NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4715 8.1776 115.2900 57.8772 63.6205 174.4841 3 V 3.3582 8.3081 128.4426 64.6576 30.9506 176.8002 4 Y 3.9455 8.5988 118.3012 60.9050 37.9955 178.9424 5 D 4.4009 7.8332 118.7142 57.0498 41.2222 178.3492 6 A 4.0737 8.1623 121.3113 55.0855 18.4870 179.5701 7 A 3.8827 8.2032 119.1528 55.0089 18.1893 179.3893 8 A 4.1220 7.4960 117.9855 54.3861 18.5537 179.0503 9 Q 4.2527 7.7631 115.4114 56.6621 29.9700 177.0385 10 L 4.2165 7.3243 121.2213 53.7460 40.1512 177.0270 11 T 4.2244 7.6720 114.7621 60.3180 71.6198 175.0760 12 A 3.9544 8.4457 121.9504 55.6757 18.2166 179.4986 13 D 4.2930 7.9916 116.6886 57.4117 40.9523 179.0831 14 V 3.5062 7.3694 117.5388 65.9267 31.5215 178.2478 15 K 3.8661 8.2868 118.6261 59.1921 31.7448 179.2745 16 K 3.9563 8.0913 119.9150 59.7239 32.2093 178.7089 17 D 4.6017 8.1587 119.1706 57.2303 40.6487 178.8625 18 L 3.7156 7.9680 119.6252 57.7448 41.5832 179.7328 19 R 4.0663 8.1417 118.0304 59.4304 29.4537 178.8757 20 D 4.4799 8.5948 119.2864 57.4967 40.8433 179.0621 21 S 3.4262 8.2724 114.7087 60.7340 63.1191 176.3152 22 W 4.2654 8.6559 132.0969 60.0202 30.1957 177.6655 23 K 3.8397 7.9192 119.1917 59.2908 31.7489 178.5810 24 V 3.7013 7.0320 114.8684 65.7244 31.4473 178.1494 25 I 3.3890 7.4378 119.5819 64.1979 36.9654 178.3816 26 G 2.2514 6.8729 107.2399 46.2404 0.0000 174.5837 27 S 4.0962 7.1558 113.9511 60.1285 63.5780 174.2863 28 D 4.6386 7.3002 120.4853 51.2211 41.0562 175.4321 29 K 3.8102 7.9504 123.0633 58.6397 32.4805 178.4171 30 K 3.9931 7.9505 119.5016 59.4057 32.3299 178.9396 31 G 3.7220 8.0359 106.6804 47.5912 0.0000 175.2691 32 N 4.4802 8.3025 119.5694 55.2039 38.5773 178.0340 33 G 3.4782 8.1314 107.6679 47.7695 0.0000 176.0908 34 V 3.5817 7.7672 120.7817 65.4452 31.5200 177.9552 35 A 4.0128 7.8435 121.9708 54.3299 18.1645 179.3819 36 L 3.7238 7.9016 118.8341 58.5017 42.1801 179.2132 37 M 3.4601 7.7071 118.6517 58.3976 31.5678 178.9206 38 T 3.9400 8.0666 110.2695 65.0403 68.7123 176.7325 39 T 3.8989 7.7126 118.6632 66.1274 68.3714 176.4219 40 L 3.8010 7.5275 122.2861 58.3198 41.8444 179.2105 41 F 4.4895 7.4828 116.0761 60.3455 38.8400 177.3277 42 A 4.2039 7.9108 120.0156 55.1524 18.3729 179.0025 43 D 4.5943 8.2698 116.4220 55.6251 42.6826 176.7950 44 N 5.1702 8.2815 116.2718 50.8209 39.1300 174.7294 45 Q 4.2132 8.2181 120.4758 58.8539 29.4399 178.9225 46 E 4.2554 8.2537 113.6161 57.7849 30.0946 177.2008 47 T 4.6277 8.1551 109.9452 62.3471 70.2095 176.7595 48 I 3.7558 7.9246 123.7968 64.4450 37.3525 178.2670 49 G 3.6432 8.1581 108.0797 48.8086 0.0000 174.2564 50 Y 4.2501 7.6189 116.2750 60.2553 38.1182 176.6193 51 F 4.8694 8.2037 118.4627 56.9943 39.7752 178.0224 52 K 3.8850 8.3451 123.3126 59.7280 32.0190 179.3053 53 R 3.9608 8.0124 117.5326 59.1478 30.0643 177.1346 54 L 4.2256 7.9807 116.0893 55.1585 42.7242 179.0470 55 G 3.8065 7.7599 106.3290 46.3503 0.0000 176.3136 56 D 4.4990 8.3673 120.4203 53.4266 40.7469 177.0332 57 V 3.7695 7.9338 120.3619 63.0834 31.5104 177.5736 58 S 4.3429 7.8965 113.0845 60.4154 63.2343 175.7056 59 Q 4.1493 8.2023 121.5873 55.6318 28.9302 177.2546 60 G 3.8261 8.6433 109.0148 46.3783 0.0000 177.0100 61 M 3.9893 8.9868 123.2775 58.0725 31.9527 176.8543 62 A 4.0142 7.6823 120.0150 53.8257 18.8998 177.2231 63 N 4.6359 8.1638 115.3588 52.5911 39.4421 175.0524 64 D 4.3891 8.6703 129.1878 57.5387 41.0253 178.9798 65 K 4.0326 8.1157 118.4860 59.3119 32.0664 179.0555 66 L 4.0580 8.6313 121.0555 57.9897 41.9471 179.0383 67 R 4.0017 8.3536 119.0478 59.3518 30.1628 178.7524 68 G 3.6291 8.3334 105.7056 47.9978 0.0000 175.1784 69 H 4.2209 8.4690 120.6923 59.2023 29.7285 177.5929 70 S 4.0742 8.2599 116.0603 61.5841 62.8034 176.4798 71 I 3.9032 8.0015 122.5654 64.8050 37.0291 178.6219 72 T 4.0601 7.9205 116.3608 66.5826 68.2883 176.3794 73 L 3.8599 8.0411 122.3009 58.4481 42.0939 179.0297 74 M 4.1899 7.8985 118.4153 58.2664 31.8433 177.9808 75 Y 4.0723 7.8916 115.8435 59.9446 38.1141 177.6979 76 A 3.6642 7.6078 122.3612 54.7271 18.3160 179.6386 77 L 3.5284 7.3264 117.0587 57.5566 41.6591 179.2187 78 Q 3.4912 7.8000 119.5865 58.8570 28.7498 177.7554 79 N 4.2816 7.7090 116.9734 56.8246 39.4454 176.3076 80 F 4.6408 7.7346 118.9157 60.9334 39.0480 177.7275 81 I 3.5704 7.6713 119.1660 64.5786 36.6577 178.2957 82 D 4.5064 8.1477 118.1728 56.5219 40.7783 177.7113 83 Q 4.4728 7.6979 117.0144 55.8310 28.7764 177.2919 84 L 3.9937 7.5641 121.4001 57.9019 41.6270 178.2790 85 D 4.3331 8.0937 117.7588 56.1040 41.2217 175.8366 86 N 4.8244 7.9079 117.7793 50.7171 40.3826 172.6573 87 P 4.2303 0.0000 0.0000 66.2693 31.0902 177.9825 88 D 4.4345 8.2034 117.9449 57.1928 40.7876 178.1835 89 D 4.4273 8.3998 119.5053 56.8145 40.8657 178.5508 90 L 3.9512 8.0605 121.0772 58.0993 42.0269 179.1765 91 V 3.3837 7.8878 118.5310 66.0979 31.3099 177.8180 92 C 4.1295 7.9300 113.8712 61.1400 29.4516 176.1762 93 V 3.7008 7.7173 114.6723 63.8914 31.2066 178.6138 94 V 3.7931 8.0367 118.2720 66.1544 31.4856 178.0344 95 E 3.9165 8.4353 118.4740 58.9114 28.8136 179.3191 96 K 3.8444 7.6394 120.1054 59.6029 31.9724 179.0052 97 F 4.7738 8.4020 119.0008 59.6510 38.7917 177.6429 98 A 3.9736 8.2796 121.0728 55.1100 18.1345 179.7527 99 V 3.5839 7.7350 116.3677 66.2817 31.3411 177.9944 100 N 4.3858 7.9244 114.8832 56.3166 38.3294 176.6552 101 H 4.4476 7.9377 116.7694 57.8541 29.2961 177.6618 102 I 3.7576 8.2315 122.5625 64.4730 36.7040 178.4223 103 T 4.0231 7.8579 109.4252 63.8596 68.6416 175.7802 104 R 4.3546 6.9087 118.7458 54.8621 30.5121 175.9784 105 K 3.8194 7.8294 116.9778 57.5427 29.9503 175.6242 106 I 4.0337 7.5739 120.1623 59.9343 38.0227 177.1420 107 S 4.5300 8.3752 120.7177 57.2921 65.6284 174.8954 108 A 3.9904 8.4375 123.0805 55.2055 17.8301 179.7148 109 A 3.9919 7.9042 117.9709 55.4885 18.8831 179.3055 110 E 4.1533 8.2720 116.8459 59.2756 29.5256 179.2568 111 F 4.1672 8.6342 121.2180 61.0791 39.4819 177.1324 112 G 3.8737 8.3449 104.6603 46.7017 0.0000 175.1493 113 K 4.2167 7.9857 120.5917 58.3360 32.0655 178.3918 114 I 3.4787 7.6203 119.1816 63.0729 37.8670 177.2455 115 N 4.4732 8.1938 117.9586 56.2637 38.2896 177.3307 116 G 3.5813 7.6364 106.8107 47.4827 0.0000 173.9444 117 P 4.2055 0.0000 0.0000 65.0314 31.2662 178.7326 118 I 3.5176 7.7741 118.5813 64.2139 36.9294 178.3462 119 K 3.9405 8.0813 120.3709 59.4797 32.0578 179.0449 120 K 3.9565 8.0162 118.7906 59.3981 31.7495 179.6000 121 V 3.5352 7.7964 117.8386 65.8182 31.7035 177.7691 122 L 4.0798 8.1288 118.7690 57.8389 41.5290 179.3260 123 A 4.2783 8.5627 122.4352 54.5761 18.0798 179.6564 124 S 4.2645 7.9959 111.3491 60.3213 63.0592 175.7814 125 K 4.4491 7.6998 120.7730 55.4276 32.4063 175.2371 126 N 4.1151 8.0898 116.0290 54.7985 37.6181 173.8835 127 F 4.5270 8.1496 115.4077 55.1280 41.0425 175.7554 128 G 4.2859 8.6251 114.9923 44.0808 0.0000 172.2005 129 D 4.4984 8.9219 118.6669 57.5889 40.6092 178.6247 130 K 3.7733 8.1748 119.3632 60.0731 32.0987 178.2453 131 Y 4.1822 8.0662 115.9431 60.8417 37.9486 177.7797 132 A 4.2392 8.2402 121.9030 55.3628 18.2657 179.4833 133 N 4.3849 8.5333 114.3828 56.1862 38.7842 177.2861 134 A 4.0825 7.7882 122.4874 55.0710 18.4818 179.8251 135 W 3.8901 8.5205 117.1725 59.6128 29.0688 178.6727 136 A 4.1187 8.1906 121.0324 54.9812 17.5365 179.8287 137 K 3.9837 7.6201 116.2966 59.2488 32.3615 179.0796 138 L 3.9509 7.6166 120.4179 58.0464 42.1690 178.9260 139 V 3.7924 8.1667 118.0863 65.9698 31.4643 177.8230 140 A 4.5151 8.0094 121.7763 54.2455 17.8871 179.7898 141 V 3.4290 7.3835 116.6663 65.9702 31.8186 178.1239 142 V 3.4948 7.4832 117.5984 65.9428 31.3300 177.7848 143 Q 3.8273 8.1115 117.5932 58.9028 28.3285 178.7049 144 A 4.0548 7.8148 120.1321 53.9209 18.4525 178.3346 145 A 4.3944 7.5486 117.2957 51.9265 19.6025 176.9488 146 L 4.1234 7.4303 122.9123 54.7709 41.8560 176.5081 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 S 8.18 4.47 0.00 3.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.31 3.36 1.89 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 0.21 0.00 0.00 0.68 0.00 0.00 4 Y 8.60 3.95 0.00 3.03 3.04 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 5 D 7.83 4.40 0.00 2.79 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 6 A 8.16 4.07 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 7 A 8.20 3.88 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 8 A 7.50 4.12 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.76 4.25 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.24 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 10 L 7.32 4.22 0.00 1.68 1.54 0.78 0.68 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 11 T 7.67 4.22 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 1.18 0.00 0.00 12 A 8.45 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.99 4.29 0.00 2.66 2.69 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 0.00 0.00 0.00 0.00 14 V 7.37 3.51 2.21 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 0.91 0.00 0.00 0.87 0.00 0.00 15 K 8.29 3.87 0.00 1.92 1.80 0.00 1.68 0.00 0.00 1.52 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.59 7.81 16 K 8.09 3.96 0.00 2.03 1.96 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.78 7.81 17 D 8.16 4.60 0.00 2.83 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 18 L 7.97 3.72 0.00 1.64 1.23 0.54 -0.66 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 19 R 8.14 4.07 0.00 2.05 2.06 0.00 3.16 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 1.68 1.87 0.00 20 D 8.59 4.48 0.00 2.97 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 21 S 8.27 3.43 0.00 3.43 3.56 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 0.00 0.00 0.00 0.00 22 W 8.66 4.27 0.00 3.83 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.92 3.84 0.00 1.85 2.02 0.00 1.88 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.45 7.81 24 V 7.03 3.70 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 1.04 0.00 0.00 1.08 0.00 0.00 25 I 7.44 3.39 1.53 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.20 0.56 0.00 0.00 26 G 6.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.16 4.10 0.00 3.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.30 4.64 0.00 2.59 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 29 K 7.95 3.81 0.00 1.73 1.69 0.00 1.23 0.00 0.00 0.77 0.00 0.00 2.19 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.24 1.38 7.81 30 K 7.95 3.99 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.04 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 32 N 8.30 4.48 0.00 2.68 2.71 0.00 0.00 6.99 7.10 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 33 G 8.13 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.77 3.58 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 1.06 0.00 0.00 0.95 0.00 0.00 35 A 7.84 4.01 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 36 L 7.90 3.72 0.00 1.73 1.72 0.76 0.72 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 37 M 7.71 3.46 0.00 1.66 1.91 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.68 0.00 38 T 8.07 3.94 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 1.30 0.00 0.00 39 T 7.71 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 1.15 0.00 0.00 40 L 7.53 3.80 0.00 1.47 1.22 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.48 4.49 0.00 3.04 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 42 A 7.91 4.20 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 43 D 8.27 4.59 0.00 2.72 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 44 N 8.28 5.17 0.00 2.97 2.90 0.00 0.00 6.89 8.48 0.00 0.00 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 Q 8.22 4.21 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.98 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 46 E 8.25 4.26 0.00 2.09 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 0.00 2.36 2.30 0.00 47 T 8.16 4.63 4.73 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 1.46 0.00 0.00 48 I 7.92 3.76 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.92 0.71 0.00 0.00 49 G 8.16 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 7.62 4.25 0.00 2.87 2.55 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 51 F 8.20 4.87 0.00 3.13 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.35 3.89 0.00 1.82 1.88 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.73 7.81 53 R 8.01 3.96 0.00 1.79 2.01 0.00 3.26 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.98 4.23 0.00 1.81 1.74 1.03 0.87 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 55 G 7.76 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 56 D 8.37 4.50 0.00 2.70 2.57 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 0.00 0.00 0.00 0.00 57 V 7.93 3.77 1.73 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 0.55 0.00 0.00 0.35 0.00 0.00 58 S 7.90 4.34 0.00 4.05 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 59 Q 8.20 4.15 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.87 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 60 G 8.64 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 8.99 3.99 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 62 A 7.68 4.01 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 63 N 8.16 4.64 0.00 2.79 2.89 0.00 0.00 7.02 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.67 4.39 0.00 2.74 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 65 K 8.12 4.03 0.00 1.98 1.90 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.63 4.06 0.00 1.79 1.87 1.08 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.35 4.00 0.00 2.04 2.06 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.33 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 69 H 8.47 4.22 0.00 3.38 3.64 0.00 5.79 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 70 S 8.26 4.07 0.00 4.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.00 3.90 1.95 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 1.56 1.53 1.14 0.00 0.00 72 T 7.92 4.06 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 73 L 8.04 3.86 0.00 1.65 1.76 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.90 4.19 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.86 0.00 75 Y 7.89 4.07 0.00 3.24 3.04 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 76 A 7.61 3.66 0.35 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 77 L 7.33 3.53 0.00 1.46 1.18 0.87 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.80 3.49 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 79 N 7.71 4.28 0.00 2.96 2.91 0.00 0.00 7.28 7.07 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 80 F 7.73 4.64 0.00 3.09 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.67 3.57 1.65 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.39 0.86 0.00 0.00 82 D 8.15 4.51 0.00 2.82 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 83 Q 7.70 4.47 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 84 L 7.56 3.99 0.00 1.57 1.68 0.79 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 85 D 8.09 4.33 0.00 2.67 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 86 N 7.91 4.82 0.00 2.68 2.69 0.00 0.00 6.87 9.02 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 87 P 0.00 4.23 0.00 2.34 2.31 0.00 3.76 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 2.10 2.08 0.00 88 D 8.20 4.43 0.00 2.92 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 89 D 8.40 4.43 0.00 2.86 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 90 L 8.06 3.95 0.00 1.91 1.75 0.82 0.60 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 91 V 7.89 3.38 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 0.60 0.00 0.00 0.55 0.00 0.00 92 C 7.93 4.13 0.00 3.15 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.72 3.70 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 0.92 0.00 0.00 1.25 0.00 0.00 94 V 8.04 3.79 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 0.94 0.00 0.00 0.42 0.00 0.00 95 E 8.44 3.92 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 96 K 7.64 3.84 0.00 1.72 1.66 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.68 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 1.38 7.81 97 F 8.40 4.77 0.00 3.39 3.23 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 0.00 98 A 8.28 3.97 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 99 V 7.73 3.58 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 1.01 0.00 0.00 0.96 0.00 0.00 100 N 7.92 4.39 0.00 3.22 2.90 0.00 0.00 6.98 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 0.00 101 H 7.94 4.45 0.00 3.36 3.40 0.00 5.82 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 0.00 102 I 8.23 3.76 1.87 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 1.55 1.02 0.90 0.00 0.00 103 T 7.86 4.02 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 104 R 6.91 4.35 0.00 1.85 1.83 0.00 3.32 0.00 0.00 3.44 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 105 K 7.83 3.82 0.00 2.00 1.98 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.59 7.81 106 I 7.57 4.03 1.98 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.67 0.97 0.00 0.00 107 S 8.38 4.53 0.00 4.07 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 0.00 108 A 8.44 3.99 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 0.00 109 A 7.90 3.99 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 0.00 110 E 8.27 4.15 0.00 2.13 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 0.00 2.43 2.41 0.00 111 F 8.63 4.17 0.00 3.26 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 0.00 112 G 8.34 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.99 4.22 0.00 1.98 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.71 7.81 114 I 7.62 3.48 1.59 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.07 0.70 0.00 0.00 115 N 8.19 4.47 0.00 2.96 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 0.00 116 G 7.64 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.21 0.00 2.15 1.98 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 118 I 7.77 3.52 1.97 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 1.20 0.73 0.73 0.00 0.00 119 K 8.08 3.94 0.00 1.96 1.97 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.54 7.81 120 K 8.02 3.96 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.60 7.81 121 V 7.80 3.54 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.88 0.00 0.00 122 L 8.13 4.08 0.00 1.96 1.96 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.56 4.28 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 0.00 124 S 8.00 4.26 0.00 4.05 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 0.00 125 K 7.70 4.45 0.00 2.11 1.99 0.00 1.81 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.64 1.52 7.81 126 N 8.09 4.12 0.00 2.74 2.60 0.00 0.00 6.90 6.46 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 0.00 127 F 8.15 4.53 0.00 3.25 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 0.00 128 G 8.63 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 0.00 129 D 8.92 4.50 0.00 2.81 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.17 3.77 0.00 1.72 1.65 0.00 1.55 0.00 0.00 1.38 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.92 1.33 7.81 131 Y 8.07 4.18 0.00 3.45 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 0.00 132 A 8.24 4.24 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 0.00 133 N 8.53 4.38 0.00 2.85 2.91 0.00 0.00 7.02 6.98 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 0.00 134 A 7.79 4.08 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 0.00 135 W 8.52 3.89 0.00 3.63 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.19 4.12 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 0.00 0.00 0.00 0.00 0.00 137 K 7.62 3.98 0.00 1.82 1.82 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.61 7.81 138 L 7.62 3.95 0.00 1.49 1.74 0.62 0.63 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 0.00 139 V 8.17 3.79 2.34 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 1.19 0.00 0.00 1.15 0.00 0.00 140 A 8.01 4.52 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 0.00 141 V 7.38 3.43 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 0.60 0.00 0.00 0.82 0.00 0.00 142 V 7.48 3.49 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 0.25 0.00 0.00 0.82 0.00 0.00 143 Q 8.11 3.83 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 144 A 7.81 4.05 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.55 4.39 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 0.00 146 L 7.43 4.12 0.00 1.70 1.51 0.50 0.62 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