 177.4456 101 V 3.4948 7.8716 119.5258 65.9367 31.3101 177.6630 102 A 4.1446 7.9446 120.0416 55.0785 18.1504 179.7245 103 V 3.4829 7.7329 116.6885 66.1613 31.6673 178.3959 104 V 3.4605 7.5777 117.7927 66.0905 31.3073 178.0401 105 I 2.7956 7.3630 119.5423 63.9699 36.6378 178.5144 106 S 4.1008 8.0194 116.1863 61.7781 62.6186 176.6006 107 N 4.3777 8.2977 119.1595 56.3488 38.2820 176.9924 108 C 3.9490 8.0826 119.9949 62.5947 31.6910 175.7166 109 L 4.0265 7.9493 120.5993 57.7575 41.1381 179.5550 110 R 3.8947 8.0468 118.8294 59.1932 29.9181 178.0914 111 E 3.7338 8.2880 119.5317 59.2038 29.4743 178.7026 112 E 3.9616 8.0992 118.6016 59.4403 29.5242 179.4500 113 R 3.9258 7.9271 118.0827 59.1615 30.1314 179.0375 114 R 3.8327 8.0750 118.3626 59.6161 30.1526 178.6590 115 I 3.7432 7.9689 119.7767 64.3806 36.8566 178.4460 116 L 3.9138 8.2240 118.9993 57.7522 41.4951 179.1831 117 A 4.1002 7.8327 119.6552 54.8820 18.3807 179.1827 118 A 4.0962 7.8690 118.3210 53.4373 18.8970 178.1972 119 A 3.9280 7.4125 120.2102 52.6796 18.8547 176.9972 120 N 4.5796 8.6315 120.6294 53.2991 39.2744 174.7565 121 M 4.7954 8.2480 122.0299 52.7958 36.0226 173.2013 122 P 4.4625 0.0000 0.0000 62.5138 32.5421 176.3543 123 I 3.9627 8.1921 120.2072 61.7556 37.1453 175.8319 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 0 G 8.34 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 0.00 0.00 0.00 1 G 7.50 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 2 S 8.41 4.54 0.00 4.59 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 3 Q 9.36 4.01 0.00 2.19 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.84 0.00 0.00 0.00 0.00 0.00 2.60 2.41 0.00 4 W 8.67 4.48 0.00 3.58 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 5 N 8.26 4.22 0.00 2.80 3.08 0.00 0.00 7.31 6.59 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 6 Q 8.03 4.03 0.00 2.30 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 7 V 7.75 3.16 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 0.46 0.00 0.00 0.98 0.00 0.00 8 Q 7.53 3.80 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.68 0.00 0.00 0.00 0.00 0.00 1.94 1.64 0.00 9 Q 7.31 4.18 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.94 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 10 L 6.57 4.14 0.00 1.16 1.37 0.20 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.49 4.13 0.00 2.08 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 2.41 2.31 0.00 12 I 8.55 3.90 1.90 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 1.70 1.21 0.90 0.00 0.00 13 K 8.20 4.06 0.00 2.03 2.08 0.00 1.58 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.56 7.81 14 F 8.31 4.30 0.00 3.35 3.38 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 15 L 6.38 2.50 0.00 0.90 1.35 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.58 3.95 0.00 2.26 2.14 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 2.53 2.34 0.00 17 Q 8.13 4.22 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 18 V 7.70 4.39 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 1.03 0.00 0.00 1.21 0.00 0.00 19 D 7.85 4.55 0.00 2.84 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 20 Q 8.13 4.25 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.77 0.00 0.00 0.00 0.00 0.00 1.73 2.05 0.00 21 F 8.28 4.19 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 22 Y 7.80 4.90 0.00 2.97 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 23 D 8.37 4.65 0.00 2.89 2.79 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 24 D 8.87 4.48 0.00 2.72 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 25 N 8.61 4.58 0.00 2.89 2.88 0.00 0.00 6.71 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 26 F 8.17 4.67 0.00 2.87 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 27 P 0.00 4.61 0.00 2.33 2.09 0.00 3.67 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 1.87 1.88 0.00 28 M 8.03 3.47 0.00 1.75 1.23 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.42 0.00 29 E 7.93 3.85 0.00 1.99 1.92 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 2.35 2.41 0.00 30 I 7.32 3.65 1.79 0.00 0.00 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 1.32 0.87 1.11 0.00 0.00 31 R 7.40 3.85 0.00 1.62 1.58 0.00 3.32 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 32 H 7.70 3.61 0.00 3.03 3.26 0.00 5.81 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 33 L 7.88 4.16 0.00 1.69 1.88 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.85 4.82 0.00 1.96 1.84 0.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.30 4.19 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 36 Q 8.10 4.02 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 37 W 8.27 4.19 0.00 3.48 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 38 I 8.63 4.04 2.27 0.00 0.00 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 2.14 1.56 0.98 0.00 0.00 39 E 8.32 4.30 0.00 2.16 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 2.56 0.00 40 T 7.48 4.12 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 1.05 0.00 0.00 41 Q 6.43 3.79 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.24 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 42 D 7.48 4.59 0.00 2.52 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 W 7.72 4.18 0.00 3.36 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 44 E 8.13 4.00 0.00 2.04 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 2.34 2.47 0.00 45 V 7.84 3.70 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 0.97 0.00 0.00 0.98 0.00 0.00 46 A 8.02 4.06 1.34 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 47 S 8.14 4.27 0.00 4.09 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 0.00 48 N 7.74 4.78 0.00 2.76 2.85 0.00 0.00 6.68 7.76 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 49 N 8.16 4.76 0.00 2.69 2.62 0.00 0.00 6.81 7.62 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 50 E 8.89 3.88 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 2.37 2.42 0.00 51 T 7.87 3.87 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 1.21 0.00 0.00 52 M 8.79 4.02 0.00 1.96 2.20 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.51 0.00 53 A 8.45 4.07 1.51 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 0.00 0.00 54 T 8.09 3.91 4.42 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 1.28 0.00 0.00 55 I 7.86 3.77 2.02 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 1.56 0.82 0.93 0.00 0.00 56 L 8.14 4.08 0.00 1.84 1.47 -0.08 0.04 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 57 L 8.28 4.24 0.00 2.10 2.05 1.08 1.12 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 58 Q 8.61 3.95 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.79 0.00 59 N 8.55 4.42 0.00 3.22 3.18 0.00 0.00 6.70 6.35 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 60 L 8.34 2.96 0.00 2.21 2.09 0.86 1.03 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 61 L 8.02 4.02 0.00 1.81 1.60 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 62 I 7.47 3.65 1.92 0.00 0.00 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 1.46 0.96 0.84 0.00 0.00 63 Q 7.76 3.78 0.00 1.53 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 64 L 8.10 3.86 0.00 1.71 1.78 0.87 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.05 4.30 0.00 2.88 2.65 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 66 E 7.97 3.95 0.00 2.13 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 2.29 2.47 0.00 67 Q 8.13 3.97 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 68 L 8.22 4.06 0.00 1.78 1.69 0.89 1.00 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 69 G 8.23 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 0.00 0.00 0.00 70 R 7.88 3.85 0.00 1.91 2.11 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 71 V 8.06 3.82 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 0.74 0.00 0.00 1.02 0.00 0.00 72 S 8.09 4.09 0.00 4.06 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 73 K 7.79 3.94 0.00 1.88 1.99 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.48 7.81 74 E 8.25 4.14 0.00 2.11 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 2.35 2.48 0.00 75 K 7.84 3.79 0.00 1.89 1.88 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.52 7.81 76 N 8.14 4.62 0.00 2.75 2.73 0.00 0.00 7.26 7.20 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 77 L 8.27 3.96 0.00 1.71 1.71 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.92 3.94 0.00 1.74 1.67 0.93 0.63 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 79 L 8.20 4.01 0.00 1.75 1.69 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.88 3.66 2.01 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 1.40 0.95 0.91 0.00 0.00 81 H 8.44 4.10 0.00 3.22 3.52 0.00 5.59 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 82 N 8.47 4.31 0.00 2.86 2.82 0.00 0.00 7.12 6.88 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 83 L 8.34 3.99 0.00 1.69 1.69 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.12 4.02 0.00 1.78 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.63 7.81 85 R 7.69 3.94 0.00 1.96 1.93 0.00 2.99 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 86 I 7.81 3.68 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.77 0.89 0.00 0.00 87 R 8.29 3.87 0.00 1.90 2.09 0.00 3.06 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 88 K 7.78 4.40 0.00 2.03 1.85 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.48 7.81 89 V 7.68 3.61 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 1.13 0.00 0.00 0.97 0.00 0.00 90 L 8.35 4.12 0.00 1.74 1.77 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.58 4.18 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 92 G 7.86 3.71 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 0.00 0.00 0.00 93 K 8.09 4.21 0.00 2.08 1.95 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.75 1.66 7.81 94 F 8.40 4.17 0.00 2.99 3.29 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 95 H 8.23 4.34 0.00 3.17 3.37 0.00 5.88 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.06 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 0.00 0.00 0.00 97 N 7.88 4.94 0.00 2.71 2.67 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 98 P 0.00 4.35 0.00 2.23 2.18 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 99 M 8.07 4.14 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.81 0.00 100 H 8.11 4.20 0.00 3.31 3.43 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.87 3.49 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 1.08 0.00 0.00 1.04 0.00 0.00 102 A 7.94 4.14 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 0.00 103 V 7.73 3.48 2.17 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 1.04 0.00 0.00 0.99 0.00 0.00 104 V 7.58 3.46 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 1.00 0.00 0.00 0.81 0.00 0.00 105 I 7.36 2.80 0.56 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.80 0.00 0.00 106 S 8.02 4.10 0.00 4.00 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 0.00 107 N 8.30 4.38 0.00 2.96 3.13 0.00 0.00 6.71 7.93 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 0.00 108 C 8.08 3.95 0.00 3.00 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 0.00 109 L 7.95 4.03 0.00 1.71 1.72 0.97 0.76 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 0.00 110 R 8.05 3.89 0.00 1.89 1.90 0.00 3.11 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 111 E 8.29 3.73 0.00 1.33 1.47 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 1.47 1.97 0.00 112 E 8.10 3.96 0.00 2.43 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 0.00 2.52 2.62 0.00 113 R 7.93 3.93 0.00 2.03 1.97 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 114 R 8.08 3.83 0.00 1.86 2.05 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 115 I 7.97 3.74 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.80 0.96 0.00 0.00 116 L 8.22 3.91 0.00 1.67 1.68 0.89 0.69 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 0.00 117 A 7.83 4.10 1.38 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 0.00 0.00 118 A 7.87 4.10 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 0.00 119 A 7.41 3.93 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 0.00 120 N 8.63 4.58 0.00 2.73 2.77 0.00 0.00 6.83 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 0.00 121 M 8.25 4.80 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.47 0.00 122 P 0.00 4.46 0.00 2.17 2.04 0.00 3.74 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 1.97 1.97 0.00 123 I 8.19 3.96 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.82 0.91 0.00 0.00