NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3841 8.3044 120.3261 55.7249 32.5621 174.8220 2 H 4.3995 7.9019 120.0954 53.8630 29.0316 170.4422 3 L 4.5723 7.6116 122.8605 52.8005 43.6795 177.2218 4 T 4.0610 8.5845 115.0865 60.6230 70.9459 173.6427 5 P 4.1768 0.0000 0.0000 66.0836 31.4260 178.9190 6 E 4.0367 8.0808 116.5694 59.1010 29.3285 179.1266 7 E 3.9116 7.9081 118.5796 59.2576 29.5250 179.2288 8 K 3.8640 8.2299 120.0019 59.2217 32.1735 179.0162 9 S 4.1537 8.0717 114.4774 60.9774 63.1477 176.2390 10 A 3.9594 7.8953 124.3357 54.9380 18.1630 179.7666 11 V 3.4114 7.8583 116.6885 66.4793 31.5970 178.4067 12 T 3.9706 7.8990 115.2220 66.4771 68.0574 176.2143 13 A 3.9934 8.3693 121.8784 55.3963 18.6115 179.1289 14 L 3.8894 7.9932 118.2673 58.0896 42.2617 178.9641 15 W 4.3731 8.7586 128.3896 60.4695 30.3420 178.0164 16 G 3.7918 8.1583 104.9561 47.0563 0.0000 174.7459 17 K 4.3751 7.9511 118.3482 55.5733 33.0098 176.9530 18 V 3.5914 6.9580 120.1700 62.2744 32.0849 175.8041 19 N 4.5565 8.2344 124.9667 52.4420 39.0130 175.9467 20 V 3.5075 8.0404 122.7962 64.0844 31.6265 178.0452 21 D 4.3422 8.1129 118.3844 57.4679 40.7829 178.4000 22 E 3.8697 8.1076 119.2112 59.3501 29.6675 179.0195 23 V 3.5867 8.0226 118.6539 65.5030 31.4975 178.2239 24 G 3.6989 8.4786 106.2809 47.7838 0.0000 175.8566 25 G 3.6253 7.8061 108.5801 47.3990 0.0000 175.5823 26 E 3.9293 8.1211 120.7842 59.0106 29.4956 179.4193 27 A 3.9142 8.0824 120.8102 54.9950 18.5882 179.4437 28 L 3.9685 7.8897 119.0133 58.1190 42.1656 179.2526 29 G 3.6251 8.1089 105.6337 48.1546 0.0000 175.8991 30 R 3.9204 8.2473 121.3667 58.3987 29.9647 178.8759 31 L 4.0215 8.0128 120.3409 58.3725 42.0629 179.1929 32 L 4.0325 7.7780 118.2424 57.3025 41.2515 179.7315 33 V 3.5147 7.4708 117.7547 65.9460 31.6876 178.0793 34 V 3.4681 7.6691 116.8205 64.4878 32.7750 175.6662 35 Y 3.8473 7.2143 115.0599 54.4295 37.9151 174.2660 36 P 4.6282 0.0000 0.0000 64.4925 31.8621 178.1966 37 W 4.3783 7.9904 115.1079 59.2693 28.2739 177.7538 38 T 4.2914 7.8502 110.4595 63.6381 68.1492 175.7837 39 Q 4.4982 8.2261 121.5589 57.7656 28.5261 177.9110 40 R 3.7473 7.5101 116.7750 58.6726 29.2725 177.8250 41 F 4.3450 7.0053 114.9042 57.3436 39.5850 175.6878 42 F 4.5000 7.8286 118.9552 56.6859 40.0713 177.2367 43 E 4.0434 8.2523 121.0914 59.1343 29.7306 178.2111 44 S 4.4657 8.0371 111.7250 59.3825 63.2912 174.4776 45 F 4.6538 8.4316 119.7272 58.1146 39.9008 177.2336 46 G 3.9605 7.6102 106.8770 44.9211 0.0000 174.2384 47 D 4.4819 8.6270 125.0111 54.4850 41.2481 175.8382 48 L 4.9105 8.3577 125.9978 54.4910 43.1897 177.9308 49 S 4.3317 8.2685 116.1105 60.3787 63.5534 174.4563 50 T 4.7405 7.4487 110.3351 58.2308 73.0958 172.6486 51 P 4.2092 0.0000 0.0000 66.1708 31.4202 178.7884 52 D 4.4593 8.0757 116.7088 57.0845 40.5380 178.4910 53 A 3.9947 7.6558 120.3489 54.9938 18.5107 179.6753 54 V 3.6862 7.9317 116.6985 66.5748 31.5123 178.3663 55 M 4.1913 8.4445 117.5126 57.4453 31.8598 177.9687 56 G 4.0376 7.6294 102.9720 43.3674 0.0000 173.7699 57 N 4.3420 7.5285 121.2790 53.0932 39.8669 173.5604 58 P 4.2394 0.0000 0.0000 65.8991 31.3782 178.6890 59 K 3.6991 8.1003 118.4270 58.8803 31.7001 179.5451 60 V 3.6372 7.6520 118.2122 65.9179 31.5760 178.1374 61 K 3.9354 8.1259 118.0704 59.3744 31.8999 179.2899 62 A 3.9916 7.9670 121.1691 55.3320 18.2043 179.2133 63 H 4.3690 8.5465 117.1293 59.2574 29.9140 177.6502 64 G 3.6202 8.4500 108.0214 47.7607 0.0000 175.4696 65 K 3.9436 8.0568 122.1207 59.0365 32.1751 178.8643 66 K 3.9734 7.8695 119.4682 59.4661 32.2143 178.9672 67 V 3.6362 7.9826 118.7544 66.1865 31.3894 177.9850 68 L 4.3827 8.3900 118.7470 57.2139 41.4870 179.6245 69 G 3.7217 8.4709 106.0023 47.9342 0.0000 175.7138 70 A 4.1774 8.1932 123.5660 54.5392 18.1142 179.6043 71 F 4.2496 8.1410 118.7102 61.5858 39.7561 177.0371 72 S 4.2678 8.7994 115.2132 62.0894 62.8977 176.5099 73 D 4.4755 8.2835 121.3513 57.4791 40.4756 179.2805 74 G 3.4686 7.8518 105.5732 47.4428 0.0000 175.2897 75 L 3.8726 7.5479 119.2245 56.0793 41.6870 178.0864 76 A 4.3437 7.4041 119.3199 52.4963 19.7570 176.5435 77 H 4.8831 8.0818 115.2479 54.7782 29.7999 175.5352 78 L 3.8861 7.9821 119.9566 57.5633 41.8253 178.5456 79 D 4.5361 7.8871 116.2179 55.4255 42.0260 175.9479 80 N 5.0013 8.1813 118.3829 51.4630 39.4533 174.9474 81 L 3.9859 7.8566 123.1575 57.8470 42.1514 179.2462 82 K 3.9441 8.0802 116.8403 59.5895 32.1948 179.0129 83 G 3.7356 7.9955 105.2501 48.2119 0.0000 175.7021 84 T 3.6759 7.6522 117.1275 65.5787 68.6698 175.7156 85 F 4.7971 7.8289 116.8687 57.0330 39.2912 177.3837 86 A 4.0773 7.7719 123.2301 55.7490 18.2441 180.5184 87 T 3.9013 7.8866 107.6183 64.8729 68.7934 176.5530 88 L 4.0890 7.9651 121.4364 57.4675 41.7564 178.9429 89 S 4.4139 8.5528 114.8649 60.9594 62.3502 176.1482 90 E 3.8730 8.2068 120.9976 59.2684 29.2042 179.1279 91 L 3.9088 7.9618 120.2501 58.6369 42.2130 178.8295 92 H 4.1887 8.6338 116.4300 58.8283 28.7213 177.3644 93 C 3.4908 7.7636 120.5803 62.3973 31.1521 175.3221 94 D 4.4069 8.2851 119.7678 56.0886 40.6257 177.6812 95 K 4.2212 7.7040 117.4099 57.9141 33.0938 177.6992 96 L 4.1781 7.6552 115.8009 54.7769 42.4708 176.0684 97 H 4.1207 7.1862 113.6888 56.6653 26.4507 175.5299 98 V 3.7540 7.8098 118.9191 61.0194 31.9693 174.7466 99 D 4.2935 8.8464 127.3621 54.0824 41.4165 175.2992 100 P 3.2466 0.0000 0.0000 64.8213 31.7858 177.9874 101 E 3.8929 8.0849 118.5539 59.2756 29.2436 178.5105 102 N 4.2980 8.0628 116.7594 56.1861 38.4847 177.2871 103 F 4.4728 7.3519 119.3135 60.5456 38.9911 177.9891 104 R 3.9868 7.9287 117.3766 59.1098 30.0012 178.8002 105 L 3.7995 7.8543 118.8129 57.7480 41.5697 179.3739 106 L 4.1085 8.1963 120.3952 57.9553 41.9916 179.1923 107 G 3.6954 8.1991 105.7830 47.9421 0.0000 175.4560 108 N 4.4345 8.1347 118.9944 56.0373 38.6104 177.7112 109 V 3.6484 7.9317 119.6797 65.8982 31.5286 177.7879 110 L 3.9062 8.3103 120.5952 57.9875 41.9057 179.1028 111 V 3.5882 7.9726 118.1966 66.3468 31.4567 177.8016 112 C 4.1484 8.1072 116.4244 62.7907 27.9105 176.3857 113 V 3.5284 7.7598 119.8614 65.8933 31.0856 178.1066 114 L 3.7935 7.8833 118.6771 57.5841 41.3282 179.3906 115 A 3.6823 7.3809 120.6929 55.1826 18.0638 179.1900 116 H 4.1204 8.0121 116.0695 59.7358 30.0149 176.9702 117 H 4.0001 7.9594 116.9748 58.1058 28.8004 176.9766 118 F 4.6850 8.3379 118.0042 56.7765 39.6956 177.2340 119 G 3.8169 8.7292 108.5259 45.8790 0.0000 176.8119 120 K 3.8978 9.0163 121.1621 59.7318 32.2900 177.9672 121 E 4.0489 8.0036 119.2907 58.4295 29.7474 177.0251 122 F 4.6639 8.0625 122.7180 57.0187 37.8471 175.5573 123 T 4.2072 7.5318 115.9102 59.9155 71.2211 173.4321 124 P 4.1591 0.0000 0.0000 65.6850 31.4418 177.1717 125 P 4.1897 0.0000 0.0000 65.4129 31.2423 178.9121 126 V 3.5463 7.4248 117.2630 65.7533 31.3455 177.6983 127 Q 3.4577 7.7805 119.4003 59.1910 28.8024 178.1192 128 A 3.9770 8.1006 121.4846 55.3095 18.3139 179.5565 129 A 3.8747 7.8706 118.4796 55.6413 18.4596 179.5558 130 Y 3.9114 8.1615 115.1797 61.1699 37.8906 178.9495 131 Q 4.1478 8.6505 119.6667 58.8619 28.7367 178.7979 132 K 3.9985 7.9517 119.3045 59.2611 31.9712 179.6180 133 V 3.4757 7.8097 118.4728 66.1997 31.4274 178.5906 134 V 3.7952 8.3688 112.3566 64.3085 31.2670 178.4710 135 A 4.1136 8.1853 120.7985 55.0593 18.2393 179.8911 136 G 3.5166 8.3125 104.4605 47.9835 0.0000 176.1261 137 V 3.4351 8.1034 120.9402 65.4675 31.3775 177.9771 138 A 3.9304 8.3177 120.9373 55.2610 18.0130 179.3875 139 N 4.2939 8.2795 114.0702 56.3934 38.7534 177.2456 140 A 4.1778 8.1256 122.2493 55.0824 18.1132 179.5334 141 L 3.8789 8.0087 116.7011 56.5996 41.5820 178.3605 142 A 4.5611 7.6023 120.0945 52.7199 19.1786 178.4354 143 H 4.4092 8.0425 113.5883 57.8560 28.7514 176.2982 144 K 4.3268 7.9628 119.3474 56.3749 32.0923 176.5307 145 Y 4.1981 8.0488 117.9224 58.4248 38.4407 175.6316 146 H 4.4505 8.2918 117.2601 56.2127 28.2443 173.3369 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 8.30 4.38 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 7.90 4.40 0.00 3.16 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.61 4.57 0.00 1.56 1.50 0.84 0.83 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 4 T 8.58 4.06 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 1.22 0.00 0.00 5 P 0.00 4.18 0.00 2.15 2.12 0.00 3.56 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 2.09 2.15 0.00 6 E 8.08 4.04 0.00 1.95 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 0.00 2.38 2.33 0.00 7 E 7.91 3.91 0.00 2.23 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 2.29 2.27 0.00 8 K 8.23 3.86 0.00 1.74 1.92 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.37 7.81 9 S 8.07 4.15 0.00 4.12 4.21 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 10 A 7.90 3.96 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 11 V 7.86 3.41 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 0.59 0.00 0.00 0.38 0.00 0.00 12 T 7.90 3.97 4.34 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 1.26 0.00 0.00 13 A 8.37 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 14 L 7.99 3.89 0.00 1.98 1.95 0.20 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.76 4.37 0.00 3.82 3.22 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 16 G 8.16 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 17 K 7.95 4.38 0.00 1.98 2.06 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.44 7.81 18 V 6.96 3.59 1.15 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 0.12 0.00 0.00 0.69 0.00 0.00 19 N 8.23 4.56 0.00 2.71 2.76 0.00 0.00 7.20 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 8.04 3.51 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 0.79 0.00 0.00 1.01 0.00 0.00 21 D 8.11 4.34 0.00 2.93 2.70 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 22 E 8.11 3.87 0.00 1.97 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 2.25 2.29 0.00 23 V 8.02 3.59 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 0.81 0.00 0.00 0.63 0.00 0.00 24 G 8.48 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 25 G 7.81 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.12 3.93 0.00 2.09 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 0.00 2.31 2.48 0.00 27 A 8.08 3.91 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 28 L 7.89 3.97 0.00 1.77 1.63 0.91 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.11 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.25 3.92 0.00 1.89 1.94 0.00 3.08 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 31 L 8.01 4.02 0.00 1.87 1.87 0.97 0.56 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 32 L 7.78 4.03 0.00 1.85 1.68 0.71 0.82 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 33 V 7.47 3.51 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 0.71 0.00 0.00 0.90 0.00 0.00 34 V 7.67 3.47 1.57 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 -0.11 0.00 0.00 0.80 0.00 0.00 35 Y 7.21 3.85 0.00 2.66 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 4.63 0.00 2.23 2.13 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 37 W 7.99 4.38 0.00 3.53 3.46 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 38 T 7.85 4.29 4.43 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 1.14 0.00 0.00 39 Q 8.23 4.50 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 40 R 7.51 3.75 0.00 1.60 1.87 0.00 2.99 0.00 0.00 2.69 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 41 F 7.01 4.35 0.00 1.98 2.42 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 42 F 7.83 4.50 0.00 2.87 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 0.00 0.00 0.00 0.00 43 E 8.25 4.04 0.00 2.16 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 0.00 2.33 2.30 0.00 44 S 8.04 4.47 0.00 4.14 4.12 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 0.00 0.00 0.00 45 F 8.43 4.65 0.00 3.22 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 46 G 7.61 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 47 D 8.63 4.48 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 48 L 8.36 4.91 0.00 1.66 1.62 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.27 4.33 0.00 3.96 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 T 7.45 4.74 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.21 0.00 2.15 2.12 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.08 4.46 0.00 2.67 2.70 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 53 A 7.66 3.99 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 54 V 7.93 3.69 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 1.02 0.00 0.00 1.01 0.00 0.00 55 M 8.44 4.19 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.82 0.00 56 G 7.63 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.53 4.34 0.00 3.00 2.80 0.00 0.00 6.87 8.17 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 58 P 0.00 4.24 0.00 2.23 2.25 0.00 3.70 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.10 3.70 0.00 1.49 0.74 0.00 1.48 0.00 0.00 1.26 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.17 1.23 7.81 60 V 7.65 3.64 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 1.12 0.00 0.00 1.01 0.00 0.00 61 K 8.13 3.94 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.58 7.81 62 A 7.97 3.99 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 63 H 8.55 4.37 0.00 3.55 3.50 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 8.45 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 65 K 8.06 3.94 0.00 1.86 2.00 0.00 1.76 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.47 1.60 7.81 66 K 7.87 3.97 0.00 2.04 2.01 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 7.98 3.64 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 1.01 0.00 0.00 0.90 0.00 0.00 68 L 8.39 4.38 0.00 2.00 1.85 1.08 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.47 3.72 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 0.00 0.00 0.00 70 A 8.19 4.18 1.55 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 71 F 8.14 4.25 0.00 3.19 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 72 S 8.80 4.27 0.00 4.31 4.25 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 73 D 8.28 4.48 0.00 2.93 2.68 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 74 G 7.85 3.47 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 0.00 0.00 0.00 75 L 7.55 3.87 0.00 1.46 1.43 -0.16 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.40 4.34 1.20 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 77 H 8.08 4.88 0.00 3.05 3.12 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.98 3.89 0.00 1.54 1.64 0.78 0.94 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 D 7.89 4.54 0.00 2.61 2.68 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 80 N 8.18 5.00 0.00 2.68 2.59 0.00 0.00 7.07 7.12 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 81 L 7.86 3.99 0.00 1.74 1.80 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.08 3.94 0.00 1.63 1.65 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.46 7.81 83 G 8.00 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 84 T 7.65 3.68 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 0.58 0.00 0.00 85 F 7.83 4.80 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 86 A 7.77 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 87 T 7.89 3.90 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 88 L 7.97 4.09 0.00 2.04 1.86 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.55 4.41 0.00 4.11 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 90 E 8.21 3.87 0.00 2.22 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 2.50 0.00 91 L 7.96 3.91 0.00 1.88 1.86 0.91 0.98 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 92 H 8.63 4.19 0.00 3.68 3.74 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.76 3.49 0.00 1.23 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 94 D 8.29 4.41 0.00 2.64 2.68 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 95 K 7.70 4.22 0.00 1.85 1.78 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.41 7.81 96 L 7.66 4.18 0.00 1.69 1.62 0.71 1.02 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 97 H 7.19 4.12 0.00 3.53 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.81 3.75 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 0.13 0.00 0.00 0.44 0.00 0.00 99 D 8.85 4.29 0.00 2.78 2.77 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 0.00 0.00 0.00 0.00 100 P 0.00 3.25 0.00 1.95 1.83 0.00 3.39 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.59 0.00 101 E 8.08 3.89 0.00 2.05 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 2.32 2.40 0.00 102 N 8.06 4.30 0.00 2.47 2.71 0.00 0.00 6.89 8.57 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 0.00 103 F 7.35 4.47 0.00 3.09 2.88 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 0.00 0.00 0.00 104 R 7.93 3.99 0.00 1.96 1.97 0.00 3.13 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 105 L 7.85 3.80 0.00 1.70 1.34 0.67 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.20 4.11 0.00 1.81 1.87 0.93 0.95 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 0.00 107 G 8.20 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 0.00 108 N 8.13 4.43 0.00 2.96 2.95 0.00 0.00 6.70 7.56 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 0.00 109 V 7.93 3.65 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 1.06 0.00 0.00 1.14 0.00 0.00 110 L 8.31 3.91 0.00 1.75 1.82 0.86 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.97 3.59 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 1.35 0.00 0.00 1.20 0.00 0.00 112 C 8.11 4.15 0.00 3.14 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 0.00 113 V 7.76 3.53 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 0.86 0.00 0.00 0.93 0.00 0.00 114 L 7.88 3.79 0.00 1.13 0.98 0.60 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.38 3.68 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 0.00 116 H 8.01 4.12 0.00 3.21 3.52 0.00 5.77 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 7.96 4.00 0.00 2.63 2.54 0.00 5.71 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 8.34 4.68 0.00 3.23 3.10 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 0.00 119 G 8.73 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 0.00 120 K 9.02 3.90 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.43 7.81 121 E 8.00 4.05 0.00 2.11 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 0.00 2.33 2.30 0.00 122 F 8.06 4.66 0.00 2.99 3.12 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 0.00 0.00 0.00 123 T 7.53 4.21 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 1.32 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.15 0.00 3.58 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 2.12 2.20 0.00 125 P 0.00 4.19 0.00 2.12 2.07 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 126 V 7.42 3.55 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 1.01 0.00 0.00 0.91 0.00 0.00 127 Q 7.78 3.46 0.00 1.62 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 128 A 8.10 3.98 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 0.00 129 A 7.87 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 Y 8.16 3.91 0.00 3.34 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 0.00 131 Q 8.65 4.15 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 132 K 7.95 4.00 0.00 1.90 1.83 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.61 7.81 133 V 7.81 3.48 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 0.94 0.00 0.00 0.70 0.00 0.00 134 V 8.37 3.80 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 1.08 0.00 0.00 1.14 0.00 0.00 135 A 8.19 4.11 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 0.00 136 G 8.31 3.52 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 0.00 137 V 8.10 3.44 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 0.63 0.00 0.00 0.66 0.00 0.00 138 A 8.32 3.93 1.44 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 0.00 0.00 139 N 8.28 4.29 0.00 2.87 2.90 0.00 0.00 7.04 7.87 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 0.00 140 A 8.13 4.18 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 0.00 141 L 8.01 3.88 0.00 0.94 0.60 0.01 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.60 4.56 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 0.00 143 H 8.04 4.41 0.00 3.29 3.69 0.00 5.75 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.96 4.33 0.00 1.74 1.84 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.11 1.48 7.81 145 Y 8.05 4.20 0.00 3.05 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 0.00 146 H 8.29 4.45 0.00 3.21 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