NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.1606 8.3544 109.7861 46.0688 0.0000 173.1192 3 F 4.0269 8.8272 124.4555 55.6858 39.5678 173.6365 4 K 4.5470 8.2089 127.4244 56.4046 34.9874 176.8331 5 G 3.3784 5.3800 109.5741 45.6200 0.0000 176.6973 6 V 3.9705 8.4630 117.6126 60.5101 32.1980 174.9784 7 G 3.8057 7.6429 111.0312 46.7470 0.0000 170.7121 8 T 5.1266 7.5669 116.4911 62.1069 69.9307 174.3292 9 Y 5.2471 9.1928 123.1964 56.3489 43.1980 174.0821 10 E 4.8181 9.4007 121.6195 55.9430 31.4895 175.5864 11 I 4.4869 8.5477 124.8114 59.6715 39.3947 174.5105 12 V 4.8648 8.7665 128.5060 60.0946 34.1613 172.9892 13 P 3.7545 0.0000 0.0000 62.5034 31.8342 176.5792 14 Y 3.8727 8.0692 125.2957 60.8553 38.6868 177.4907 15 Q 4.0412 7.8182 115.5202 57.3580 29.8617 176.1103 16 A 4.6591 7.6296 121.1504 50.0550 19.1142 175.0041 17 P 4.4162 0.0000 0.0000 64.0628 32.2209 178.2302 18 S 4.4707 8.0067 113.3284 59.1535 64.0682 173.3991 19 L 5.3471 8.0646 120.5924 53.3057 44.8675 174.5489 20 N 5.3697 9.1778 117.3805 51.1645 41.5562 172.9983 21 L 4.6545 9.0168 121.6695 55.0087 43.2532 175.0220 22 N 5.4574 9.3997 124.6987 51.7476 42.5734 172.9249 23 A 4.9302 9.1270 128.7706 50.8971 19.4370 176.6182 24 W 4.3743 9.1066 133.6795 59.7088 31.0155 176.1950 25 E 3.6079 8.1839 125.0917 54.9691 27.2678 174.4843 26 G 3.8435 7.3959 105.9448 46.3115 0.0000 173.8323 27 K 4.4692 7.8675 116.8976 54.8651 33.7634 177.3086 28 L 4.2728 8.2443 119.2078 56.4195 42.1108 177.8740 29 E 4.2213 7.9933 118.3453 55.2275 30.0201 174.9938 30 P 3.8635 0.0000 0.0000 63.4923 31.8840 176.4433 31 G 3.9392 8.7044 108.1061 44.8046 0.0000 173.7243 32 A 4.1916 8.0583 121.3775 52.6425 19.4464 178.3096 33 V 4.4948 8.5461 114.2566 60.9255 34.0570 174.9596 34 V 5.0667 8.3672 121.7110 61.5086 33.9739 174.7490 35 R 5.2567 9.0750 125.5075 54.2735 35.0410 174.7088 36 T 4.9234 8.8700 111.2080 62.5785 70.2955 172.8716 37 Y 5.6106 9.0074 122.5575 57.0518 42.9709 173.6610 38 T 3.9864 7.4980 119.8857 64.3920 68.3965 174.0342 39 R 3.8920 8.9417 126.4593 58.5463 30.2591 178.3042 40 G 3.9869 7.9630 102.9703 44.6758 0.0000 172.9881 41 D 4.5282 8.4466 117.5142 56.4974 41.0439 177.3623 42 K 4.6923 7.5463 116.5675 53.7737 36.1566 174.0537 43 P 4.4999 0.0000 0.0000 62.4086 32.2858 176.4388 44 S 4.4421 8.3620 115.1039 57.8529 64.2159 174.9859 45 D 4.2550 8.4422 121.3740 57.1324 40.9829 177.9522 46 N 4.5650 8.0402 114.7400 54.0049 37.6011 175.3521 47 A 5.1638 7.8490 120.2341 50.6755 20.2284 175.8657 48 K 4.8971 7.5537 117.1355 55.7401 35.5984 175.4912 49 W 5.3279 9.2192 122.9198 55.0067 33.4762 174.0635 50 Q 4.8193 9.4658 126.8281 55.1153 30.0885 174.6558 51 V 4.6367 9.2024 128.4349 62.3904 32.9301 174.4880 52 A 5.1148 9.1472 130.3103 49.7964 21.7872 174.6081 53 L 4.4055 8.8931 125.6224 55.3782 42.1986 176.7864 54 V 4.4376 8.5311 118.6190 61.6026 34.0385 175.6239 55 A 4.3278 7.8747 120.2922 51.8944 22.3746 178.0514 56 G 3.9545 9.2570 107.8354 46.2982 0.0000 172.8913 57 S 4.1988 8.7355 110.1648 58.5159 65.3152 175.0018 58 G 3.8138 8.7785 112.2649 45.7732 0.0000 171.1562 59 D 4.3855 8.6813 120.2515 55.0391 40.7747 177.7510 60 S 4.7026 8.7140 124.1842 57.1603 63.2943 174.4580 61 A 4.1786 7.7933 122.3031 53.4770 19.0131 178.1655 62 E 4.8554 8.8395 121.5133 54.6580 33.1085 174.8448 63 Y 5.3204 9.0220 120.5435 56.1975 42.2799 174.9027 64 L 4.6485 8.8651 122.6631 54.5644 43.6992 176.2945 65 I 4.8493 8.6311 122.8799 59.9296 39.4863 173.8302 66 I 5.1915 9.0858 129.1483 59.2505 39.3679 175.1183 67 N 3.7570 9.4789 127.2653 53.6135 39.1853 175.9164 68 V 3.4854 8.0950 126.8813 66.4820 31.7631 177.0553 69 H 4.2739 8.3401 119.3852 58.8020 29.8997 175.9405 70 S 4.1527 7.9289 111.2937 57.6576 63.7353 175.3405 71 G 3.7516 7.9772 107.9414 45.7711 0.0000 173.0823 72 Y 4.3867 7.3547 117.6296 57.3358 39.9052 174.3081 73 F 5.7066 7.9079 117.2127 55.8839 41.0719 175.3328 74 L 4.6265 9.3911 126.4236 56.2428 43.0014 175.9381 75 T 5.2718 9.5322 122.2803 61.9179 73.1057 172.5921 76 A 4.9916 8.5971 127.7878 51.1206 19.4262 177.1374 77 T 4.3952 8.7283 112.2505 62.2060 70.7520 174.8855 78 K 4.6024 7.5689 118.6898 54.3501 36.1241 175.4432 79 E 3.9298 8.7351 121.5095 58.1887 30.2356 177.0456 80 N 4.2658 8.5989 120.3005 54.3334 36.8237 173.2741 81 H 4.9598 7.4839 115.4666 54.1255 34.3885 172.7629 82 I 4.1458 8.0756 123.3909 61.6582 38.6327 175.9569 83 V 4.4664 8.8316 122.5834 61.3108 33.5933 174.7847 84 S 5.1725 8.8893 116.2102 57.6369 67.0563 173.5639 85 T 5.3219 8.9763 109.5122 58.6627 66.8713 171.5632 86 P 4.7453 0.0000 0.0000 62.5671 34.0027 176.5199 87 Q 4.0535 7.9491 121.6033 55.8559 29.3438 174.8499 88 I 4.5209 7.6504 123.3995 59.6182 41.1909 174.0662 89 S 4.4685 8.5867 121.8948 57.8914 63.2220 173.8291 90 P 4.4675 0.0000 0.0000 65.0089 31.2064 176.9759 91 T 4.2526 7.7504 107.8179 61.6625 69.6747 174.0831 92 D 4.4981 8.0958 124.6358 53.2429 41.7503 175.1760 93 P 4.2452 0.0000 0.0000 65.4850 31.7160 178.3776 94 S 4.1218 8.4828 113.3533 60.1904 63.0205 174.8567 95 A 4.9357 7.7880 121.3294 51.0969 19.5359 176.8007 96 R 4.9433 7.5792 116.0068 54.4207 33.1142 175.3759 97 W 5.6804 9.2330 121.7367 55.2613 33.9797 174.1806 98 T 5.0406 9.2127 113.4458 60.2799 71.1505 173.6279 99 I 4.9859 8.5812 123.8100 59.7348 39.6670 174.8767 100 K 4.8696 8.8785 126.5392 53.4822 35.8573 174.3904 101 P 3.9977 0.0000 0.0000 63.0773 31.1637 176.5472 102 A 4.2121 8.5485 126.7722 54.2083 18.8562 177.9098 103 T 4.5668 7.3991 103.3757 59.6268 71.8734 173.8111 104 T 4.0320 8.1805 112.9903 62.9306 69.6006 173.5451 105 H 4.2268 9.3551 116.3734 56.4104 25.8117 174.4261 106 Q 4.7232 7.6718 117.7108 55.7031 31.6767 172.6204 107 Y 4.7332 8.2921 120.4810 57.5596 39.2976 175.6353 108 E 4.8717 8.2824 117.7407 55.7009 32.6369 176.4472 109 V 4.4850 7.1757 118.2238 60.8996 34.1740 174.6372 110 F 5.2747 9.1116 125.4967 55.8908 43.5510 173.9764 111 T 5.1470 8.8814 111.5183 59.8433 71.5668 173.9014 112 I 4.8819 8.3634 123.1155 59.9458 40.3190 173.8487 113 N 5.5145 9.4430 125.8301 51.0907 41.0160 174.2976 114 N 3.9939 9.1279 123.6677 53.0947 39.1202 175.0041 115 K 3.9238 8.3819 127.0648 59.1971 33.2366 176.9955 116 V 3.7860 8.0999 120.4847 61.7758 30.7354 176.0833 117 S 4.1053 8.7888 125.1403 61.6367 62.8214 177.1873 118 E 4.0992 7.9975 116.0610 58.5422 29.5942 177.7768 119 L 4.1356 7.8775 119.2834 55.3717 43.0120 178.8919 120 G 4.0092 7.9759 106.2602 45.8327 0.0000 172.5614 121 Q 5.3155 8.7874 121.5970 53.5292 32.4850 174.8911 122 L 4.6414 8.8742 124.9527 55.7433 43.3299 175.9966 123 T 5.0140 9.0749 122.4465 61.8518 73.1496 173.1984 124 V 4.1469 8.6737 127.0459 61.8044 32.8421 175.4277 125 K 3.8035 8.9406 129.9814 58.2580 32.3980 176.1715 126 D 4.2875 9.3615 123.9345 55.3746 38.3753 173.0197 127 Y 3.5744 7.4953 113.0342 58.7900 36.0135 170.5730 128 S 4.2405 7.9534 114.0935 58.9619 62.8392 173.8780 129 T 4.4630 8.4775 115.4605 61.5489 69.0474 173.2290 130 H 4.7261 7.9898 121.7861 54.3894 31.5130 174.6994 131 S 4.1286 8.2105 119.8784 60.2885 62.5889 174.9037 132 G 3.8410 9.4916 114.4709 45.2806 0.0000 173.2313 133 A 4.2772 7.7837 121.5672 51.1810 19.8175 177.6320 134 D 4.5505 8.6516 121.2034 54.4480 42.5147 175.3607 135 V 4.7175 8.4536 122.5673 61.3697 33.5693 174.7442 136 L 5.2871 9.1846 128.0927 53.0855 45.3041 175.6210 137 S 5.1969 8.9257 116.0578 57.3254 64.4123 173.0997 138 A 5.1831 8.8465 125.8565 49.2996 23.1712 174.7927 139 S 4.2394 8.5318 113.7137 59.2769 63.4661 174.7332 140 A 4.4780 8.6698 126.8763 51.7265 18.3925 177.0434 141 K 4.4304 8.8789 119.8353 55.3366 34.4904 176.2098 142 T 3.3295 8.3040 114.5637 64.3016 66.6110 171.9940 143 A 4.3655 8.1624 122.9991 51.4540 19.3444 179.1844 144 D 4.1409 8.6016 118.8446 57.0970 41.1339 178.1026 145 N 4.5291 8.0279 114.8954 53.3231 37.6798 175.4220 146 Q 5.0452 8.0876 117.1785 54.7843 30.8482 174.6510 147 K 4.8504 7.2051 117.9659 54.4785 35.0902 175.3711 148 W 5.4086 8.8812 122.2061 55.4486 33.9574 173.6651 149 Y 5.2049 9.0704 120.4299 56.6449 40.7556 175.1611 150 F 5.0028 9.0921 120.4917 56.1868 41.0429 173.7774 151 D 5.2507 9.0802 124.2778 53.0029 43.0158 176.0520 152 A 4.7448 8.5245 122.1659 51.2060 22.3102 176.4561 153 K 4.1376 8.7250 121.3443 56.5345 32.4167 176.5254 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 G 8.35 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 F 8.83 4.03 0.00 2.17 2.40 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 4 K 8.21 4.55 0.00 1.80 1.80 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.28 7.81 5 G 5.38 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 0.00 0.00 0.00 6 V 8.46 3.97 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 0.88 0.00 0.00 0.94 0.00 0.00 7 G 7.64 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 8 T 7.57 5.13 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 1.20 0.00 0.00 9 Y 9.19 5.25 0.00 3.09 2.99 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 10 E 9.40 4.82 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.40 0.00 11 I 8.55 4.49 1.48 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.71 0.10 0.00 0.00 12 V 8.77 4.86 2.31 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 1.32 0.00 0.00 1.07 0.00 0.00 13 P 0.00 3.75 0.00 1.80 1.51 0.00 4.10 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.98 0.00 14 Y 8.07 3.87 0.00 2.45 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 15 Q 7.82 4.04 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.12 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 16 A 7.63 4.66 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 17 P 0.00 4.42 0.00 2.13 2.20 0.00 3.70 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 1.93 1.87 0.00 18 S 8.01 4.47 0.00 3.88 4.10 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 19 L 8.06 5.35 0.00 1.63 1.79 0.94 0.76 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 20 N 9.18 5.37 0.00 3.03 3.01 0.00 0.00 7.04 6.21 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 21 L 9.02 4.65 0.00 1.78 1.55 0.56 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 22 N 9.40 5.46 0.00 3.07 3.11 0.00 0.00 6.66 7.08 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 23 A 9.13 4.93 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 24 W 9.11 4.37 0.00 3.41 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 25 E 8.18 3.61 0.00 2.08 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 1.57 2.24 0.00 26 G 7.40 3.84 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 0.00 0.00 0.00 27 K 7.87 4.47 0.00 1.78 1.96 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.52 7.81 28 L 8.24 4.27 0.00 1.64 1.71 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.99 4.22 0.00 1.96 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 0.00 2.33 2.38 0.00 30 P 0.00 3.86 0.00 1.77 0.84 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.65 0.00 31 G 8.70 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.06 4.19 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 33 V 8.55 4.49 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 0.91 0.00 0.00 34 V 8.37 5.07 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 1.03 0.00 0.00 1.14 0.00 0.00 35 R 9.08 5.26 0.00 1.79 1.72 0.00 2.21 0.00 0.00 2.51 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.24 0.00 36 T 8.87 4.92 4.36 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 1.33 0.00 0.00 37 Y 9.01 5.61 0.00 3.41 2.99 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 38 T 7.50 3.99 3.65 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 1.10 0.00 0.00 39 R 8.94 3.89 0.00 1.78 2.03 0.00 3.36 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 40 G 7.96 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 41 D 8.45 4.53 0.00 2.68 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 42 K 7.55 4.69 0.00 1.68 1.65 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.36 7.81 43 P 0.00 4.50 0.00 2.20 2.21 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 44 S 8.36 4.44 0.00 4.02 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 45 D 8.44 4.25 0.00 2.65 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 46 N 8.04 4.56 0.00 2.77 2.92 0.00 0.00 5.94 7.03 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 47 A 7.85 5.16 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 48 K 7.55 4.90 0.00 1.68 1.65 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.50 7.81 49 W 9.22 5.33 0.00 3.33 3.16 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 50 Q 9.47 4.82 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 51 V 9.20 4.64 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 0.56 0.00 0.00 1.15 0.00 0.00 52 A 9.15 5.11 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 53 L 8.89 4.41 0.00 1.74 1.61 0.59 0.96 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 54 V 8.53 4.44 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 0.67 0.00 0.00 0.92 0.00 0.00 55 A 7.87 4.33 1.14 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 0.00 0.00 0.00 0.00 0.00 56 G 9.26 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 0.00 0.00 0.00 57 S 8.74 4.20 0.00 3.94 3.91 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 0.00 0.00 0.00 58 G 8.78 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 59 D 8.68 4.39 0.00 2.68 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 60 S 8.71 4.70 0.00 3.96 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 61 A 7.79 4.18 1.06 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 0.00 0.00 62 E 8.84 4.86 0.00 1.78 1.76 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 0.00 2.17 2.18 0.00 63 Y 9.02 5.32 0.00 2.94 2.83 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 64 L 8.87 4.65 0.00 1.51 1.33 0.29 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 65 I 8.63 4.85 1.65 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 0.69 0.00 0.00 66 I 9.09 5.19 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 1.18 0.00 0.00 67 N 9.48 3.76 0.00 2.49 2.57 0.00 0.00 6.42 7.32 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 68 V 8.09 3.49 2.16 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 0.69 0.00 0.00 0.89 0.00 0.00 69 H 8.34 4.27 0.00 3.06 3.39 0.00 5.96 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 7.93 4.15 0.00 4.06 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 71 G 7.98 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.35 4.39 0.00 2.99 3.01 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 73 F 7.91 5.71 0.00 3.11 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 74 L 9.39 4.63 0.00 1.73 1.53 0.51 -0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 75 T 9.53 5.27 4.48 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 1.28 0.00 0.00 76 A 8.60 4.99 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 77 T 8.73 4.40 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 1.25 0.00 0.00 78 K 7.57 4.60 0.00 1.54 1.62 0.00 1.41 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.32 7.81 79 E 8.74 3.93 0.00 1.95 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 2.53 2.33 0.00 80 N 8.60 4.27 0.00 2.87 2.86 0.00 0.00 6.70 8.21 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 81 H 7.48 4.96 0.00 3.36 3.25 0.00 5.87 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.08 4.15 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.06 0.82 0.00 0.00 83 V 8.83 4.47 2.31 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 0.95 0.00 0.00 0.89 0.00 0.00 84 S 8.89 5.17 0.00 4.03 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 85 T 8.98 5.32 4.52 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 1.63 0.00 0.00 86 P 0.00 4.75 0.00 2.08 2.20 0.00 4.03 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 2.10 2.00 0.00 87 Q 7.95 4.05 0.00 1.66 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 88 I 7.65 4.52 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.77 1.17 0.00 0.00 89 S 8.59 4.47 0.00 3.99 3.84 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 90 P 0.00 4.47 0.00 2.17 2.20 0.00 3.90 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 91 T 7.75 4.25 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 1.23 0.00 0.00 92 D 8.10 4.50 0.00 2.77 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 93 P 0.00 4.25 0.00 2.16 2.23 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.92 0.00 94 S 8.48 4.12 0.00 4.19 4.08 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 95 A 7.79 4.94 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 96 R 7.58 4.94 0.00 1.78 1.75 0.00 3.02 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 97 W 9.23 5.68 0.00 3.25 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 98 T 9.21 5.04 4.35 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 1.32 0.00 0.00 99 I 8.58 4.99 1.47 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.66 -0.39 0.00 0.00 100 K 8.88 4.87 0.00 1.71 1.71 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.59 7.81 101 P 0.00 4.00 0.00 1.86 1.93 0.00 3.78 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 102 A 8.55 4.21 1.07 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 0.00 0.00 0.00 103 T 7.40 4.57 4.18 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 1.11 0.00 0.00 104 T 8.18 4.03 4.05 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 1.17 0.00 0.00 105 H 9.36 4.23 0.00 3.37 3.47 0.00 5.72 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.67 4.72 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.54 0.00 0.00 0.00 0.00 0.00 2.21 2.51 0.00 107 Y 8.29 4.73 0.00 3.01 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 0.00 108 E 8.28 4.87 0.00 2.08 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 0.00 2.38 2.43 0.00 109 V 7.18 4.49 1.79 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 0.65 0.00 0.00 0.86 0.00 0.00 110 F 9.11 5.27 0.00 3.09 2.83 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 0.00 111 T 8.88 5.15 4.31 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 1.26 0.00 0.00 112 I 8.36 4.88 1.43 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.64 0.38 0.00 0.00 113 N 9.44 5.51 0.00 2.67 2.77 0.00 0.00 6.31 6.95 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 0.00 114 N 9.13 3.99 0.00 2.25 2.61 0.00 0.00 7.20 6.37 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 0.00 115 K 8.38 3.92 0.00 1.73 1.87 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.36 7.81 116 V 8.10 3.79 2.06 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 0.92 0.00 0.00 0.82 0.00 0.00 117 S 8.79 4.11 0.00 3.90 3.91 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 0.00 0.00 0.00 118 E 8.00 4.10 0.00 2.06 2.07 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 2.24 2.40 0.00 119 L 7.88 4.14 0.00 1.67 1.71 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 120 G 7.98 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 0.00 0.00 0.00 121 Q 8.79 5.32 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 122 L 8.87 4.64 0.00 1.38 1.27 0.47 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 123 T 9.07 5.01 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 1.09 0.00 0.00 124 V 8.67 4.15 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 0.88 0.00 0.00 0.72 0.00 0.00 125 K 8.94 3.80 0.00 1.84 1.71 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.41 7.81 126 D 9.36 4.29 0.00 2.88 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 0.00 127 Y 7.50 3.57 0.00 3.02 3.11 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 0.00 128 S 7.95 4.24 0.00 3.87 3.77 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 0.00 129 T 8.48 4.46 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 1.25 0.00 0.00 130 H 7.99 4.73 0.00 3.16 3.22 0.00 5.77 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.21 4.13 0.00 3.78 3.76 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 0.00 0.00 0.00 0.00 132 G 9.49 3.84 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 0.00 0.00 0.00 133 A 7.78 4.28 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 0.00 134 D 8.65 4.55 0.00 2.56 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.45 4.72 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 1.11 0.00 0.00 1.07 0.00 0.00 136 L 9.18 5.29 0.00 1.59 1.64 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 137 S 8.93 5.20 0.00 4.19 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 0.00 138 A 8.85 5.18 1.22 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 0.00 0.00 139 S 8.53 4.24 0.00 3.78 3.88 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 0.00 140 A 8.67 4.48 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 0.00 141 K 8.88 4.43 0.00 1.85 1.80 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.58 7.81 142 T 8.30 3.33 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 1.13 0.00 0.00 143 A 8.16 4.37 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 0.00 144 D 8.60 4.14 0.00 2.92 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 0.00 145 N 8.03 4.53 0.00 2.51 2.88 0.00 0.00 6.07 7.44 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 0.00 146 Q 8.09 5.05 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.01 0.00 147 K 7.21 4.85 0.00 1.37 1.17 0.00 0.84 0.00 0.00 1.06 0.00 0.00 2.62 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.07 1.30 7.81 148 W 8.88 5.41 0.00 2.99 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 0.00 149 Y 9.07 5.20 0.00 2.90 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 F 9.09 5.00 0.00 2.74 2.36 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 0.00 151 D 9.08 5.25 0.00 2.73 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.52 4.74 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 0.00 153 K 8.73 4.14 0.00 1.76 1.72 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81