NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4462 8.2893 120.3517 55.3853 33.3819 174.2020 2 E 4.8769 8.4416 122.2111 54.0677 33.4584 173.0903 3 A 4.6940 8.8329 122.0849 50.0427 22.9970 176.6222 4 K 5.4050 8.9280 119.6782 54.5154 35.6578 174.4391 5 A 4.3333 8.1571 118.4585 52.4298 20.3794 174.2544 6 I 3.0345 7.6962 124.8059 61.0662 35.5854 173.2067 7 A 4.4767 8.8400 129.0690 50.6403 19.8900 175.9673 8 R 4.5020 8.2765 121.9672 55.5448 32.2744 175.5925 9 Y 3.6243 8.3284 118.6187 59.3377 34.6844 171.2119 10 V 3.3972 8.1006 121.4234 64.0522 31.9632 175.5718 11 R 4.0685 8.0432 116.8383 58.3758 27.4513 174.8425 12 I 4.6379 7.3584 113.6457 58.4810 41.4936 173.9129 13 S 4.4146 8.4993 118.4746 57.2010 62.9451 172.5761 14 P 4.0960 0.0000 0.0000 65.9826 30.7726 178.2727 15 R 3.9117 8.0968 115.8690 59.7735 29.9048 179.0805 16 K 4.0674 7.9940 116.8139 59.3491 32.3588 179.1906 17 V 3.8896 7.6501 117.8076 65.5424 31.7318 177.7800 18 R 3.9400 8.5719 118.3105 59.6867 29.7392 178.4253 19 L 4.0393 7.3487 116.1040 57.8584 41.8705 179.4758 20 V 3.9723 8.2395 118.6116 63.9827 31.9938 178.2766 21 V 3.5505 7.8588 118.3863 66.2192 31.3459 177.4126 22 D 4.4415 8.6684 118.6989 57.4377 40.3739 178.7072 23 L 4.1378 8.0054 120.4432 56.9227 42.2619 177.3334 24 I 4.2546 7.5308 109.9820 59.9792 38.4860 174.6581 25 R 3.9270 7.3998 121.2366 59.4695 29.4343 175.9162 26 G 4.2940 9.0339 114.6474 45.8813 0.0000 172.1083 27 K 4.6809 7.6133 118.4817 53.6597 34.8096 176.2339 28 S 4.6147 8.4863 115.3495 58.4496 64.7557 174.8016 29 L 3.8173 8.4919 125.6829 59.2650 41.6991 178.5108 30 E 3.9073 8.4073 118.3865 58.5311 29.4522 177.8752 31 E 3.8446 9.1487 118.7865 59.5326 29.8747 179.1033 32 A 3.9816 8.6824 120.9366 55.5724 18.2725 179.8635 33 R 3.8107 8.1480 115.8266 59.6038 29.9992 178.5875 34 N 4.5917 7.7976 114.6224 57.0599 39.0081 176.7386 35 I 3.8362 8.3780 120.6475 64.9238 37.2729 178.2013 36 L 3.9753 8.2816 120.5022 57.2592 41.3547 179.5611 37 R 3.7190 8.2534 118.5449 58.9799 30.1048 177.5163 38 Y 4.6475 7.7232 114.0990 57.8733 38.3366 175.7060 39 T 4.4504 7.9821 117.7545 62.0230 69.4877 174.4689 40 N 4.8065 8.5623 126.4083 51.9356 37.7429 173.0977 41 K 4.3877 7.8120 118.4864 54.7493 36.3091 176.4014 42 R 3.8354 8.8045 123.7991 59.6076 30.3902 178.8062 43 G 3.7133 8.2681 103.8233 47.8960 0.0000 174.4196 44 A 3.8617 8.2112 121.3061 56.5878 18.1801 179.2324 45 Y 3.4892 8.0647 111.3642 59.9271 39.4184 178.6585 46 F 4.3254 7.9603 117.2878 61.3252 39.5513 177.6360 47 V 3.5650 8.7180 117.1342 66.5218 31.3655 177.6096 48 A 3.8457 8.0548 119.6814 55.3726 18.2417 179.1913 49 K 3.6473 8.1909 117.0679 59.9985 32.2812 179.2565 50 V 3.7054 7.9064 111.9594 63.5316 31.3580 178.1392 51 L 3.8676 8.1214 121.0480 58.3615 41.8700 178.5576 52 E 3.8801 8.4009 118.5158 59.7030 29.4690 179.1123 53 S 4.0428 7.9207 112.2039 61.6206 62.3430 176.0139 54 A 3.8720 8.1083 122.7783 55.4315 18.1204 178.8789 55 A 3.8469 8.3209 118.5130 55.5907 18.4060 179.4683 56 A 3.4113 9.0409 111.8631 55.6143 18.4398 180.6893 57 N 4.0401 6.9461 115.4455 55.0568 39.3943 175.6949 58 A 3.7903 8.8266 120.4631 55.8912 17.8213 179.3776 59 V 3.5576 7.9189 114.0492 66.2288 31.8728 178.5659 60 N 4.3911 8.4545 115.6594 56.0662 38.6263 176.5897 61 N 4.7050 8.9635 116.8816 53.7257 39.7065 175.0595 62 H 4.7176 8.3287 117.9891 60.1492 30.1778 175.3219 63 D 4.3979 7.1804 113.2637 55.5207 37.5001 173.1754 64 M 4.2722 7.7962 125.0083 55.3212 34.6265 171.8292 65 L 3.5476 7.8254 124.0632 54.1935 39.3153 173.4822 66 E 3.7012 8.1981 123.4567 59.4593 30.1538 179.0813 67 D 4.5189 7.7024 120.9800 57.2646 41.6348 178.5374 68 R 4.2549 8.1128 117.0286 56.4595 31.0044 175.5601 69 L 5.4415 8.4370 119.9375 54.5568 43.1624 175.3844 70 Y 5.2448 9.3712 119.4223 55.4719 42.3634 174.4043 71 V 3.8828 8.3583 119.5818 61.7296 30.9883 176.7693 72 K 3.5575 8.3584 128.3759 58.3563 31.8430 176.1671 73 A 4.9256 7.6618 119.1595 50.2033 23.3662 173.3290 74 A 5.1389 8.5703 119.7607 49.9151 23.2084 174.9692 75 Y 4.8774 7.3647 118.5732 57.2430 41.1041 172.7462 76 V 4.9568 8.5911 114.7113 59.9492 34.3695 174.7342 77 D 5.1082 8.8646 122.9439 52.1584 44.8451 174.9489 78 E 4.2247 8.8390 122.1631 56.5256 30.5177 176.4041 79 G 4.1993 8.7435 114.7716 43.7123 0.0000 170.4332 80 P 4.4938 0.0000 0.0000 62.0879 31.8532 175.9767 81 A 4.1829 8.4674 125.3569 51.8988 19.5007 176.4509 82 L 4.3109 8.8519 121.8746 53.9772 43.1540 176.0976 83 K 4.6435 8.6817 124.2187 55.1713 33.2634 176.0660 84 R 4.7197 8.8678 125.0825 53.9503 33.0756 176.1837 85 V 4.1975 8.3225 122.3711 63.0053 32.7241 175.2375 86 L 4.6635 9.2224 128.5791 52.6027 44.8233 173.7178 87 P 4.6724 0.0000 0.0000 62.7995 32.1495 175.9508 88 R 4.8380 8.3870 121.0306 53.7723 33.5709 174.7103 89 A 4.0193 8.5146 121.6951 53.4586 18.8074 177.2864 90 R 3.8724 9.1148 116.0696 57.6383 28.3904 176.9857 91 G 3.9896 7.2399 101.3846 46.7921 0.0000 174.3298 92 R 3.8331 7.8876 119.7753 58.7557 30.8911 173.6523 93 A 3.6137 7.9508 127.7858 52.1503 15.0278 176.5925 94 D 4.9029 8.7899 121.8850 53.6225 43.7877 175.5738 95 I 4.8143 8.0254 113.4430 59.2029 38.8690 175.2190 96 I 4.0731 8.4955 128.9847 60.4539 39.3707 174.8294 97 K 5.0077 8.4227 127.6174 54.7709 34.3422 175.7840 98 K 4.1207 8.6889 126.4235 56.6035 32.8839 177.8457 99 R 4.8133 8.5333 124.7733 55.7536 32.8940 175.0959 100 T 4.7390 8.1085 113.0549 61.2582 70.8549 172.7010 101 S 5.1393 8.7983 123.7855 57.2632 66.6004 172.9750 102 H 5.2454 9.1422 119.2026 54.2847 31.0621 172.6377 103 I 4.4685 8.7601 125.3524 60.4778 39.2571 175.4964 104 T 4.6456 8.3761 121.9794 61.8020 72.3032 172.9737 105 V 4.6506 8.2339 126.1863 60.7549 35.1572 174.2292 106 I 4.7867 8.5287 120.3063 59.3374 40.2872 174.2933 107 L 5.2387 8.5067 127.8257 53.0459 43.7871 176.0877 108 G 4.5340 7.7918 107.6140 44.6137 0.0000 170.8624 109 E 4.7941 8.7264 118.4723 55.1991 30.9098 175.6307 110 K 3.7793 9.3246 124.5534 57.1314 33.0486 179.7901 111 H 4.8468 7.9768 120.8804 54.6135 30.9683 172.1834 112 G 3.2137 8.4045 102.5348 45.8748 0.0000 174.4548 113 K 4.2091 7.9560 126.5259 54.8576 32.6584 176.3360 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 8.29 4.45 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 2 E 8.44 4.88 0.00 2.05 1.82 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 2.13 2.34 0.00 3 A 8.83 4.69 1.08 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 0.00 0.00 4 K 8.93 5.40 0.00 1.73 1.73 0.00 1.10 0.00 0.00 2.35 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.24 1.19 7.81 5 A 8.16 4.33 1.16 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 0.00 0.00 6 I 7.70 3.03 1.80 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 1.27 0.40 0.82 0.00 0.00 7 A 8.84 4.48 1.19 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 0.00 0.00 8 R 8.28 4.50 0.00 1.68 1.03 0.00 3.16 0.00 0.00 2.59 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.42 0.00 9 Y 8.33 3.62 0.00 3.19 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 10 V 8.10 3.40 1.82 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 -0.42 0.00 0.00 0.79 0.00 0.00 11 R 8.04 4.07 0.00 1.97 2.04 0.00 3.22 0.00 0.00 3.83 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 12 I 7.36 4.64 2.07 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.20 0.90 0.00 0.00 13 S 8.50 4.41 0.00 3.91 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 14 P 0.00 4.10 0.00 2.20 2.06 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 15 R 8.10 3.91 0.00 1.86 2.03 0.00 3.14 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 16 K 7.99 4.07 0.00 1.96 1.92 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.47 7.81 17 V 7.65 3.89 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 1.08 0.00 0.00 1.02 0.00 0.00 18 R 8.57 3.94 0.00 2.02 2.03 0.00 3.22 0.00 0.00 3.19 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 19 L 7.35 4.04 0.00 1.85 1.78 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.24 3.97 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 0.84 0.00 0.00 0.96 0.00 0.00 21 V 7.86 3.55 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 1.07 0.00 0.00 0.99 0.00 0.00 22 D 8.67 4.44 0.00 2.92 2.74 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 23 L 8.01 4.14 0.00 1.70 1.71 0.94 0.97 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 24 I 7.53 4.25 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.97 0.00 0.00 25 R 7.40 3.93 0.00 1.92 1.95 0.00 3.28 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 26 G 9.03 4.29 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 0.00 27 K 7.61 4.68 0.00 1.80 1.92 0.00 1.92 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.51 7.81 28 S 8.49 4.61 0.00 4.08 4.03 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 29 L 8.49 3.82 0.00 1.90 1.76 0.91 0.92 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 30 E 8.41 3.91 0.00 2.09 1.87 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 2.40 2.39 0.00 31 E 9.15 3.84 0.00 2.04 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 0.00 2.35 2.40 0.00 32 A 8.68 3.98 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 33 R 8.15 3.81 0.00 1.88 1.97 0.00 3.22 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 1.64 1.98 0.00 34 N 7.80 4.59 0.00 2.94 2.99 0.00 0.00 7.13 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 35 I 8.38 3.84 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.27 0.94 0.00 0.00 36 L 8.28 3.98 0.00 1.77 1.70 0.93 0.65 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 37 R 8.25 3.72 0.00 1.73 2.23 0.00 3.03 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.74 0.00 38 Y 7.72 4.65 0.00 3.04 2.94 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 39 T 7.98 4.45 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 1.24 0.00 0.00 40 N 8.56 4.81 0.00 2.69 2.77 0.00 0.00 7.08 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 41 K 7.81 4.39 0.00 1.78 1.64 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.32 7.81 42 R 8.80 3.84 0.00 1.82 1.97 0.00 3.17 0.00 0.00 3.40 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.51 0.00 43 G 8.27 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 44 A 8.21 3.86 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.06 3.49 0.00 2.68 2.38 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 46 F 7.96 4.33 0.00 3.33 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 47 V 8.72 3.57 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 1.04 0.00 0.00 1.02 0.00 0.00 48 A 8.05 3.85 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 49 K 8.19 3.65 0.00 1.34 1.91 0.00 1.56 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.39 1.41 7.81 50 V 7.91 3.71 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 0.82 0.00 0.00 0.86 0.00 0.00 51 L 8.12 3.87 0.00 1.86 1.71 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.40 3.88 0.00 2.10 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 2.29 2.34 0.00 53 S 7.92 4.04 0.00 3.89 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 54 A 8.11 3.87 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 55 A 8.32 3.85 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 56 A 9.04 3.41 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 57 N 6.95 4.04 0.00 3.02 2.84 0.00 0.00 7.10 7.67 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 58 A 8.83 3.79 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 59 V 7.92 3.56 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 1.02 0.00 0.00 0.98 0.00 0.00 60 N 8.45 4.39 0.00 2.87 2.86 0.00 0.00 7.13 8.56 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 61 N 8.96 4.70 0.00 2.77 2.60 0.00 0.00 6.86 8.04 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 62 H 8.33 4.72 0.00 3.12 3.27 0.00 5.85 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 63 D 7.18 4.40 0.00 2.86 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 64 M 7.80 4.27 0.00 1.99 2.28 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 2.61 2.67 0.00 65 L 7.83 3.55 0.00 1.90 1.78 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.20 3.70 0.00 2.04 1.87 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 2.40 2.39 0.00 67 D 7.70 4.52 0.00 2.70 2.73 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 68 R 8.11 4.25 0.00 2.06 1.93 0.00 3.08 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 69 L 8.44 5.44 0.00 1.89 1.87 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 9.37 5.24 0.00 3.19 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 71 V 8.36 3.88 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 1.04 0.00 0.00 72 K 8.36 3.56 0.00 1.43 1.75 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.34 7.81 73 A 7.66 4.93 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 74 A 8.57 5.14 1.11 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 75 Y 7.36 4.88 0.00 3.00 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 76 V 8.59 4.96 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 0.80 0.00 0.00 0.95 0.00 0.00 77 D 8.86 5.11 0.00 2.63 2.53 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 78 E 8.84 4.22 0.00 1.94 1.82 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 2.27 2.35 0.00 79 G 8.74 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 0.00 0.00 0.00 0.00 80 P 0.00 4.49 0.00 2.23 2.14 0.00 4.04 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 81 A 8.47 4.18 1.25 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 0.00 0.00 0.00 82 L 8.85 4.31 0.00 1.74 1.61 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.68 4.64 0.00 1.63 1.76 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.45 7.81 84 R 8.87 4.72 0.00 1.67 1.80 0.00 3.29 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 85 V 8.32 4.20 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 0.73 0.00 0.00 0.93 0.00 0.00 86 L 9.22 4.66 0.00 1.70 1.47 0.92 0.94 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 87 P 0.00 4.67 0.00 1.98 1.96 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 88 R 8.39 4.84 0.00 1.68 1.81 0.00 3.29 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 89 A 8.51 4.02 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 90 R 9.11 3.87 0.00 1.93 1.99 0.00 3.36 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 91 G 7.24 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 92 R 7.89 3.83 0.00 1.94 1.95 0.00 3.35 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 93 A 7.95 3.61 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 94 D 8.79 4.90 0.00 2.63 2.60 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 0.00 95 I 8.03 4.81 1.87 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 1.23 0.64 0.91 0.00 0.00 96 I 8.50 4.07 1.87 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 1.29 1.39 0.91 0.00 0.00 97 K 8.42 5.01 0.00 1.76 1.79 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.43 7.81 98 K 8.69 4.12 0.00 1.74 1.81 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.57 7.81 99 R 8.53 4.81 0.00 1.77 2.06 0.00 3.12 0.00 0.00 3.53 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 100 T 8.11 4.74 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 1.36 0.00 0.00 101 S 8.80 5.14 0.00 3.71 3.68 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 0.00 102 H 9.14 5.25 0.00 3.04 3.08 0.00 5.62 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.76 4.47 1.82 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.70 0.88 0.00 0.00 104 T 8.38 4.65 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 0.58 0.00 0.00 105 V 8.23 4.65 1.97 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 0.94 0.00 0.00 0.83 0.00 0.00 106 I 8.53 4.79 1.79 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 1.39 0.66 0.81 0.00 0.00 107 L 8.51 5.24 0.00 1.53 1.57 0.82 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.79 4.53 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 0.00 0.00 0.00 109 E 8.73 4.79 0.00 1.91 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 2.27 2.32 0.00 110 K 9.32 3.78 0.00 1.50 1.49 0.00 0.93 0.00 0.00 0.71 0.00 0.00 2.94 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.30 7.81 111 H 7.98 4.85 0.00 3.20 3.16 0.00 5.57 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.40 3.21 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 0.00 113 K 7.96 4.21 0.00 1.74 1.53 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.23 0.95 7.81